*HEADER    HORMONE/GROWTH FACTOR/TRANSFERASE       27-SEP-02   1MW4              
*TITLE     SOLUTION STRUCTURE OF THE HUMAN GRB7-SH2 DOMAIN IN COMPLEX            
*TITLE    2 WITH A 10 AMINO ACID PEPTIDE PY1139                                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: GROWTH FACTOR RECEPTOR-BOUND PROTEIN 7;                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SH2 DOMAIN;                                                
*COMPND   5 SYNONYM: GRB7 ADAPTER PROTEIN, EPIDERMAL GROWTH FACTOR               
*COMPND   6 RECEPTOR GRB-7, B47;                                                 
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 MOL_ID: 2;                                                           
*COMPND   9 MOLECULE: RECEPTOR PROTEIN-TYROSINE KINASE ERBB-2;                   
*COMPND  10 CHAIN: B;                                                            
*COMPND  11 FRAGMENT: SH2 DOMAIN BINDING SITE;                                   
*COMPND  12 SYNONYM: PY1139, NEU PROTO-ONCOGENE, C-ERBB-2, TYROSINE              
*COMPND  13 KINASE-TYPE CELL SURFACE RECEPTOR HER2, MLN 19;                      
*COMPND  14 EC: 2.7.1.112;                                                       
*COMPND  15 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3) PLYSS;                          
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PGEX2T;                                   
*SOURCE   9 MOL_ID: 2;                                                           
*SOURCE  10 SYNTHETIC: YES;                                                      
*SOURCE  11 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE  12 SEQUENCE OF THE PEPTIDE IS NATURALLY FOUND IN HOMO SAPIENS           
*SOURCE  13 (HUMAN).                                                             
*KEYWDS    SH2 DOMAIN IN COMPLEX WITH A LIGAND                                   
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    M.IVANCIC, B.A.LYONS                                                  
*REVDAT   1   09-SEP-03 1MW4    0                                                

!remark phi angle constraints

  !!    g1
 assign (resid  1  and name c ) (resid  2  and name n ) 
        (resid  2  and name ca) (resid  2  and name c )   1.0  0.0 180.0 2
  !!    s2
 assign (resid  1  and name c ) (resid  2  and name n ) 
        (resid  2  and name ca) (resid  2  and name c )   1.0  -90.0 60.0 2
  !!    p3
 assign (resid  2  and name c ) (resid  3  and name n ) 
        (resid  3  and name ca) (resid  3  and name c )   1.0  -90.0 60.0 2
  !!    a4
 assign (resid  3  and name c ) (resid  4  and name n ) 
        (resid  4  and name ca) (resid  4  and name c )   1.0  -90.0 60.0 2
  !!    s5
 assign (resid  4  and name c ) (resid  5  and name n ) 
        (resid  5  and name ca) (resid  5  and name c )   1.0  -90.0 60.0 2
  !!    g6
 assign (resid  5  and name c ) (resid  6  and name n ) 
        (resid  6  and name ca) (resid  6  and name c )   1.0  0.0 180.0 2
  !!    t7
 assign (resid  6  and name c ) (resid  7  and name n ) 
        (resid  7  and name ca) (resid  7  and name c )  1.0 -90.0 60.0 2
  !!    s8
 assign (resid  7  and name c ) (resid  8  and name n ) 
        (resid  8  and name ca) (resid  8  and name c )   1.0  -90.0 60.0 2
  !!    l9
 assign (resid  8  and name c ) (resid  9  and name n ) 
        (resid  9  and name ca) (resid  9  and name c )   1.0  -90.0 60.0 2
  !!    s10
 assign (resid  9  and name c ) (resid 10 and name n ) 
        (resid  10 and name ca) (resid 10 and name c )   1.0  -90.0 60.0 2
  !!    a11
 assign (resid 10 and name c ) (resid 11 and name n ) 
        (resid 11 and name ca) (resid 11 and name c )   1.0  -90.0 60.0 2
  !!    a12
 assign (resid 11 and name c ) (resid 12 and name n ) 
        (resid 12 and name ca) (resid 12 and name c )   1.0  -90.0 60.0 2
  !!    i13
 assign (resid 12 and name c ) (resid 13 and name n ) 
        (resid 13 and name ca) (resid 13 and name c )   1.0  -60.0 20.0 2
  !!    h14
 assign (resid 13 and name c ) (resid 14 and name n ) 
        (resid 14 and name ca) (resid 14 and name c )   1.0  -90.0 60.0 2
  !!    r15
 assign (resid 14 and name c ) (resid 15 and name n ) 
        (resid 15 and name ca) (resid 15 and name c )   1.0  -120.0 20.0 2
  !!    t16
 assign (resid 15 and name c ) (resid 16 and name n ) 
        (resid 16 and name ca) (resid 16 and name c )   1.0  -120.0 20.0 2
  !!    q17
 assign (resid 16 and name c ) (resid 17 and name n ) 
        (resid 17 and name ca) (resid 17 and name c )   1.0  -90.0 60.0 2
  !!    l18
 assign (resid 17 and name c ) (resid 18 and name n ) 
        (resid 18 and name ca) (resid 18 and name c )   1.0  -90.0 60.0 2
  !!    w19
 assign (resid 18 and name c ) (resid 19 and name n ) 
        (resid 19 and name ca) (resid 19 and name c )   1.0  -120.0 20.0 2
  !!    f20
 assign (resid 19 and name c ) (resid 20 and name n ) 
        (resid 20 and name ca) (resid 20 and name c )   1.0  -90.0 60.0 2
  !!    h21
 assign (resid 20 and name c ) (resid 21 and name n ) 
        (resid 21 and name ca) (resid 21 and name c )   1.0  -120.0 20.0 2
  !!    g22
 assign (resid 21 and name c ) (resid 22 and name n ) 
        (resid 22 and name ca) (resid 22 and name c )   1.0  -120.0 20.0 2
  !!    r23
 assign (resid 22 and name c ) (resid 23 and name n ) 
        (resid 23 and name ca) (resid 23 and name c )   1.0  -90.0 60.0 2
  !!    i24
 assign (resid 23 and name c ) (resid 24 and name n ) 
        (resid 24 and name ca) (resid 24 and name c )   1.0  -95.0 60.0 2
  !!    s25
 assign (resid 24 and name c ) (resid 25 and name n ) 
        (resid 25 and name ca) (resid 25 and name c )   1.0  -95.0 60.0 2
  !!    r26
 assign (resid 25 and name c ) (resid 26 and name n ) 
        (resid 26 and name ca) (resid 26 and name c )   1.0  -90.0 60.0 2
  !!    e27
 assign (resid 26 and name c ) (resid 27 and name n ) 
        (resid 27 and name ca) (resid 27 and name c )   1.0  -60.0 20.0 2
  !!    e28
 assign (resid 27 and name c ) (resid 28 and name n ) 
        (resid 28 and name ca) (resid 28 and name c )  1.0 -60.0 20.0 2
  !!    s29
 assign (resid 28 and name c ) (resid 29 and name n ) 
        (resid 29 and name ca) (resid 29 and name c )  1.0 -90.0 60.0 2
  !!    q30
 assign (resid 29 and name c ) (resid 30 and name n ) 
        (resid 30 and name ca) (resid 30 and name c )  1.0 -60.0 20.0 2
  !!    r31
 assign (resid 30 and name c ) (resid 31 and name n ) 
        (resid 31 and name ca) (resid 31 and name c )  1.0 -60.0 20.0 2
  !!    l32
 assign (resid 31 and name c ) (resid 32 and name n ) 
        (resid 32 and name ca) (resid 32 and name c )  1.0 -90.0 60.0 2
  !!    i33
 assign (resid 32 and name c ) (resid 33 and name n ) 
        (resid 33 and name ca) (resid 33 and name c )  1.0 -60.0 20.0 2
  !!    g34
 assign (resid 33 and name c ) (resid 34 and name n ) 
        (resid 34 and name ca) (resid 34 and name c )  1.0 -120.0 20.0 2
  !!    q35
 assign (resid 34 and name c ) (resid 35 and name n ) 
        (resid 35 and name ca) (resid 35 and name c )  1.0 -90.0 60.0 2
  !!    q36
 assign (resid 35 and name c ) (resid 36 and name n ) 
        (resid 36 and name ca) (resid 36 and name c )  1.0 -90.0 60.0 2
  !!    g37
 assign (resid 36 and name c ) (resid 37 and name n ) 
        (resid 37 and name ca) (resid 37 and name c )  1.0 -120.0 20.0 2
  !!    l38
 assign (resid 37 and name c ) (resid 38 and name n ) 
        (resid 38 and name ca) (resid 38 and name c )  1.0 -60.0 20.0 2
  !!    v39
 assign (resid 38 and name c ) (resid 39 and name n ) 
        (resid 39 and name ca) (resid 39 and name c )  1.0 -60.0 20.0 2
  !!    d40
 assign (resid 39 and name c ) (resid 40 and name n ) 
        (resid 40 and name ca) (resid 40 and name c )  1.0 -90.0 60.0 2
  !!    g41
 assign (resid 40 and name c ) (resid 41 and name n ) 
        (resid 41 and name ca) (resid 41 and name c )  1.0 -120.0 20.0 2
  !!    l42
 assign (resid 41 and name c ) (resid 42 and name n ) 
        (resid 42 and name ca) (resid 42 and name c )  1.0 -120.0 20.0 2
  !!    f43
 assign (resid 42 and name c ) (resid 43 and name n ) 
        (resid 43 and name ca) (resid 43 and name c )  1.0 -120.0 20.0 2
  !!    l44
 assign (resid 43 and name c ) (resid 44 and name n ) 
        (resid 44 and name ca) (resid 44 and name c )  1.0 -120.0 20.0 2
  !!    v45
 assign (resid 44 and name c ) (resid 45 and name n ) 
        (resid 45 and name ca) (resid 45 and name c )  1.0 -120.0 20.0 2
  !!    r46
 assign (resid 45 and name c ) (resid 46 and name n ) 
        (resid 46 and name ca) (resid 46 and name c )  1.0 -120.0 20.0 2
  !!    e47
 assign (resid 46 and name c ) (resid 47 and name n ) 
        (resid 47 and name ca) (resid 47 and name c )  1.0 -120.0 20.0 2
  !!    s48
 assign (resid 47 and name c ) (resid 48 and name n ) 
        (resid 48 and name ca) (resid 48 and name c )   1.0  -120.0 20.0 2
  !!    q49
 assign (resid 48 and name c ) (resid 49 and name n ) 
        (resid 49 and name ca) (resid 49 and name c )   1.0  -120.0 20.0 2
  !!    r50
 assign (resid 49 and name c ) (resid 50 and name n ) 
        (resid 50 and name ca) (resid 50 and name c )   1.0  -120.0 20.0 2
  !!    n51
 assign (resid 50 and name c ) (resid 51 and name n ) 
        (resid 51 and name ca) (resid 51 and name c )   1.0  -60.0 20.0 2
  !!    p52
 assign (resid 51 and name c ) (resid 52 and name n ) 
        (resid 52 and name ca) (resid 52 and name c )   1.0  -90.0 60.0 2
  !!    q53
 assign (resid 52 and name c ) (resid 53 and name n ) 
        (resid 53 and name ca) (resid 53 and name c )   1.0  -90.0 60.0 2
  !!    g54
 assign (resid 53 and name c ) (resid 54 and name n ) 
        (resid 54 and name ca) (resid 54 and name c )   1.0  -120.0 20.0 2
  !!    f55
 assign (resid 54 and name c ) (resid 55 and name n ) 
        (resid 55 and name ca) (resid 55 and name c )   1.0  -120.0 20.0 2
  !!    v56
 assign (resid 55 and name c ) (resid 56 and name n ) 
        (resid 56 and name ca) (resid 56 and name c )   1.0  -120.0 20.0 2
  !!    l57
 assign (resid 56 and name c ) (resid 57 and name n ) 
        (resid 57 and name ca) (resid 57 and name c )   1.0  -120.0 20.0 2
  !!    s58
 assign (resid 57 and name c ) (resid 58 and name n ) 
        (resid 58 and name ca) (resid 58 and name c )   1.0  -120.0 20.0 2
  !!    l59
 assign (resid 58 and name c ) (resid 59 and name n ) 
        (resid 59 and name ca) (resid 59 and name c )   1.0  -120.0 20.0 2
  !!    c60
 assign (resid 59 and name c ) (resid 60 and name n ) 
        (resid 60 and name ca) (resid 60 and name c )   1.0  -120.0 20.0 2
  !!    h61
 assign (resid 60 and name c ) (resid 61 and name n ) 
        (resid 61 and name ca) (resid 61 and name c )   1.0  -90.0 60.0 2
  !!    l62
 assign (resid 61 and name c ) (resid 62 and name n ) 
        (resid 62 and name ca) (resid 62 and name c )   1.0  -120.0 20.0 2
  !!    q63
 assign (resid 62 and name c ) (resid 63 and name n ) 
        (resid 63 and name ca) (resid 63 and name c )   1.0  -90.0 60.0 2
  !!    k64
 assign (resid 63 and name c ) (resid 64 and name n ) 
        (resid 64 and name ca) (resid 64 and name c )   1.0 -90.0 60.0 2
  !!    v65
 assign (resid 64 and name c ) (resid 65 and name n ) 
        (resid 65 and name ca) (resid 65 and name c )   1.0  -120.0 20.0 2
  !!    k66
 assign (resid 65 and name c ) (resid 66 and name n ) 
        (resid 66 and name ca) (resid 66 and name c )   1.0 -120.0 20.0 2
  !!    h67
 assign (resid 66 and name c ) (resid 67 and name n ) 
        (resid 67 and name ca) (resid 67 and name c )   1.0 -120.0 20.0 2
  !!    y68
 assign (resid 67 and name c ) (resid 68 and name n ) 
        (resid 68 and name ca) (resid 68 and name c )   1.0 -120.0 20.0 2
  !!    l69
 assign (resid 68 and name c ) (resid 69 and name n ) 
        (resid 69 and name ca) (resid 69 and name c )   1.0  -120.0 20.0 2
  !!    i70
 assign (resid 69 and name c ) (resid 70 and name n ) 
        (resid 70 and name ca) (resid 70 and name c )   1.0 -120.0 20.0 2
  !!    l71
 assign (resid 70 and name c ) (resid 71 and name n ) 
        (resid 71 and name ca) (resid 71 and name c )   1.0  -120.0 20.0 2
  !!    p72
 assign (resid 71 and name c ) (resid 72 and name n ) 
        (resid 72 and name ca) (resid 72 and name c )   1.0  -90.0 60.0 2
  !!    s73
 assign (resid 72 and name c ) (resid 73 and name n ) 
        (resid 73 and name ca) (resid 73 and name c )  1.0 -90.0 60.0 2
  !!    e74
 assign (resid 73 and name c ) (resid 74 and name n )
        (resid 74 and name ca) (resid 74 and name c )  1.0 -120.0 20.0 2
  !!    e75
 assign (resid 74 and name c ) (resid 75 and name n )
        (resid 75 and name ca) (resid 75 and name c )  1.0 -120.0 20.0 2
  !!    e76
 assign (resid 75 and name c ) (resid 76 and name n ) 
        (resid 76 and name ca) (resid 76 and name c )   1.0 -120.0 20.0 2
  !!    g77
 assign (resid 76 and name c ) (resid 77 and name n ) 
        (resid 77 and name ca) (resid 77 and name c )   1.0  0.0 180.0 2
  !!    r78
 assign (resid 77 and name c ) (resid 78 and name n ) 
        (resid 78 and name ca) (resid 78 and name c )   1.0  -90.0 60.0 2
  !!    l79
 assign (resid 78 and name c ) (resid 79 and name n ) 
        (resid 79 and name ca) (resid 79 and name c )   1.0  -60.0 20.0 2
  !!    y80
 assign (resid 79 and name c ) (resid 80 and name n ) 
        (resid 80 and name ca) (resid 80 and name c )   1.0  -90.0 60.0 2
  !!    f81
 assign (resid 80 and name c ) (resid 81 and name n ) 
        (resid 81 and name ca) (resid 81 and name c )   1.0 -90.0 60.0 2
  !!    s2
 assign (resid 81 and name c ) (resid 82 and name n ) 
        (resid 82 and name ca) (resid 82 and name c )   1.0 -90.0 60.0 2
  !!    m83
 assign (resid 82 and name c ) (resid 83 and name n ) 
        (resid 83 and name ca) (resid 83 and name c )   1.0 -90.0 60.0 2
  !!    d84
 assign (resid 83 and name c ) (resid 84 and name n ) 
        (resid 84 and name ca) (resid 84 and name c )   1.0  -90.0 60.0 2
  !!    d85
 assign (resid 84 and name c ) (resid 85 and name n ) 
        (resid 85 and name ca) (resid 85 and name c )   1.0  -120.0 20.0 2
  !!    g86
 assign (resid 85 and name c ) (resid 86 and name n ) 
        (resid 86 and name ca) (resid 86 and name c )   1.0  -120.0 20.0 2
  !!    q87
 assign (resid 86 and name c ) (resid 87 and name n )
        (resid 87 and name ca) (resid 87 and name c )   1.0 -120.0 20.0 2
  !!    t88
 assign (resid 87 and name c ) (resid 88 and name n ) 
        (resid 88 and name ca) (resid 88 and name c )   1.0 -90.0 60.0 2
  !!    r89
 assign (resid 88 and name c ) (resid 89 and name n )
        (resid 89 and name ca) (resid 89 and name c )   1.0 -60.0 20.0 2
  !!    f90
 assign (resid 89 and name c ) (resid 90 and name n ) 
        (resid 90 and name ca) (resid 90 and name c )   1.0 -120.0 20.0 2
  !!    t91
 assign (resid 90 and name c ) (resid 91 and name n ) 
        (resid 91 and name ca) (resid 91 and name c )   1.0 -60.0 20.0 2
  !!    d92
 assign (resid 91 and name c ) (resid 92 and name n ) 
        (resid 92 and name ca) (resid 92 and name c )   1.0  -90.0 60.0 2
  !!    l93
 assign (resid 92 and name c ) (resid 93 and name n ) 
        (resid 93 and name ca) (resid 93 and name c )   1.0 -60.0 20.0 2
  !!    l94
 assign (resid 93 and name c ) (resid 94 and name n ) 
        (resid 94 and name ca) (resid 94 and name c )   1.0 -60.0 20.0 2
  !!    q95
 assign (resid 94 and name c ) (resid 95 and name n ) 
        (resid 95 and name ca) (resid 95 and name c )   1.0 -90.0 60.0 2
  !!    l96
 assign (resid 95 and name c ) (resid 96 and name n ) 
        (resid 96 and name ca) (resid 96 and name c )   1.0  -60.0 20.0 2
  !!    v97
 assign (resid 96 and name c ) (resid 97 and name n ) 
        (resid 97 and name ca) (resid 97 and name c )   1.0 -60.0 20.0 2
  !!    e98
 assign (resid 97 and name c ) (resid 98 and name n ) 
        (resid 98 and name ca) (resid 98 and name c )   1.0 -60.0 20.0 2
  !!    f99
 assign (resid 98 and name c ) (resid 99 and name n ) 
        (resid 99 and name ca) (resid 99 and name c )   1.0 -60.0 20.0 2
  !!    h100
 assign (resid 99 and name c ) (resid 100 and name n ) 
        (resid 100 and name ca) (resid 100 and name c )   1.0 -60.0 20.0 2
  !!    q101
 assign (resid 100 and name c ) (resid 101 and name n ) 
        (resid 101 and name ca) (resid 101 and name c )   1.0  -60.0 20.0 2
  !!    l102
 assign (resid 101 and name c ) (resid 102 and name n ) 
        (resid 102 and name ca) (resid 102 and name c )   1.0 -90.0 60.0 2
  !!    n103
 assign (resid 102 and name c ) (resid 103 and name n ) 
        (resid 103 and name ca) (resid 103 and name c )   1.0 -90.0 60.0 2
  !!    r104
 assign (resid 103 and name c ) (resid 104 and name n ) 
        (resid 104 and name ca) (resid 104 and name c )   1.0 -90.0 60.0 2
  !!    g105
 assign (resid 104 and name c ) (resid 105 and name n ) 
        (resid 105 and name ca) (resid 105 and name c )   1.0  0.0 180.0 2
  !!    i106
 assign (resid 105 and name c ) (resid 106 and name n ) 
        (resid 106 and name ca) (resid 106 and name c )   1.0 -90.0 60.0 2
  !!    l107
 assign (resid 106 and name c ) (resid 107 and name n ) 
        (resid 107 and name ca) (resid 107 and name c )   1.0  -90.0 60.0 2
  !!    p108
 assign (resid 107 and name c ) (resid 108 and name n ) 
        (resid 108 and name ca) (resid 108 and name c )   1.0 -90.0 60.0 2
  !!    c109
 assign (resid 108 and name c ) (resid 109 and name n ) 
        (resid 109 and name ca) (resid 109 and name c )   1.0 -90.0 60.0 2
  !!    l110
 assign (resid 109 and name c ) (resid 110 and name n ) 
        (resid 110 and name ca) (resid 110 and name c )   1.0 -90.0 60.0 2
  !!    l111
 assign (resid 110 and name c ) (resid 111 and name n ) 
        (resid 111 and name ca) (resid 111 and name c )   1.0  -90.0 60.0 2
  !!    r112
 assign (resid 111 and name c ) (resid 112 and name n ) 
        (resid 112 and name ca) (resid 112 and name c )   1.0 -90.0 60.0 2
  !!    h113
 assign (resid 112 and name c ) (resid 113 and name n ) 
        (resid 113 and name ca) (resid 113 and name c )   1.0 -90.0 60.0 2
  !!    c114
 assign (resid 113 and name c ) (resid 114 and name n ) 
        (resid 114 and name ca) (resid 114 and name c )   1.0 -120.0 20.0 2
  !!    c115
 assign (resid 114 and name c ) (resid 115 and name n ) 
        (resid 115 and name ca) (resid 115 and name c )   1.0 -120.0 20.0 2
  !!    t116
 assign (resid 115 and name c ) (resid 116 and name n ) 
        (resid 116 and name ca) (resid 116 and name c )   1.0  -120.0 20.0 2
  !!    r117
 assign (resid 116 and name c ) (resid 117 and name n ) 
        (resid 117 and name ca) (resid 117 and name c )   1.0 -90.0 60.0 2
  !!    v118
 assign (resid 117 and name c ) (resid 118 and name n ) 
        (resid 118 and name ca) (resid 118 and name c )   1.0 -90.0 60.0 2
  !!    a119
 assign (resid 118 and name c ) (resid 119 and name n ) 
        (resid 119 and name ca) (resid 119 and name c )   1.0 -60.0 20.0 2
  !!    l120
 assign (resid 119 and name c ) (resid 120 and name n ) 
        (resid 120 and name ca) (resid 120 and name c )   1.0  -90.0 60.0 2




! residue 1    Gly , intraresidue NOEs

! residue 1    Gly , NOEs forward in sequence

! residue 2    Ser , intraresidue NOEs

! residue 2    Ser , NOEs forward in sequence

! residue 3    Pro , intraresidue NOEs

! residue 3    Pro , NOEs forward in sequence

! residue 4    Ala , intraresidue NOEs
assi (resi 4    and name HN  ) (resi 4    and name HA  )  2.50  0.70  0.80
assi (resi 4    and name HN  ) (resi 4    and name HB# )  4.00  2.20  1.80

! residue 4    Ala , NOEs forward in sequence

! residue 5    Ser , intraresidue NOEs

! residue 5    Ser , NOEs forward in sequence

! residue 6    Gly , intraresidue NOEs
! trivial: assi (resi 6    and name HN  ) (resi 6    and name HA1 )  4.00  2.20  0.80
! trivial: assi (resi 6    and name HN  ) (resi 6    and name HA2 )  4.00  2.20  0.80

! residue 6    Gly , NOEs forward in sequence
assi (resi 6    and name HA1 ) (resi 7    and name HN  )  3.00  1.20  0.80

! residue 7    Thr , intraresidue NOEs
assi (resi 7    and name HN  ) (resi 7    and name HA  )  3.00  1.20  0.80

! residue 7    Thr , NOEs forward in sequence

! residue 8    Ser , intraresidue NOEs
assi (resi 8    and name HN  ) (resi 8    and name HA  )  3.00  1.20  0.80
assi (resi 8    and name HN  ) (resi 8    and name HB# )  3.00  1.20  1.60

! residue 8    Ser , NOEs forward in sequence
assi (resi 8    and name HA  ) (resi 9    and name HN  )  2.50  0.70  0.80

! residue 9    Leu , intraresidue NOEs
assi (resi 9    and name HN  ) (resi 9    and name HA  )  2.50  0.70  0.80

! residue 9    Leu , NOEs forward in sequence
assi (resi 9    and name HA  ) (resi 10   and name HN  )  2.50  0.70  0.80

! residue 10   Ser , intraresidue NOEs
assi (resi 10   and name HN  ) (resi 10   and name HA  )  2.50  0.70  0.80

! residue 10   Ser , NOEs forward in sequence
assi (resi 10   and name HA  ) (resi 11   and name HN  )  2.50  0.70  0.80
assi (resi 10   and name HB# ) (resi 11   and name HN  )  4.00  2.20  1.80

! residue 11   Ala , intraresidue NOEs
assi (resi 11   and name HN  ) (resi 11   and name HA  )  2.50  0.70  0.80

! residue 11   Ala , NOEs forward in sequence
assi (resi 11   and name HB# ) (resi 12   and name HN  )  4.00  2.20  1.80

! residue 12   Ala , intraresidue NOEs
assi (resi 12   and name HN  ) (resi 12   and name HA  )  2.50  0.70  0.80

! residue 12   Ala , NOEs forward in sequence
assi (resi 12   and name HA  ) (resi 13   and name HN  )  2.50  0.70  0.80
assi (resi 12   and name HB# ) (resi 13   and name HN  )  4.00  2.20  1.80

! residue 13   Ile , intraresidue NOEs
assi (resi 13   and name HN  ) (resi 13   and name HA  )  2.50  0.70  0.80
assi (resi 13   and name HN  ) (resi 13   and name HG2#)  4.00  2.20  1.60
assi (resi 13   and name HN  ) (resi 13   and name HD1#)  4.00  2.20  1.80

! residue 13   Ile , NOEs forward in sequence

! residue 14   His , intraresidue NOEs
! trivial: assi (resi 14   and name HN  ) (resi 14   and name HA  )  4.00  2.20  0.80
assi (resi 14   and name HN  ) (resi 14   and name HD2 )  4.00  2.20  1.80
assi (resi 14   and name HN  ) (resi 14   and name HE1 )  4.00  2.20  0.80
assi (resi 14   and name HN  ) (resi 14   and name HB# )  4.00  2.20  1.80

! residue 14   His , NOEs forward in sequence
assi (resi 14   and name HN  ) (resi 15   and name HN  )  4.00  2.20  0.80
assi (resi 14   and name HD2 ) (resi 15   and name HN  )  4.50  2.20  0.80
assi (resi 14   and name HB# ) (resi 15   and name HN  )  3.00  2.20  1.80
assi (resi 14   and name HA ) (resi 15   and name HN  )  2.00  0.20  0.80
assi (resi 14   and name HB# ) (resi 16   and name HN  )  4.50  2.20  1.80
assi (resi 14   and name HA ) (resi 16   and name HN  )  4.00  2.20  0.80


! residue 15   Arg , intraresidue NOEs, Nnoesy
assi (resi 15   and name HN  ) (resi 15   and name HA  )  2.50  0.70  0.80
assi (resi 15   and name HN  ) (resi 15   and name HB# )  4.00  2.20  1.80
assi (resi 15   and name HN  ) (resi 15   and name HG# )  3.00  0.70  1.80
assi (resi 15   and name HN  ) (resi 15   and name HD# )  4.00  0.70  1.80

! residue 15   Arg , NOEs forward in sequence, Nnoesy
assi (resi 15   and name HA  ) (resi 16   and name HN  )  2.00  0.20  0.80
assi (resi 15   and name HN  ) (resi 16   and name HA  )  4.50  2.20  0.80
assi (resi 15   and name HN  ) (resi 16   and name HG2#  )  5.00  3.20  1.60
assi (resi 15   and name HN  ) (resi 18   and name HD2#  )  3.00  2.20  1.80
assi (resi 15   and name HG#  ) (resi 18   and name HN  )  4.50  2.20  1.80
assi (resi 15   and name HN  ) (resi 18   and name HN  )  5.00  3.20  0.80

! residue 15   Arg , intraresidue NOEs, Cnoesy
assi (resi 15   and name HN  ) (resi 15   and name HG#  )  3.00  0.70  1.80
assi (resi 15   and name HD#  ) (resi 15   and name HB#  )  4.00  0.70  2.80
assi (resi 15   and name HD#  ) (resi 15   and name HG#  )  2.50  0.70  2.80

! residue 15   Arg , NOEs forward in sequence, Cnoesy
assi (resi 15   and name HN  ) (resi 16   and name HA  )  4.50  2.20  0.80
assi (resi 15   and name HE  ) (resi 16   and name HG2#  )  2.50  0.70  1.60
assi (resi 15   and name HG#  ) (resi 18   and name HB#  )  4.00  2.20  2.80
assi (resi 15   and name HG#  ) (resi 16   and name HG2#  )  2.00  0.20  2.60
assi (resi 15   and name HD#  ) (resi 16   and name HG2#  )  4.00  2.20  2.60
assi (resi 15   and name HG#  ) (resi 18   and name HD2#  )  4.50  2.20  2.80
assi (resi 15   and name HA  ) (resi 16   and name HN  )  4.00  2.20  0.80
assi (resi 15   and name HB#  ) (resi 16   and name HN  )  4.00  2.20  1.80
assi (resi 15   and name HG#  ) (resi 16   and name HN  )  2.00  0.20  1.80
assi (resi 15   and name HN  ) (resi 16   and name HN  )  2.00  0.20  0.80

! residue 16   Thr , intraresidue NOEs, Nnoesy
assi (resi 16   and name HN  ) (resi 16   and name HA  )  3.00  1.20  0.80
assi (resi 16   and name HN  ) (resi 16   and name HB  )  4.00  2.20  0.80
assi (resi 16   and name HN  ) (resi 16   and name HG2#  )  3.50  1.70  1.60

! residue 16   Thr , NOEs forward in sequence, Nnoesy
assi (resi 16   and name HN  ) (resi 17   and name HN  )  4.00  2.20  0.80
assi (resi 16   and name HN  ) (resi 18   and name HB#  )  4.00  2.20  1.80
assi (resi 16   and name HA  ) (resi 17   and name HN  )  3.00  1.20  0.80
assi (resi 16   and name HN  ) (resi 18   and name HD2#  )  3.50  1.70  1.60
assi (resi 16   and name HB  ) (resi 17   and name HN  )  2.00  0.20  0.80
assi (resi 16   and name HG2#  ) (resi 17   and name HN  )  4.50  2.70  1.60
assi (resi 16   and name HN  ) (resi 18   and name HB#  )  4.00  2.20  1.80
assi (resi 16   and name HB  ) (resi 18   and name HN  )  4.00  2.20  0.80
assi (resi 16   and name HA  ) (resi 18   and name HN  )  4.50  2.70  0.80

! residue 16   Thr , intraresidue NOEs, Cnoesy
assi (resi 16   and name HN  ) (resi 16   and name HA  )  3.00  1.20  0.80

! residue 16   Thr , NOEs forward in sequence, Cnoesy
assi (resi 16   and name HN  ) (resi 18   and name HD2#  )  3.50  1.70  1.60
assi (resi 16   and name HA  ) (resi 17   and name HQ#  )  4.50  2.70  1.80
assi (resi 16   and name HA  ) (resi 17   and name HB#  )  5.00  3.20  1.80
assi (resi 16   and name HA  ) (resi 17   and name HG#  )  4.50  2.70  1.80
assi (resi 16   and name HA  ) (resi 17   and name HN  )  3.00  1.20  0.80
assi (resi 16   and name HB  ) (resi 17   and name HB#  )  4.50  2.70  1.80

! residue 17   Gln , intraresidue NOEs, Nnoesy
assi (resi 17   and name HE21  ) (resi 17   and name HB#  )  4.50  0.70  1.80
assi (resi 17   and name HG#  ) (resi 17   and name HE21  )  2.00  0.70  1.80
assi (resi 17   and name HG#  ) (resi 17   and name HE22  )  3.50  0.70  1.80
assi (resi 17   and name HG#  ) (resi 17   and name HN  )  2.00  0.70  1.80
assi (resi 17   and name HB#  ) (resi 17   and name HN  )  3.00  0.70  1.80
assi (resi 17   and name HA  ) (resi 17   and name HN  )  3.00  0.70  0.80
assi (resi 17   and name HN  ) (resi 17   and name HE21  )  2.50  0.70  0.80

! residue 17   Gln , NOEs forward in sequence, Nnoesy
assi (resi 17   and name HN  ) (resi 18   and name HA  )  4.50  2.20  0.80
assi (resi 17   and name HN  ) (resi 18   and name HB#  )  4.50  2.20  1.80
assi (resi 17   and name HE22  ) (resi 18   and name HB#  )  5.00  3.20  1.80
assi (resi 17   and name HN  ) (resi 18   and name HN  )  3.00  2.20  0.80
assi (resi 17   and name HG#  ) (resi 18   and name HN  )  4.50  2.20  1.80
assi (resi 17   and name HB#  ) (resi 18   and name HN  )  4.50  2.20  1.80
assi (resi 17   and name HA  ) (resi 18   and name HN  )  3.00  2.20  0.80
assi (resi 17   and name HE22  ) (resi 18   and name HN  )  4.50  2.20  0.80
assi (resi 17   and name HE21  ) (resi 18   and name HN  )  4.00  2.20  0.80

! residue 17   Gln , intraresidue NOEs, Cnoesy
assi (resi 17   and name HE21  ) (resi 17   and name HG#  )  2.00  0.20  1.80
assi (resi 17   and name HE22  ) (resi 17   and name HG#  )  3.50  1.70  1.80
assi (resi 17   and name HA  ) (resi 17   and name HB#  )  2.50  0.70  1.80
assi (resi 17   and name HG#  ) (resi 17   and name HB#  )  2.50  0.70  2.80

! residue 17   Gln , NOEs forward in sequence, Cnoesy
assi (resi 17   and name HB#  ) (resi 18   and name HN  )  4.50  2.70  1.80

! residue 18   Leu , intraresidue NOEs, Nnoesy
assi (resi 18   and name HD2#  ) (resi 18   and name HN  )  3.50  1.70  1.60
assi (resi 18   and name HD1#  ) (resi 18   and name HN  )  4.50  2.70  1.60
assi (resi 18   and name HB#  ) (resi 18   and name HN  )  2.50  0.70  1.80
assi (resi 18   and name HB#  ) (resi 18   and name HN  )  2.50  0.70  1.80
assi (resi 18   and name HA  ) (resi 18   and name HN  )  3.00  1.20  0.80

! residue 18   Leu , NOEs forward in sequence, Nnoesy
assi (resi 18   and name HN  ) (resi 19   and name HN  )  4.50  2.70  0.80
assi (resi 18   and name HA  ) (resi 19   and name HN  )  2.50  0.70  0.80
assi (resi 18   and name HD#  ) (resi 19   and name HN  )  5.00  3.20  3.20

! residue 18   Leu , intraresidue NOEs, Cnoesy

! residue 18   Leu , NOEs forward in sequence, Cnoesy
assi (resi 18   and name HD#  ) (resi 20   and name HB#  )  4.50  2.70  3.20

! residue 19   Trp , intraresidue NOEs, Nnoesy
assi (resi 19   and name HA  ) (resi 19   and name HN  )  3.00  1.20  0.80
assi (resi 19   and name HB#  ) (resi 19   and name HN  )  3.50  1.70  1.60
assi (resi 19   and name HE1  ) (resi 19   and name HH2  )  5.00  3.20  0.80
assi (resi 19   and name HE1  ) (resi 19   and name HB#  )  5.00  3.20  1.80

! residue 19   Trp , NOEs forward in sequence, Nnoesy
assi (resi 19   and name HN  ) (resi 20   and name HN  )  3.00  1.20  0.80
assi (resi 19   and name HE1  ) (resi 115   and name HA  )  4.50  2.70  0.80
assi (resi 19   and name HA  ) (resi 44   and name HD1#  )  3.50  1.70  1.60

! residue 19   Trp , intraresidue NOEs, Cnoesy

! residue 19   Trp , NOEs forward in sequence, Cnoesy
assi (resi 19   and name HB#  ) (resi 43   and name HE#  )  5.00  3.20  2.80

! residue 20   Phe , intraresidue NOEs, Nnoesy
assi (resi 20   and name HB#  ) (resi 20   and name HN  )  4.00  2.20  1.80

! residue 20   Phe , NOEs forward in sequence, Nnoesy
assi (resi 20   and name HA  ) (resi 21   and name HN  )  2.00  0.20  0.80

! residue 20   Phe , intraresidue NOEs, Cnoesy

! residue 20   Phe , NOEs forward in sequence, Cnoesy
assi (resi 20   and name HA  ) (resi 44   and name HD2#  )  5.00  3.20  1.60
assi (resi 20   and name HA  ) (resi 44   and name HG  )  3.50  1.70  0.80
assi (resi 20   and name HB#  ) (resi 45   and name HB  )  3.50  1.70  1.80
assi (resi 20   and name HB#  ) (resi 21   and name HA  )  5.00  3.20  1.80
assi (resi 20   and name HD#  ) (resi 45   and name HG1#  )  4.00  2.20  3.60

! residue 21   His , intraresidue NOEs, Nnoesy
assi (resi 21   and name HN  ) (resi 21   and name HB#  )  2.50  0.70  1.80
assi (resi 21   and name HN  ) (resi 21   and name HA  )  3.00  1.20  0.80

! residue 21   His , NOEs forward in sequence, Nnoesy
assi (resi 21   and name HN  ) (resi 45   and name HG  )  3.00  1.20  0.80
assi (resi 21   and name HN  ) (resi 46   and name HB#  )  2.50  0.70  1.80
assi (resi 21   and name HA  ) (resi 22   and name HN  )  2.50  0.70  0.80

! residue 21   His , intraresidue NOEs, Cnoesy
assi (resi 21   and name HB1  ) (resi 21   and name HA  )  3.00  1.20  0.80

! residue 21   His , NOEs forward in sequence, Cnoesy
assi (resi 21   and name HB1  ) (resi 44   and name HG  )  4.00  2.20  0.80
assi (resi 21   and name HN  ) (resi 44   and name HD1#  )  5.00  3.20  1.60
assi (resi 21   and name HA  ) (resi 46   and name HA  )  5.00  3.20  0.80
assi (resi 21   and name HB#  ) (resi 46   and name HA  )  3.50  1.70  1.80
assi (resi 21   and name HB#  ) (resi 46   and name HB#  )  2.00  0.20  2.80

! residue 22   Gly , intraresidue NOEs, Nnoesy
assi (resi 22   and name HN  ) (resi 22   and name HA1  )  2.50  0.70  0.80
assi (resi 22   and name HN  ) (resi 22   and name HA2  )  3.00  1.20  0.80

! residue 22   Gly , NOEs forward in sequence, Nnoesy
assi (resi 22   and name HN  ) (resi 24   and name HB  )  5.00  3.20  0.80
assi (resi 22   and name HN  ) (resi 46   and name HB#  )  4.50  2.70  1.80
assi (resi 22   and name HA2  ) (resi 49   and name HN  )  4.00  2.20  0.80

! residue 22   Gly , intraresidue NOEs, Cnoesy

! residue 22   Gly , NOEs forward in sequence, Cnoesy
assi (resi 22   and name HA2  ) (resi 46   and name HA  )  4.00  2.20  0.80
assi (resi 22   and name HN  ) (resi 46   and name HB#  )  4.50  2.70  1.80
assi (resi 22   and name HN  ) (resi 49   and name HB#  )  4.00  2.20  1.80

! residue 23   Arg , intraresidue NOEs, Nnoesy
assi (resi 23   and name HN  ) (resi 23   and name HG#  )  4.50  2.70  1.80
assi (resi 23   and name HN  ) (resi 23   and name HB#  )  2.50  0.70  1.80
assi (resi 23   and name HN  ) (resi 23   and name HA  )  3.00  1.20  0.80
assi (resi 23   and name HN  ) (resi 23   and name HD#  )  5.00  3.20  1.80

! residue 23   Arg , NOEs forward in sequence, Nnoesy
assi (resi 23   and name HA  ) (resi 47   and name HN  )  5.00  3.20  0.80
assi (resi 23   and name HA  ) (resi 48   and name HN  )  4.50  2.70  0.80
assi (resi 23   and name HA  ) (resi 49   and name HN  )  3.00  1.20  0.80
assi (resi 23   and name HA  ) (resi 49   and name HE21  )  4.50  2.70  0.80
assi (resi 23   and name HD#  ) (resi 50   and name HB#  )  3.50  1.70  2.80
assi (resi 23   and name HD#  ) (resi 50   and name HN  )  4.50  2.70  1.80
assi (resi 23   and name HB#  ) (resi 50   and name HN  )  4.50  2.70  1.80
assi (resi 23   and name HA  ) (resi 50   and name HN  )  4.50  2.70  0.80

! residue 23   Arg , intraresidue NOEs, Cnoesy
assi (resi 23   and name HD#  ) (resi 23   and name HB#  )  3.00  1.20  2.80
assi (resi 23   and name HD#  ) (resi 23   and name HG#  )  2.50  0.70  2.80
assi (resi 23   and name HB#  ) (resi 23   and name HG#  )  3.00  1.20  2.80

! residue 23   Arg , NOEs forward in sequence, Cnoesy
assi (resi 23   and name HD#  ) (resi 50   and name HD#  )  5.00  3.20  2.80
assi (resi 23   and name HB#  ) (resi 48   and name HA  )  4.00  2.20  1.80
assi (resi 23   and name HB#  ) (resi 49   and name HB#  )  4.50  2.70  2.80
assi (resi 23   and name HA  ) (resi 24   and name HN  )  2.00  0.20  0.80
assi (resi 23   and name HD#  ) (resi 48   and name HA  )  5.00  3.20  1.80
assi (resi 23   and name HG#  ) (resi 49   and name HN  )  4.00  2.20  1.80
assi (resi 23   and name HG#  ) (resi 49   and name HG#  )  4.50  2.70  2.80
assi (resi 23   and name HD#  ) (resi 50   and name HB#  )  5.00  3.20  2.80

! residue 24   Ile , intraresidue NOEs, Nnoesy
assi (resi 24   and name HA  ) (resi 24   and name HN  )  3.00  1.20  0.80
assi (resi 24   and name HB  ) (resi 24   and name HN  )  3.50  1.70  0.80

! residue 24   Ile , NOEs forward in sequence, Nnoesy
assi (resi 24   and name HB  ) (resi 25   and name HN  )  4.00  2.20  0.80
assi (resi 24   and name HG1#  ) (resi 25   and name HN  )  3.00  1.20  1.60

! residue 24   Ile , intraresidue NOEs, Cnoesy
assi (resi 24   and name HB  ) (resi 24   and name HD1#  )  4.00  2.20  1.60
assi (resi 24   and name HB  ) (resi 24   and name HG2#  )  2.50  0.70  1.60

! residue 24   Ile , NOEs forward in sequence, Cnoesy
assi (resi 24   and name HG2#  ) (resi 46   and name HB#  )  3.50  1.70  2.60
assi (resi 24   and name HG2#  ) (resi 46   and name HE  )  3.50  1.70  1.60
assi (resi 24   and name HG2#  ) (resi 46   and name HA  )  5.00  3.20  1.60
assi (resi 24   and name HB  ) (resi 46   and name HB#  )  5.00  3.20  1.80
assi (resi 24   and name HN  ) (resi 48   and name HA  )  3.50  1.70  0.80
 
! residue 25   Ser , intraresidue NOEs, Nnoesy
assi (resi 25   and name HA  ) (resi 25   and name HN  )  3.00  1.20  0.80
assi (resi 25   and name HB#  ) (resi 25   and name HN  )  3.50  1.70  1.80

! residue 25   Ser , NOEs forward in sequence, Nnoesy
assi (resi 25   and name HN  ) (resi 26   and name HN  )  4.50  2.70  0.80
assi (resi 25   and name HN  ) (resi 29   and name HN  )  5.00  3.20  0.80
assi (resi 25   and name HA  ) (resi 28   and name HN  )  4.50  2.70  0.80
assi (resi 25   and name HB#  ) (resi 28   and name HN  )  2.50  0.70  1.80
assi (resi 25   and name HA  ) (resi 29   and name HN  )  5.00  3.20  0.80

! residue 25   Ser , intraresidue NOEs, Cnoesy
assi (resi 25   and name HB#  ) (resi 25   and name HA  )  2.50  0.70  1.80

! residue 25   Ser , NOEs forward in sequence, Cnoesy
assi (resi 25   and name HA  ) (resi 26   and name HB#  )  4.50  2.70  1.80
assi (resi 25   and name HA  ) (resi 26   and name HN  )  2.00  0.20  0.80
assi (resi 25   and name HB#  ) (resi 28   and name HN  )  2.50  0.70  1.80
assi (resi 25   and name HB#  ) (resi 26   and name HN  )  3.50  1.70  1.80
assi (resi 25   and name HB#  ) (resi 28   and name HG#  )  3.50  1.70  2.80
assi (resi 25   and name HB#  ) (resi 29   and name HN  )  4.00  2.20  1.80

! residue 26   Arg , intraresidue NOEs, Nnoesy
assi (resi 26   and name HA  ) (resi 26   and name HN  )  3.00  1.20  0.80
assi (resi 26   and name HD#  ) (resi 26   and name HN  )  4.50  2.70  1.80
assi (resi 26   and name HB#  ) (resi 26   and name HN  )  2.50  0.70  1.80
assi (resi 26   and name HG#  ) (resi 26   and name HN  )  3.50  1.70  1.80

! residue 26   Arg , NOEs forward in sequence, Nnoesy
assi (resi 26   and name HN  ) (resi 27   and name HG#  )  4.50  2.70  1.80
assi (resi 26   and name HN  ) (resi 27   and name HN  )  3.00  1.20  0.80
assi (resi 26   and name HG#  ) (resi 27   and name HN  )  2.00  0.20  1.80
assi (resi 26   and name HA  ) (resi 28   and name HN  )  4.50  2.70  0.80
assi (resi 26   and name HG#  ) (resi 28   and name HN  )  4.50  2.70  1.80
assi (resi 26   and name HA  ) (resi 29   and name HN  )  3.00  1.20  0.80
assi (resi 26   and name HA  ) (resi 30   and name HN  )  4.00  2.20  0.80
assi (resi 26   and name HA  ) (resi 46   and name HE  )  4.00  2.20  0.80
assi (resi 26   and name HE  ) (resi 125   and name HD2  )  3.00  1.20  0.80
assi (resi 26   and name HE  ) (resi 125   and name HN  )  4.50  2.70  0.80
assi (resi 26   and name HE  ) (resi 124   and name HB1  )  4.00  2.20  0.80
assi (resi 26   and name HE  ) (resi 124   and name HB2  )  3.00  1.20  0.80
assi (resi 26   and name HE  ) (resi 124   and name HG#  )  4.50  2.70  1.80

! residue 26   Arg , intraresidue NOEs, Cnoesy
assi (resi 26   and name HA  ) (resi 26   and name HB#  )  2.50  0.70  1.80
assi (resi 26   and name HD#  ) (resi 26   and name HB#  )  3.50  1.70  2.80
assi (resi 26   and name HD#  ) (resi 26   and name HG#  )  2.50  0.70  2.80
assi (resi 26   and name HG#  ) (resi 26   and name HA  )  4.00  2.20  1.80

! residue 26   Arg , NOEs forward in sequence, Cnoesy
assi (resi 26   and name HA  ) (resi 30   and name HN  )  4.00  2.20  0.80
assi (resi 26   and name HA  ) (resi 29   and name HB#  )  3.50  1.70  1.80
assi (resi 26   and name HA  ) (resi 30   and name HG#  )  4.50  2.70  1.80
assi (resi 26   and name HB#  ) (resi 47   and name HA  )  5.00  3.20  1.80
assi (resi 26   and name HB#  ) (resi 56   and name HB  )  4.50  2.70  1.80
assi (resi 26   and name HB#  ) (resi 56   and name HG1#  )  3.50  1.70  2.60
assi (resi 26   and name HG#  ) (resi 125   and name HE2  )  4.50  2.70  1.80
assi (resi 26   and name HG#  ) (resi 125   and name HD1  )  4.50  2.70  0.80

! residue 26   Arg , NOEs forward in sequence, Label to Unlabel noesy
assi (resi 26   and name HG#  ) (resi 125   and name HD1  )  4.50  2.70  1.80

! residue 26   Arg , NOEs forward in sequence, Unlabel to Label noesy
assi (resi 26   and name HG#  ) (resi 125   and name HE1  )  4.50  2.70  1.80

! residue 27   Glu , intraresidue NOEs, Nnoesy
assi (resi 27   and name HA  ) (resi 27   and name HN  )  3.00  1.20  0.80
assi (resi 27   and name HG#  ) (resi 27   and name HN  )  2.00  0.20  1.80

! residue 27   Glu , NOEs forward in sequence, Nnoesy
assi (resi 27   and name HG#  ) (resi 28   and name HN  )  4.00  2.20  1.80
assi (resi 27   and name HA  ) (resi 28   and name HN  )  3.50  1.70  0.80
assi (resi 27   and name HA  ) (resi 29   and name HN  )  4.50  2.70  0.80
assi (resi 27   and name HA  ) (resi 30   and name HN  )  4.00  2.20  0.80

! residue 27   Glu , intraresidue NOEs, Cnoesy

! residue 27   Glu , NOEs forward in sequence, Cnoesy

! residue 28   Glu , intraresidue NOEs, Nnoesy
assi (resi 28   and name HA  ) (resi 28   and name HN  )  3.00  1.20  0.80
assi (resi 28   and name HG#  ) (resi 28   and name HN  )  4.00  2.20  1.80
assi (resi 28   and name HB#  ) (resi 28   and name HN  )  3.50  1.70  1.80

! residue 28   Glu , NOEs forward in sequence, Nnoesy
assi (resi 28   and name HN  ) (resi 29   and name HA  )  5.00  3.20  0.80
assi (resi 28   and name HN  ) (resi 29   and name HN  )  2.50  0.70  0.80
assi (resi 28   and name HA  ) (resi 29   and name HN  )  3.50  1.70  0.80
assi (resi 28   and name HB#  ) (resi 29   and name HN  )  4.00  2.20  1.80
assi (resi 28   and name HA  ) (resi 30   and name HN  )  4.50  2.70  0.80
assi (resi 28   and name HN  ) (resi 30   and name HN  )  4.50  2.70  0.80
assi (resi 28   and name HA  ) (resi 31   and name HN  )  3.50  1.70  0.80
assi (resi 28   and name HB#  ) (resi 32   and name HN  )  5.00  3.20  1.80

! residue 28   Glu , intraresidue NOEs, Cnoesy
assi (resi 28   and name HB#  ) (resi 28   and name HG#  )  2.50  0.70  2.80
assi (resi 28   and name HB#  ) (resi 28   and name HN  )  3.50  1.70  1.80

! residue 28   Glu , NOEs forward in sequence, Cnoesy
assi (resi 28   and name HA  ) (resi 29   and name HA  )  5.00  3.20  0.80
assi (resi 28   and name HA  ) (resi 29   and name HB#  )  4.50  2.70  1.80
assi (resi 28   and name HB#  ) (resi 31   and name HB#  )  4.00  2.20  2.80
assi (resi 28   and name HB#  ) (resi 32   and name HD1#  )  3.50  1.70  2.60

! residue 29   Ser , intraresidue NOEs, Nnoesy
assi (resi 29   and name HA  ) (resi 29   and name HN  )  3.00  1.20  0.80
assi (resi 29   and name HB#  ) (resi 29   and name HN  )  3.50  1.70  1.80

! residue 29   Ser , NOEs forward in sequence, Nnoesy
assi (resi 29   and name HN  ) (resi 32   and name HD1#  )  4.50  2.70  1.60
assi (resi 29   and name HN  ) (resi 30   and name HN  )  3.00  1.20  0.80
assi (resi 29   and name HA  ) (resi 30   and name HN  )  3.50  1.70  0.80
assi (resi 29   and name HB#  ) (resi 30   and name HN  )  3.50  1.70  1.80
assi (resi 29   and name HA  ) (resi 32   and name HN  )  3.00  1.20  0.80
assi (resi 29   and name HA  ) (resi 33   and name HN  )  3.00  1.20  0.80

! residue 29   Ser , intraresidue NOEs, Cnoesy

! residue 29   Ser , NOEs forward in sequence, Cnoesy
assi (resi 29   and name HA  ) (resi 32   and name HB#  )  4.50  2.70  1.80
assi (resi 29   and name HA  ) (resi 31   and name HB#  )  5.00  3.20  1.80
assi (resi 29   and name HB#  ) (resi 30   and name HN  )  3.50  1.70  1.80
assi (resi 29   and name HB#  ) (resi 30   and name HA  )  4.50  2.70  1.80
assi (resi 29   and name HA  ) (resi 32   and name HD#  )  3.00  1.20  3.20
assi (resi 29   and name HN  ) (resi 32   and name HD1#  )  4.50  2.70  1.60
assi (resi 29   and name HA  ) (resi 33   and name HD1#  )  2.00  0.20  1.60

! residue 30   Gln , intraresidue NOEs, Nnoesy
assi (resi 30   and name HE21  ) (resi 30   and name HN  )  4.50  2.70  0.80
assi (resi 30   and name HA  ) (resi 30   and name HN  )  2.50  0.70  0.80
assi (resi 30   and name HG#  ) (resi 30   and name HN  )  2.00  0.20  1.80
assi (resi 30   and name HB#  ) (resi 30   and name HN  )  3.50  1.70  1.80
assi (resi 30   and name HB#  ) (resi 30   and name HE21  )  2.00  0.20  1.80
assi (resi 30   and name HG#  ) (resi 30   and name HE21  )  3.50  1.70  1.80
assi (resi 30   and name HB#  ) (resi 30   and name HE22  )  3.50  1.70  1.80
assi (resi 30   and name HG#  ) (resi 30   and name HE22  )  4.00  2.20  1.80
assi (resi 30   and name HA  ) (resi 30   and name HE21  )  4.00  2.20  0.80
assi (resi 30   and name HE21  ) (resi 30   and name HE22  )  2.00  0.20  0.80

! residue 30   Gln , NOEs forward in sequence, Noesy
assi (resi 30   and name HN  ) (resi 33   and name HB  )  4.50  2.70  0.80
assi (resi 30   and name HN  ) (resi 33   and name HD1#  )  4.50  2.70  1.60
assi (resi 30   and name HA  ) (resi 31   and name HN  )  3.50  1.70  0.80
assi (resi 30   and name HG#  ) (resi 31   and name HN  )  4.50  2.70  1.80
assi (resi 30   and name HB#  ) (resi 31   and name HN  )  4.00  2.20  1.80
assi (resi 30   and name HA  ) (resi 32   and name HN  )  5.00  3.20  0.80
assi (resi 30   and name HA  ) (resi 33   and name HN  )  4.00  2.20  0.80
assi (resi 30   and name HB#  ) (resi 34   and name HN  )  5.00  3.20  1.80
assi (resi 30   and name HB#  ) (resi 65   and name HN  )  4.50  2.70  1.80
assi (resi 30   and name HE21  ) (resi 65   and name HN  )  4.50  2.70  0.80

! residue 30   Gln , intraresidue NOEs, Cnoesy
assi (resi 30   and name HB#  ) (resi 30   and name HA  )  2.50  0.70  1.80
assi (resi 30   and name HG#  ) (resi 30   and name HE21  )  3.50  1.70  1.80
assi (resi 30   and name HG#  ) (resi 30   and name HE22  )  4.00  2.20  1.80
assi (resi 30   and name HG#  ) (resi 30   and name HB#  )  3.00  1.20  2.80
assi (resi 30   and name HE21  ) (resi 30   and name HB#  )  1.80  1.20  1.80

! residue 30   Gln , NOEs forward in sequence, Cnoesy
assi (resi 30   and name HA  ) (resi 65   and name HB  )  3.50  1.70  0.80
assi (resi 30   and name HA  ) (resi 33   and name HB  )  3.50  1.70  0.80
assi (resi 30   and name HA  ) (resi 33   and name HD1#  )  4.50  2.70  1.60
assi (resi 30   and name HB#  ) (resi 34   and name HA1  )  4.00  2.20  1.80
assi (resi 30   and name HE22  ) (resi 65   and name HG2#  )  4.50  2.70  1.60
assi (resi 30   and name HE21  ) (resi 66   and name HA  )  3.00  1.20  0.80
assi (resi 30   and name HB#  ) (resi 66   and name HA  )  3.50  1.70  1.80

! residue 31   Arg , intraresidue NOEs, Nnoesy
assi (resi 31   and name HN  ) (resi 31   and name HE  )  5.00  3.20  0.80
assi (resi 31   and name HN  ) (resi 31   and name HA  )  3.00  1.20  0.80
assi (resi 31   and name HB#  ) (resi 31   and name HN  )  2.50  0.70  1.80
assi (resi 31   and name HG#  ) (resi 31   and name HN  )  4.50  2.70  1.80
assi (resi 31   and name HE  ) (resi 31   and name HN  )  5.00  3.20  0.80

! residue 31   Arg , NOEs forward in sequence, Nnoesy
assi (resi 31   and name HN  ) (resi 32   and name HD#  )  4.00  2.20  3.20
assi (resi 31   and name HN  ) (resi 34   and name HN  )  4.00  2.20  0.80
assi (resi 31   and name HN  ) (resi 32   and name HN  )  2.50  0.70  0.80
assi (resi 31   and name HB#  ) (resi 33   and name HN  )  5.00  3.20  1.80

! residue 31   Arg , intraresidue NOEs, Cnoesy
assi (resi 31   and name HN  ) (resi 31   and name HA  )  3.00  1.20  0.80

! residue 31   Arg , NOEs forward in sequence, Cnoesy
assi (resi 31   and name HB#  ) (resi 32   and name HG  )  4.50  2.70  1.80
assi (resi 31   and name HG#  ) (resi 32   and name HD1#  )  4.50  2.70  2.60
assi (resi 31   and name HG#  ) (resi 32   and name HG  )  4.50  2.70  1.80
assi (resi 31   and name HG#  ) (resi 32   and name HA  )  3.50  1.70  1.80
assi (resi 31   and name HG#  ) (resi 32   and name HD#  )  4.50  2.70  4.20

! residue 32   Leu , intraresidue NOEs, Nnoesy
assi (resi 32   and name HA  ) (resi 32   and name HN  )  3.00  1.20  0.80
assi (resi 32   and name HB#  ) (resi 32   and name HN  )  3.50  1.70  1.80
assi (resi 32   and name HG  ) (resi 32   and name HN  )  3.50  1.70  0.80
assi (resi 32   and name HD1#  ) (resi 32   and name HN  )  2.00  0.20  1.60
assi (resi 32   and name HD#  ) (resi 32   and name HN  )  2.00  0.20  3.20

! residue 32   Leu , NOEs forward in sequence, Nnoesy
assi (resi 32   and name HN  ) (resi 33   and name HB  )  5.00  3.20  0.80
assi (resi 32   and name HN  ) (resi 33   and name HD1#  )  4.00  2.20  1.60
assi (resi 32   and name HG  ) (resi 33   and name HN  )  5.00  3.20  0.80
assi (resi 32   and name HD1#  ) (resi 33   and name HN  )  4.00  2.20  1.60
assi (resi 32   and name HD#  ) (resi 33   and name HN  )  4.00  2.20  3.20
assi (resi 32   and name HN  ) (resi 34   and name HN  )  3.50  1.70  0.80

! residue 32   Leu , intraresidue NOEs, Cnoesy
assi (resi 32   and name HA  ) (resi 32   and name HD1#  )  4.00  2.20  1.60
assi (resi 32   and name HA  ) (resi 32   and name HB#  )  2.50  0.70  1.80
assi (resi 32   and name HD1#  ) (resi 32   and name HD2#  )  4.00  2.20  2.40
assi (resi 32   and name HD1#  ) (resi 32   and name HG  )  3.00  1.20  1.60
assi (resi 32   and name HD1#  ) (resi 32   and name HB#  )  3.50  1.70  2.60

! residue 32   Leu , NOEs forward in sequence, Cnoesy
assi (resi 32   and name HD#  ) (resi 33   and name HD1#  )  4.00  2.20  4.00

! residue 33   Ile , intraresidue NOEs, Nnoesy
assi (resi 33   and name HA  ) (resi 33   and name HN  )  3.00  1.20  0.80
assi (resi 33   and name HB  ) (resi 33   and name HN  )  2.50  0.70  0.80
assi (resi 33   and name HG1#  ) (resi 33   and name HN  )  3.50  1.70  1.60
assi (resi 33   and name HG2#  ) (resi 33   and name HN  )  4.50  2.70  1.60

! residue 33   Ile , NOEs forward in sequence, Nnoesy
assi (resi 33   and name HN  ) (resi 34   and name HN  )  2.50  0.70  0.80
assi (resi 33   and name HN  ) (resi 35   and name HN  )  4.00  2.20  0.80
assi (resi 33   and name HA  ) (resi 34   and name HN  )  3.50  1.70  0.80
assi (resi 33   and name HB  ) (resi 34   and name HN  )  3.00  1.20  0.80
assi (resi 33   and name HG2#  ) (resi 34   and name HN  )  4.50  2.70  1.60
assi (resi 33   and name HD1#  ) (resi 34   and name HN  )  4.00  2.20  1.60
assi (resi 33   and name HN  ) (resi 34   and name HN  )  2.50  0.70  0.80
assi (resi 33   and name HA  ) (resi 35   and name HN  )  3.50  1.70  0.80
assi (resi 33   and name HB  ) (resi 35   and name HN  )  5.00  3.20  0.80
assi (resi 33   and name HG2#  ) (resi 35   and name HN  )  5.00  3.20  1.60
assi (resi 33   and name HA  ) (resi 36   and name HN  )  4.00  2.20  0.80
assi (resi 33   and name HG2#  ) (resi 36   and name HE2#  )  3.00  1.20  2.60
assi (resi 33   and name HG1#  ) (resi 36   and name HE2#  )  3.50  1.70  2.60
assi (resi 33   and name HA  ) (resi 36   and name HE2#  )  2.00  0.20  1.80
assi (resi 33   and name HG2#  ) (resi 117   and name HN  )  5.00  3.20  1.60

! residue 33   Ile , intraresidue NOEs, Cnoesy
assi (resi 33   and name HG1#  ) (resi 33   and name HA  )  2.50  0.70  1.60
assi (resi 33   and name HG1#  ) (resi 33   and name HB  )  2.50  0.70  1.60
assi (resi 33   and name HG2#  ) (resi 33   and name HA  )  2.50  0.70  1.60
assi (resi 33   and name HD1#  ) (resi 33   and name HA  ) 4.00  2.20  1.60
assi (resi 33   and name HD1#  ) (resi 33   and name HB  ) 2.50  0.70  1.60
assi (resi 33   and name HD1#  ) (resi 33   and name HG2#  ) 4.50  2.70  2.40
assi (resi 33   and name HG2#  ) (resi 33   and name HB  )  3.00  1.20  1.60

! residue 33   Ile , NOEs forward in sequence, Cnoesy
assi (resi 33   and name HB  ) (resi 34   and name HA2  )  4.50  2.70  0.80
assi (resi 33   and name HG2#  ) (resi 34   and name HA2  )  4.50  2.70  1.60
assi (resi 33   and name HG2#  ) (resi 36   and name HG#  )  4.50  2.70  2.80
assi (resi 33   and name HA  ) (resi 36   and name HG#  )  3.50  1.70  1.80

! residue 34   Gly , intraresidue NOEs, Nnoesy
assi (resi 34   and name HA2  ) (resi 34   and name HN  )  3.00  1.20  0.80
assi (resi 34   and name HA1  ) (resi 34   and name HN  )  2.50  0.70  0.80

! residue 34   Gly , NOEs forward in sequence, Nnoesy
assi (resi 34   and name HN  ) (resi 35   and name HB#  )  4.00  2.20  1.80
assi (resi 34   and name HN  ) (resi 65   and name HB  )  5.00  3.20  0.80
assi (resi 34   and name HN  ) (resi 36   and name HN  )  4.50  2.70  0.80
assi (resi 34   and name HN  ) (resi 35   and name HN  )  2.50  0.70  0.80
assi (resi 34   and name HA1  ) (resi 35   and name HN  )  3.50  1.70  0.80
assi (resi 34   and name HA2  ) (resi 35   and name HN  )  3.00  1.20  0.80
assi (resi 34   and name HA1  ) (resi 36   and name HN  )  4.50  2.70  0.80
assi (resi 34   and name HA2  ) (resi 36   and name HN  )  3.50  1.70  0.80

! residue 34   Gly , intraresidue NOEs, Cnoesy

! residue 34   Gly , NOEs forward in sequence, Cnoesy
assi (resi 34   and name HA1  ) (resi 65   and name HG1#  )  3.50  1.70  1.60
assi (resi 34   and name HA2  ) (resi 65   and name HG1#  )  3.00  1.20  1.60
assi (resi 34   and name HA2  ) (resi 65   and name HG2#  )  4.50  2.70  1.60

! residue 35   Gln , intraresidue NOEs, Nnoesy
assi (resi 35   and name HN  ) (resi 35   and name HA  )  3.00  1.20  0.80
assi (resi 35   and name HN  ) (resi 35   and name HG#  )  3.50  1.70  1.80
assi (resi 35   and name HN  ) (resi 35   and name HB#  )  3.00  1.20  1.80

! residue 35   Gln , NOEs forward in sequence, Noesy
assi (resi 35   and name HN  ) (resi 36   and name HN  )  2.50  0.70  0.80
assi (resi 35   and name HN  ) (resi 36   and name HE2#  )  4.50  2.70  1.80
assi (resi 35   and name HN  ) (resi 36   and name HA  )  4.50  2.70  0.80
assi (resi 35   and name HN  ) (resi 36   and name HG#  )  3.50  1.70  1.80
assi (resi 35   and name HA  ) (resi 36   and name HN  )  3.50  1.70  0.80
assi (resi 35   and name HG#  ) (resi 36   and name HN  )  3.00  1.20  1.80
assi (resi 35   and name HB#  ) (resi 36   and name HN  )  4.00  2.20  1.80

! residue 35   Gln , intraresidue NOEs, Cnoesy
assi (resi 35   and name HN  ) (resi 35   and name HA  )  3.00  1.20  0.80
assi (resi 35   and name HB#  ) (resi 35   and name HA  )  2.50  0.70  1.80
assi (resi 35   and name HB#  ) (resi 35   and name HN  )  2.50  0.70  1.80
assi (resi 35   and name HB#  ) (resi 35   and name HG#  )  3.00  1.20  2.80

! residue 35   Gln , NOEs forward in sequence, Cnoesy
assi (resi 35   and name HA  ) (resi 36   and name HA  )  5.00  3.20  0.80
assi (resi 35   and name HG#  ) (resi 36   and name HG#  )  3.50  1.70  2.80

! residue 36   Gln , intraresidue NOEs, Nnoesy
assi (resi 36   and name HA  ) (resi 36   and name HN  )  3.00  1.20  0.80
assi (resi 36   and name HG#  ) (resi 36   and name HN  )  2.00  0.20  1.80
assi (resi 36   and name HB#  ) (resi 36   and name HN  )  3.50  1.70  1.80
assi (resi 36   and name HE2#  ) (resi 36   and name HG#  )  2.00  0.20  2.80
assi (resi 36   and name HE2#  ) (resi 36   and name HB#  )  4.50  2.70  2.80

! residue 36   Gln , NOEs forward in sequence, Nnoesy
assi (resi 36   and name HB#  ) (resi 37   and name HN  )  3.50  1.70  1.80
assi (resi 36   and name HA  ) (resi 37   and name HN  )  2.00  0.20  0.80
assi (resi 36   and name HA  ) (resi 38   and name HN  )  4.00  2.20  0.80
assi (resi 36   and name HB#  ) (resi 38   and name HN  )  3.00  1.20  1.80
assi (resi 36   and name HE2#  ) (resi 117   and name HN  )  4.50  2.70  1.80

! residue 36   Gln , intraresidue NOEs, Cnoesy
assi (resi 36   and name HA  ) (resi 36   and name HG#  )  3.00  1.20  1.80
assi (resi 36   and name HA  ) (resi 36   and name HN  )  2.00  0.20  0.80
assi (resi 36   and name HA  ) (resi 36   and name HE2#  )  2.00  0.20  1.80
assi (resi 36   and name HB#  ) (resi 36   and name HG#  )  3.00  1.20  2.80
assi (resi 36   and name HB#  ) (resi 36   and name HN  )  3.50  1.70  1.80
assi (resi 36   and name HB#  ) (resi 36   and name HE2#  )  4.50  2.70  2.80

! residue 36   Gln , NOEs forward in sequence, Cnoesy
assi (resi 36   and name HA  ) (resi 38   and name HD2#  )  4.00  2.20  1.60
assi (resi 36   and name HA  ) (resi 37   and name HN  )  2.00  0.20  0.80
assi (resi 36   and name HA  ) (resi 37   and name HA2  )  4.50  2.70  0.80
assi (resi 36   and name HB#  ) (resi 38   and name HD2#  )  3.00  1.20  2.60

! residue 37   Gly , intraresidue NOEs, Nnoesy
assi (resi 37   and name HN  ) (resi 37   and name HA2  )  3.00  1.20  0.80
assi (resi 37   and name HN  ) (resi 37   and name HA1  )  2.50  0.70  0.80

! residue 37   Gly , NOEs forward in sequence, Nnoesy
assi (resi 37   and name HN  ) (resi 38   and name HD2#  )  4.00  2.20  1.60
assi (resi 37   and name HN  ) (resi 38   and name HA  )  5.00  3.20  0.80
assi (resi 37   and name HN  ) (resi 38   and name HN  )  3.00  1.20  0.80
assi (resi 37   and name HN  ) (resi 38   and name HN  )  3.00  1.20  0.80
assi (resi 37   and name HA1  ) (resi 38   and name HN  )  3.50  1.70  0.80
assi (resi 37   and name HA2  ) (resi 38   and name HN  )  3.00  1.20  0.80

! residue 37   Gly , intraresidue NOEs, Cnoesy
assi (resi 37   and name HA1  ) (resi 37   and name HN  )  2.50  0.70  0.80
assi (resi 37   and name HA2  ) (resi 37   and name HN  )  3.00  1.20  0.80
assi (resi 37   and name HA2  ) (resi 37   and name HA1  )  2.00  0.20  0.80

! residue 37   Gly , NOEs forward in sequence, Cnoesy
assi (resi 37   and name HN  ) (resi 38   and name HD2#  )  4.00  2.20  1.60

! residue 38   Leu , intraresidue NOEs, Nnoesy
assi (resi 38   and name HA  ) (resi 38   and name HN  )  3.00  1.20  0.80
assi (resi 38   and name HB#  ) (resi 38   and name HN  )  3.50  1.70  1.80
assi (resi 38   and name HG  ) (resi 38   and name HN  )  4.00  2.20  0.80
assi (resi 38   and name HD1#  ) (resi 38   and name HN  )  4.50  2.70  1.60
assi (resi 38   and name HD2#  ) (resi 38   and name HN  )  3.50  1.70  1.60

! residue 38   Leu , NOEs forward in sequence, Nnoesy
assi (resi 38   and name HN  ) (resi 39   and name HN  )  4.50  2.70  0.80
assi (resi 38   and name HN  ) (resi 60   and name HB1  )  5.00  3.20  0.80
assi (resi 38   and name HA  ) (resi 39   and name HN  )  3.00  1.20  0.80
assi (resi 38   and name HB#  ) (resi 39   and name HN  )  2.00  0.20  1.80
assi (resi 38   and name HG  ) (resi 39   and name HN  )  4.00  2.20  0.80
assi (resi 38   and name HD1#  ) (resi 39   and name HN  )  3.00  1.20  1.60

! residue 38   Leu , intraresidue NOEs, Cnoesy
assi (resi 38   and name HN  ) (resi 38   and name HA  )  3.00  1.20  0.80
assi (resi 38   and name HG  ) (resi 38   and name HA  )  3.50  1.70  0.80
assi (resi 38   and name HD2#  ) (resi 38   and name HA  )  4.00  2.20  1.60
assi (resi 38   and name HD1#  ) (resi 38   and name HA  )  2.50  0.70  1.60
assi (resi 38   and name HD1#  ) (resi 38   and name HG  )  2.50  0.70  1.60
assi (resi 38   and name HD2#  ) (resi 38   and name HB#  )  4.00  2.20  2.60
assi (resi 38   and name HD2#  ) (resi 38   and name HG  )  2.50  0.70  1.60

! residue 38   Leu , NOEs forward in sequence, Cnoesy
assi (resi 38   and name HG  ) (resi 42   and name HG  )  3.00  1.20  0.80
assi (resi 38   and name HD2#  ) (resi 42   and name HG  )  5.00  3.20  1.60
assi (resi 38   and name HB#  ) (resi 39   and name HG2#  )  3.00  1.20  2.60
assi (resi 38   and name HB#  ) (resi 42   and name HD2#  )  3.50  1.70  2.60

! residue 39   Val , intraresidue NOEs, Nnoesy
assi (resi 39   and name HA  ) (resi 39   and name HN  )  3.00  1.20  0.80
assi (resi 39   and name HB  ) (resi 39   and name HN  )  3.50  1.70  0.80
assi (resi 39   and name HG1#  ) (resi 39   and name HN  )  3.50  1.70  1.60
assi (resi 39   and name HG2#  ) (resi 39   and name HN  )  2.00  0.20  1.60

! residue 39   Val , NOEs forward in sequence, Nnoesy
assi (resi 39   and name HN  ) (resi 110   and name HG  )  5.00  3.20  0.80
assi (resi 39   and name HN  ) (resi 40   and name HN  )  4.50  2.70  0.80
assi (resi 39   and name HA  ) (resi 40   and name HN  )  2.50  0.70  0.80
assi (resi 39   and name HB  ) (resi 40   and name HN  )  2.50  0.70  0.80
assi (resi 39   and name HG2#  ) (resi 40   and name HN  )  5.00  3.20  1.60
assi (resi 39   and name HG1#  ) (resi 40   and name HN  )  4.00  2.20  1.60
assi (resi 39   and name HB  ) (resi 41   and name HN  )  3.50  1.70  0.80
assi (resi 39   and name HA  ) (resi 41   and name HN  )  4.00  2.20  0.80

! residue 39   Val , intraresidue NOEs, Cnoesy
assi (resi 39   and name HA  ) (resi 39   and name HN  )  3.00  1.20  0.80
assi (resi 39   and name HA  ) (resi 39   and name HG1#  )  2.50  0.70  1.60
assi (resi 39   and name HA  ) (resi 39   and name HG2#  )  4.00  2.20  1.60
assi (resi 39   and name HB  ) (resi 39   and name HG1#  )  2.50  0.70  1.60
assi (resi 39   and name HB  ) (resi 39   and name HG2#  )  3.00  1.20  1.60
assi (resi 39   and name HN  ) (resi 39   and name HG2#  )  2.00  0.20  1.60
assi (resi 39   and name HN  ) (resi 39   and name HG1#  )  3.50  1.70  1.60

! residue 39   Val , NOEs forward in sequence, Cnoesy
assi (resi 39   and name HA  ) (resi 40   and name HN  )  2.50  0.70  0.80
assi (resi 39   and name HA  ) (resi 110   and name HG  )  3.50  1.70  0.80
assi (resi 39   and name HB  ) (resi 110   and name HD2#  )  4.00  2.20  1.60
assi (resi 39   and name HG1#  ) (resi 40   and name HN  )  4.00  2.20  1.60
assi (resi 39   and name HG2#  ) (resi 40   and name HN  )  5.00  3.20  1.60
assi (resi 39   and name HG2#  ) (resi 41   and name HN  )  4.00  2.20  1.60
assi (resi 39   and name HG2#  ) (resi 110   and name HB#  )  5.00  3.20  2.60
assi (resi 39   and name HA  ) (resi 41   and name HN  )  3.00  1.20  0.80
assi (resi 39   and name HB  ) (resi 41   and name HN  )  3.50  1.70  0.80
assi (resi 39   and name HG2#  ) (resi 42   and name HN  )  5.00  3.20  1.60
assi (resi 39   and name HG2#  ) (resi 42   and name HG  )  4.50  2.70  1.60
assi (resi 39   and name HG2#  ) (resi 42   and name HD2#  )  3.00  1.20  2.40
assi (resi 39   and name HB  ) (resi 110   and name HB#  )  3.00  1.20  1.80
assi (resi 39   and name HB  ) (resi 110   and name HG  )  2.00  0.20  0.80

! residue 40   Asp , intraresidue NOEs, Nnoesy
assi (resi 40   and name HN  ) (resi 40   and name HA  )  3.00  1.20  0.80
assi (resi 40   and name HN  ) (resi 40   and name HB#  )  2.50  0.70  1.80

! residue 40   Asp , NOEs forward in sequence, Nnoesy
assi (resi 40   and name HN  ) (resi 41   and name HA1  )  5.00  3.20  0.80
assi (resi 40   and name HN  ) (resi 61   and name HA  )  4.50  2.70  0.80
assi (resi 40   and name HN  ) (resi 109   and name HB1  )  4.50  2.70  0.80
assi (resi 40   and name HN  ) (resi 110   and name HB#  )  2.50  0.70  1.80
assi (resi 40   and name HN  ) (resi 106   and name HG2#  )  4.50  2.70  1.60
assi (resi 40   and name HN  ) (resi 62   and name HN  )  4.50  2.70  0.80
assi (resi 40   and name HN  ) (resi 41   and name HN  )  3.50  1.70  0.80
assi (resi 40   and name HN  ) (resi 110   and name HN  )  4.00  2.20  0.80
assi (resi 40   and name HA  ) (resi 41   and name HN  )  2.50  0.70  0.80
assi (resi 40   and name HA  ) (resi 42   and name HN  )  3.50  1.70  0.80
assi (resi 40   and name HB#  ) (resi 62   and name HN  )  3.50  1.70  1.80

! residue 40   Asp , intraresidue NOEs, Cnoesy
assi (resi 40   and name HA  ) (resi 40   and name HB#  )  3.00  1.20  1.80
assi (resi 40   and name HN  ) (resi 40   and name HB#  )  2.50  0.70  1.80

! residue 40   Asp , NOEs forward in sequence, Cnoesy
assi (resi 40   and name HA  ) (resi 41   and name HN  )  2.50  0.70  0.80
assi (resi 40   and name HB#  ) (resi 61   and name HB1  )  4.50  2.70  1.80
assi (resi 40   and name HN  ) (resi 110   and name HB#  )  3.00  1.20  1.80

! residue 41   Gly , intraresidue NOEs, Nnoesy
assi (resi 41   and name HN  ) (resi 41   and name HA2  )  3.00  1.20  0.80
assi (resi 41   and name HN  ) (resi 41   and name HA1  )  2.50  0.70  0.80

! residue 41   Gly , NOEs forward in sequence, Nnoesy
assi (resi 41   and name HN  ) (resi 110   and name HB#  )  5.00  3.20  1.80
assi (resi 41   and name HN  ) (resi 113   and name HA  )  4.50  2.70  0.80
assi (resi 41   and name HN  ) (resi 42   and name HA  )  4.50  2.70  0.80
assi (resi 41   and name HN  ) (resi 61   and name HA  )  4.00  2.20  0.80
assi (resi 41   and name HA1  ) (resi 42   and name HN  )  3.50  1.70  0.80
assi (resi 41   and name HA2  ) (resi 42   and name HN  )  3.00  1.20  0.80
assi (resi 41   and name HA2  ) (resi 43   and name HN  )  4.50  2.70  0.80
assi (resi 41   and name HA2  ) (resi 60   and name HN  )  4.50  2.70  0.80
assi (resi 41   and name HN  ) (resi 60   and name HN  )  5.00  3.20  0.80
assi (resi 41   and name HA2  ) (resi 105   and name HA#  )  3.50  1.70  1.80
assi (resi 41   and name HA1  ) (resi 105   and name HA#  )  5.00  3.20  1.80
assi (resi 41   and name HA2  ) (resi 106   and name HN  )  5.00  3.20  0.80
assi (resi 41   and name HA1  ) (resi 114   and name HN  )  4.00  2.20  0.80
assi (resi 41   and name HA2  ) (resi 114   and name HN  )  4.50  2.70  0.80

! residue 41   Gly , intraresidue NOEs, Cnoesy
assi (resi 41   and name HA1  ) (resi 41   and name HA2  )  2.00  0.20  0.80

! residue 41   Gly , NOEs forward in sequence, Cnoesy
assi (resi 41   and name HA1  ) (resi 113   and name HA  )  2.00  0.20  0.80

! residue 42   Leu , intraresidue NOEs, Nnoesy
assi (resi 42   and name HN  ) (resi 42   and name HA  )  3.00  1.20  0.80
assi (resi 42   and name HN  ) (resi 42   and name HB#  )  3.50  1.70  1.80

! residue 42   Leu , NOEs forward in sequence, Nnoesy
assi (resi 42   and name HN  ) (resi 61   and name HA  )  5.00  3.20  0.80
assi (resi 42   and name HN  ) (resi 60   and name HA  )  5.00  3.20  0.80
assi (resi 42   and name HN  ) (resi 43   and name HN  )  3.50  1.70  0.80
assi (resi 42   and name HA  ) (resi 43   and name HN  )  2.00  0.20  0.80
assi (resi 42   and name HB#  ) (resi 43   and name HN  )  4.00  2.20  1.80
assi (resi 42   and name HD1#  ) (resi 43   and name HN  )  4.00  2.20  1.80
assi (resi 42   and name HA  ) (resi 60   and name HN  )  4.50  2.70  0.80
assi (resi 42   and name HB#  ) (resi 60   and name HN  )  5.00  3.20  1.80
assi (resi 42   and name HN  ) (resi 60   and name HN  )  3.50  1.70  0.30
assi (resi 42   and name HD1#  ) (resi 114   and name HN  )  4.50  2.70  1.60
assi (resi 42   and name HD2#  ) (resi 114   and name HN  )  3.50  1.70  1.60
assi (resi 42   and name HA  ) (resi 116   and name HN  )  5.00  3.20  0.80
assi (resi 42   and name HD1#  ) (resi 116   and name HN  )  5.00  3.20  1.60
assi (resi 42   and name HB#  ) (resi 117   and name HN  )  4.00  2.20  1.80

! residue 42   Leu , intraresidue NOEs, Cnoesy
assi (resi 42   and name HG  ) (resi 42   and name HA  )  3.50  1.70  0.80
assi (resi 42   and name HB#  ) (resi 42   and name HA  )  2.50  0.70  1.80
assi (resi 42   and name HD1#  ) (resi 42   and name HG  )  2.50  0.70  1.60
assi (resi 42   and name HB#  ) (resi 42   and name HG  )  2.50  0.70  1.80
assi (resi 42   and name HD1#  ) (resi 42   and name HN  )  4.00  2.20  1.60
assi (resi 42   and name HD1#  ) (resi 42   and name HD2#  )  3.50  1.70  2.40
assi (resi 42   and name HD2#  ) (resi 42   and name HG  )  3.00  1.20  1.60

! residue 42   Leu , NOEs forward in sequence, Cnoesy
assi (resi 42   and name HA  ) (resi 60   and name HB2  )  4.00  2.20  0.80
assi (resi 42   and name HA  ) (resi 113   and name HB2  )  4.50  2.70  0.80
assi (resi 42   and name HA  ) (resi 114   and name HB1  )  4.50  2.70  0.80
assi (resi 42   and name HD1#  ) (resi 43   and name HN  )  4.00  2.20  1.60

! residue 43   Phe , intraresidue NOEs, Nnoesy
assi (resi 43   and name HA  ) (resi 43   and name HN  )  3.00  1.20  0.80
assi (resi 43   and name HB2  ) (resi 43   and name HN  )  3.50  1.70  0.80
assi (resi 43   and name HB1  ) (resi 43   and name HN  )  3.00  1.20  0.80
assi (resi 43   and name HE#  ) (resi 43   and name HN  )  5.00  3.20  1.80
assi (resi 43   and name HD#  ) (resi 43   and name HN  )  3.50  1.70  1.80

! residue 43   Phe , NOEs forward in sequence, Nnoesy
assi (resi 43   and name HN  ) (resi 59   and name HA  )  4.50  2.70  0.80
assi (resi 43   and name HN  ) (resi 115   and name HA  )  4.50  2.70  0.80
assi (resi 43   and name HN  ) (resi 60   and name HB2  )  4.50  2.70  0.80
assi (resi 43   and name HN  ) (resi 113   and name HB2  )  4.00  2.20  0.80
assi (resi 43   and name HN  ) (resi 59   and name HD2#  )  5.00  3.20  1.60
assi (resi 43   and name HN  ) (resi 44   and name HN  )  4.50  2.70  0.80
assi (resi 43   and name HN  ) (resi 116   and name HN  )  4.50  2.70  0.80
assi (resi 43   and name HN  ) (resi 114   and name HN  )  4.00  2.20  0.80
assi (resi 43   and name HB2  ) (resi 44   and name HN  )  3.00  1.20  0.80
assi (resi 43   and name HB1  ) (resi 44   and name HN  )  4.00  2.20  0.80
assi (resi 43   and name HD#  ) (resi 44   and name HN  )  3.50  1.70  1.80
assi (resi 43   and name HD#  ) (resi 45   and name HN  )  4.50  2.70  1.80
assi (resi 43   and name HA  ) (resi 59   and name HN  )  4.50  2.70  0.80
assi (resi 43   and name HA  ) (resi 60   and name HN  )  3.00  1.20  0.80
assi (resi 43   and name HB2  ) (resi 60   and name HN  )  4.50  2.70  0.80
assi (resi 43   and name HB1  ) (resi 60   and name HN  )  3.50  1.70  0.80

! residue 43   Phe , intraresidue NOEs, Cnoesy
assi (resi 43   and name HA  ) (resi 43   and name HB2  )  2.50  0.70  0.80
assi (resi 43   and name HB1  ) (resi 43   and name HB2  )  2.00  0.20  0.80

! residue 43   Phe , NOEs forward in sequence, Cnoesy
assi (resi 43   and name HA  ) (resi 44   and name HB#  )  4.50  2.70  1.80
assi (resi 43   and name HB2  ) (resi 58   and name HN  )  4.00  2.20  0.80
assi (resi 43   and name HB2  ) (resi 59   and name HB#  )  5.00  3.20  1.80
assi (resi 43   and name HB2  ) (resi 57   and name HD2#  )  3.00  1.20  1.60
assi (resi 43   and name HB1  ) (resi 59   and name HD2#  )  2.00  0.20  1.60
assi (resi 43   and name HD#  ) (resi 59   and name HD2#  )  4.50  2.70  3.60
assi (resi 43   and name HB2  ) (resi 59   and name HD2#  )  2.00  0.20  1.60
assi (resi 43   and name HN  ) (resi 113   and name HB1  )  4.50  2.70  0.80

! residue 44   Leu , intraresidue NOEs, Nnoesy
assi (resi 44   and name HN  ) (resi 44   and name HA  )  3.00  1.20  0.80
assi (resi 44   and name HN  ) (resi 44   and name HG  )  4.50  2.70  0.80
assi (resi 44   and name HN  ) (resi 44   and name HB#  )  3.00  1.20  1.80

! residue 44   Leu , NOEs forward in sequence, Nnoesy
assi (resi 44   and name HN  ) (resi 59   and name HA  )  3.50  1.70  0.80
assi (resi 44   and name HN  ) (resi 57   and name HA  )  5.00  3.20  0.80
assi (resi 44   and name HN  ) (resi 57   and name HD2#  )  4.00  2.20  1.60
assi (resi 44   and name HN  ) (resi 59   and name HD2#  )  4.00  2.20  1.60
assi (resi 44   and name HN  ) (resi 58   and name HN  )  3.00  1.20  0.80
assi (resi 44   and name HN  ) (resi 45   and name HN  )  4.50  2.70  0.80
assi (resi 44   and name HA  ) (resi 45   and name HN  )  2.00  0.20  0.80
assi (resi 44   and name HG  ) (resi 45   and name HN  )  2.50  0.70  0.80
assi (resi 44   and name HB#  ) (resi 45   and name HN  )  4.00  2.20  1.80
assi (resi 44   and name HD1#  ) (resi 45   and name HN  )  4.00  2.20  1.60
assi (resi 44   and name HG  ) (resi 46   and name HN  )  4.00  2.20  0.80
assi (resi 44   and name HB#  ) (resi 46   and name HN  )  5.00  3.20  1.80

! residue 44   Leu , intraresidue NOEs, Cnoesy
assi (resi 44   and name HB#  ) (resi 44   and name HG#  )  2.50  0.70  2.80
assi (resi 44   and name HD1#  ) (resi 44   and name HD2#  )  2.50  0.70  2.40
assi (resi 44   and name HD1#  ) (resi 44   and name HG  )  3.00  1.20  1.60
assi (resi 44   and name HD1#  ) (resi 44   and name HB#  )  4.00  2.20  2.60
assi (resi 44   and name HD2#  ) (resi 44   and name HG  )  2.50  0.70  1.60
assi (resi 44   and name HD2#  ) (resi 44   and name HB#  )  3.50  1.70  2.60

! residue 44   Leu , NOEs forward in sequence, Cnoesy
assi (resi 44   and name HG  ) (resi 46   and name HD#  )  4.00  2.20  3.20
assi (resi 44   and name HD1#  ) (resi 118   and name HG#  )  3.50  1.70  2.60
assi (resi 44   and name HD2#  ) (resi 46   and name HB#  )  4.00  2.20  2.60
assi (resi 44   and name HG  ) (resi 45   and name HB  )  5.00  3.20  0.80
assi (resi 44   and name HG  ) (resi 46   and name HA  )  4.50  2.70  0.80
assi (resi 44   and name HB#  ) (resi 46   and name HD#  )  4.50  2.70  2.80
assi (resi 44   and name HG  ) (resi 46   and name HB#  )  3.50  1.70  1.80
assi (resi 44   and name HA  ) (resi 58   and name HN  )  4.50  2.70  0.80
assi (resi 44   and name HB#  ) (resi 58   and name HN  )  4.50  2.70  1.80
assi (resi 44   and name HN  ) (resi 59   and name HA  )  3.50  1.70  0.80
assi (resi 44   and name HN  ) (resi 59   and name HD2#  )  4.00  2.20  1.60

! residue 45   Val , intraresidue NOEs, Nnoesy
assi (resi 45   and name HN  ) (resi 45   and name HA  )  3.00  1.20  0.80
assi (resi 45   and name HN  ) (resi 45   and name HB  )  2.50  0.70  0.80
assi (resi 45   and name HN  ) (resi 45   and name HG2#  )  3.50  1.70  1.60
assi (resi 45   and name HN  ) (resi 45   and name HG1#  )  4.50  2.70  1.60

! residue 45   Val , NOEs forward in sequence, Nnoesy
assi (resi 45   and name HN  ) (resi 58   and name HN  )  4.50  2.70  0.80
assi (resi 45   and name HA  ) (resi 46   and name HN  )  2.00  0.20  0.80
assi (resi 45   and name HB  ) (resi 46   and name HN  )  4.50  2.70  0.80
assi (resi 45   and name HG1#  ) (resi 46   and name HN  )  3.50  1.70  1.60
assi (resi 45   and name HG1#  ) (resi 57   and name HN  )  5.00  3.20  1.60
assi (resi 45   and name HG1#  ) (resi 58   and name HN  )  5.00  3.20  1.60

! residue 45   Val , intraresidue NOEs, Cnoesy
assi (resi 45   and name HB  ) (resi 45   and name HG2#  )  2.50  0.70  1.60
assi (resi 45   and name HN  ) (resi 45   and name HG1#  )  4.50  2.70  1.60
assi (resi 45   and name HN  ) (resi 45   and name HG2#  )  3.50  1.70  1.60
assi (resi 45   and name HB  ) (resi 45   and name HG2#  )  2.50  0.70  1.60
assi (resi 45   and name HB  ) (resi 45   and name HG1#  )  3.00  1.20  1.60
assi (resi 45   and name HG2#  ) (resi 45   and name HG1#  )  3.50  1.70  2.40

! residue 45   Val , NOEs forward in sequence, Cnoesy
assi (resi 45   and name HG2#  ) (resi 57   and name HN  )  5.00  3.20  1.60
assi (resi 45   and name HG1#  ) (resi 46   and name HN  )  3.50  1.70  1.60
assi (resi 45   and name HG1#  ) (resi 58   and name HN  )  5.00  3.20  1.60
assi (resi 45   and name HG1#  ) (resi 81   and name HE#  )  4.50  2.70  2.60
assi (resi 45   and name HG1#  ) (resi 56   and name HA  )  5.00  3.20  1.60
assi (resi 45   and name HG1#  ) (resi 56   and name HG2#  )  4.50  2.70  2.40
assi (resi 45   and name HB  ) (resi 46   and name HA  )  5.00  3.20  0.80
assi (resi 45   and name HG1#  ) (resi 55   and name HA  )  4.50  2.70  1.60
assi (resi 45   and name HA  ) (resi 56   and name HN  )  4.50  2.70  0.80
assi (resi 45   and name HG1#  ) (resi 57   and name HD2#  )  5.00  3.20  2.40
assi (resi 45   and name HA  ) (resi 58   and name HN  )  3.00  1.20  0.80

! residue 46   Arg , intraresidue NOEs, Nnoesy
assi (resi 46   and name HA  ) (resi 46   and name HN  )  3.00  1.20  0.80
assi (resi 46   and name HD#  ) (resi 46   and name HN  )  2.00  0.20  1.80
assi (resi 46   and name HB#  ) (resi 46   and name HN  )  3.50  1.70  1.80
assi (resi 46   and name HD#  ) (resi 46   and name HE  )  2.50  0.70  1.80

! residue 46   Arg , NOEs forward in sequence, Nnoesy
assi (resi 46   and name HN  ) (resi 57   and name HA  )  4.00  2.20  0.80
assi (resi 46   and name HN  ) (resi 47   and name HA  )  5.00  3.20  0.80
assi (resi 46   and name HN  ) (resi 56   and name HG1#  )  4.50  2.70  1.60
assi (resi 46   and name HE  ) (resi 56   and name HG1#  )  3.00  1.20  1.60
assi (resi 46   and name HA  ) (resi 47   and name HN  )  2.00  0.20  0.80
assi (resi 46   and name HB#  ) (resi 47   and name HN  )  3.50  1.70  1.80
assi (resi 46   and name HN  ) (resi 47   and name HN  )  4.50  2.70  0.80

! residue 46   Arg , intraresidue NOEs, Cnoesy
assi (resi 46   and name HD#  ) (resi 46   and name HA  )  4.00  2.20  1.80
assi (resi 46   and name HB#  ) (resi 46   and name HA  )  2.00  0.20  1.80
assi (resi 46   and name HN  ) (resi 46   and name HA  )  3.00  1.20  0.80
assi (resi 46   and name HB#  ) (resi 46   and name HD#  )  3.50  1.70  2.80

! residue 46   Arg , NOEs forward in sequence, Cnoesy
assi (resi 46   and name HA  ) (resi 55   and name HA  )  5.00  3.20  0.80
assi (resi 46   and name HA  ) (resi 47   and name HA  )  4.50  2.70  0.80
assi (resi 46   and name HA  ) (resi 47   and name HB#  )  4.50  2.70  1.80
assi (resi 46   and name HA  ) (resi 47   and name HN  )  2.00  0.20  0.80
assi (resi 46   and name HD#  ) (resi 58   and name HN  )  4.00  2.20  1.80
assi (resi 46   and name HD#  ) (resi 56   and name HB  )  5.00  3.20  1.80
assi (resi 46   and name HD#  ) (resi 47   and name HA  )  5.00  3.20  1.80
assi (resi 46   and name HN  ) (resi 47   and name HA  )  5.00  3.20  0.80
assi (resi 46   and name HN  ) (resi 56   and name HG1#  )  4.50  2.70  1.60
assi (resi 46   and name HN  ) (resi 56   and name HG2#  )  2.00  0.20  1.60
assi (resi 46   and name HE  ) (resi 56   and name HG1#  )  3.00  1.20  1.60

! residue 47   Glu , intraresidue NOEs, Nnoesy
assi (resi 47   and name HA  ) (resi 47   and name HN  )  3.00  1.20  0.80
assi (resi 47   and name HG#  ) (resi 47   and name HN  )  4.50  2.70  1.80
assi (resi 47   and name HB#  ) (resi 47   and name HN  )  3.00  1.20  1.80

! residue 47   Glu , NOEs forward in sequence, Nnoesy
assi (resi 47   and name HA  ) (resi 48   and name HN  )  4.50  2.70  0.80
assi (resi 47   and name HG#  ) (resi 48   and name HN  )  2.00  0.20  1.80
assi (resi 47   and name HG#  ) (resi 54   and name HN  )  4.50  2.70  1.80
assi (resi 47   and name HB#  ) (resi 54   and name HN  )  5.00  3.20  1.80
assi (resi 47   and name HG#  ) (resi 55   and name HN  )  4.50  2.70  1.80
assi (resi 47   and name HA  ) (resi 56   and name HN  )  3.50  1.70  0.80
assi (resi 47   and name HB#  ) (resi 56   and name HN  )  3.00  1.20  1.80
assi (resi 47   and name HG#  ) (resi 56   and name HN  )  5.00  3.20  1.80

! residue 47   Glu , intraresidue NOEs, Cnoesy
assi (resi 47   and name HA  ) (resi 47   and name HB#  )  3.00  1.20  1.80
assi (resi 47   and name HA  ) (resi 47   and name HG#  )  3.50  1.70  1.80
assi (resi 47   and name HA  ) (resi 47   and name HN  )  3.00  1.20  0.80
assi (resi 47   and name HG#  ) (resi 47   and name HN  )  4.50  2.70  1.80
assi (resi 47   and name HG#  ) (resi 47   and name HB#  )  2.50  0.70  2.80

! residue 47   Glu , NOEs forward in sequence, Cnoesy
assi (resi 47   and name HA  ) (resi 56   and name HG1#  )  2.50  0.70  1.60
assi (resi 47   and name HA  ) (resi 56   and name HG2#  )  2.50  0.70  1.60
assi (resi 47   and name HA  ) (resi 48   and name HN  )  3.50  1.70  0.80
assi (resi 47   and name HG#  ) (resi 56   and name HN  )  5.00  3.20  1.80
assi (resi 47   and name HG#  ) (resi 48   and name HA  )  4.00  2.20  1.80
assi (resi 47   and name HG#  ) (resi 56   and name HG1#  )  5.00  3.20  2.60
assi (resi 47   and name HB#  ) (resi 56   and name HG1#  )  4.50  2.70  2.60
assi (resi 47   and name HB#  ) (resi 48   and name HB#  )  4.00  2.20  2.80
assi (resi 47   and name HB#  ) (resi 54   and name HA1  )  4.00  2.20  1.80
assi (resi 47   and name HB#  ) (resi 55   and name HA  )  2.00  0.20  1.80
assi (resi 47   and name HG#  ) (resi 55   and name HA  )  4.00  2.20  1.80

! residue 48   Ser , intraresidue NOEs, Nnoesy
assi (resi 48   and name HN  ) (resi 48   and name HB#  )  3.00  1.20  1.80
assi (resi 48   and name HN  ) (resi 48   and name HA  )  3.00  1.20  0.80

! residue 48   Ser , NOEs forward in sequence, Nnoesy
assi (resi 48   and name HN  ) (resi 54   and name HA1  )  4.50  2.70  0.80
assi (resi 48   and name HN  ) (resi 49   and name HN  )  4.50  2.70  0.80
assi (resi 48   and name HA  ) (resi 49   and name HN  )  2.00  0.20  0.80
assi (resi 48   and name HB#  ) (resi 49   and name HN  )  4.00  2.20  1.80
assi (resi 48   and name HB#  ) (resi 51   and name HN  )  3.00  1.20  1.80
assi (resi 48   and name HA  ) (resi 51   and name HN  )  5.00  3.20  0.80
assi (resi 48   and name HB#  ) (resi 54   and name HN  )  4.50  2.70  1.80
assi (resi 48   and name HN  ) (resi 54   and name HN  )  5.00  3.20  0.80
assi (resi 48   and name HN  ) (resi 56   and name HN  )  5.00  3.20  0.80
assi (resi 48   and name HB#  ) (resi 51   and name HD2#  )  3.50  1.70  2.60

! residue 48   Ser , intraresidue NOEs, Cnoesy
assi (resi 48   and name HA  ) (resi 48   and name HN  )  3.00  1.20  0.80

! residue 48   Ser , NOEs forward in sequence, Cnoesy
assi (resi 48   and name HA  ) (resi 49   and name HG#  )  4.00  2.20  1.80
assi (resi 48   and name HA  ) (resi 50   and name HN  )  4.00  2.20  0.80

! residue 49   Gln , intraresidue NOEs, Nnoesy
assi (resi 49   and name HA  ) (resi 49   and name HN  )  3.00  1.20  0.80
assi (resi 49   and name HB#  ) (resi 49   and name HN  )  3.00  1.20  1.80
assi (resi 49   and name HG#  ) (resi 49   and name HN  )  2.00  0.20  1.80
assi (resi 49   and name HE22  ) (resi 49   and name HN  )  4.00  2.20  0.80
assi (resi 49   and name HE21  ) (resi 49   and name HN  )  2.50  0.70  0.80
assi (resi 49   and name HE21  ) (resi 49   and name HB#  )  4.50  2.70  1.80
assi (resi 49   and name HE21  ) (resi 49   and name HE22  )  2.00  0.20  0.80

! residue 49   Gln , NOEs forward in sequence, Nnoesy
assi (resi 49   and name HN  ) (resi 51   and name HN  )  4.50  2.70  0.80
assi (resi 49   and name HN  ) (resi 50   and name HN  )  3.00  1.20  0.80
assi (resi 49   and name HE21  ) (resi 50   and name HB#  )  4.00  2.20  1.80
assi (resi 49   and name HG#  ) (resi 50   and name HN  )  4.50  2.70  1.80
assi (resi 49   and name HE22  ) (resi 50   and name HD#  )  4.00  2.20  1.80
assi (resi 49   and name HA  ) (resi 51   and name HN  )  5.00  3.20  0.80

! residue 49   Gln , intraresidue NOEs, Cnoesy
assi (resi 49   and name HG#  ) (resi 49   and name HB#  )  2.50  0.70  2.80
assi (resi 49   and name HG#  ) (resi 49   and name HN  )  2.00  0.20  1.80
assi (resi 49   and name HG#  ) (resi 49   and name HE21  )  2.00  0.20  1.80
assi (resi 49   and name HB#  ) (resi 49   and name HN  )  3.00  1.20  1.80

! residue 49   Gln , NOEs forward in sequence, Cnoesy

! residue 50   Arg , intraresidue NOEs, Nnoesy
assi (resi 50   and name HA  ) (resi 50   and name HN  )  3.00  1.20  0.80
assi (resi 50   and name HG#  ) (resi 50   and name HN  )  4.50  2.70  1.80
assi (resi 50   and name HB#  ) (resi 50   and name HN  )  3.00  1.20  1.80
assi (resi 50   and name HG#  ) (resi 50   and name HE  )  3.00  1.20  1.80
assi (resi 50   and name HD#  ) (resi 50   and name HE  )  3.00  1.20  1.80
assi (resi 50   and name HB#  ) (resi 50   and name HE  )  4.00  2.20  1.80

! residue 50   Arg , NOEs forward in sequence, Nnoesy
assi (resi 50   and name HN  ) (resi 51   and name HA  )  4.50  2.70  0.80
assi (resi 50   and name HA  ) (resi 51   and name HN  )  3.50  1.70  0.80
assi (resi 50   and name HB#  ) (resi 51   and name HN  )  2.50  0.70  1.80
assi (resi 50   and name HG#  ) (resi 51   and name HN  )  3.50  1.70  1.80
assi (resi 50   and name HG#  ) (resi 51   and name HD2#  )  2.00  0.20  2.60
assi (resi 50   and name HB#  ) (resi 51   and name HD2#  )  3.00  1.20  2.60

! residue 50   Arg , intraresidue NOEs, Cnoesy
assi (resi 50   and name HG#  ) (resi 50   and name HA  )  3.00  1.20  1.80
assi (resi 50   and name HB#  ) (resi 50   and name HA  )  3.00  1.20  1.80
assi (resi 50   and name HN  ) (resi 50   and name HA  )  3.00  1.20  0.80
assi (resi 50   and name HD#  ) (resi 50   and name HG#  )  3.00  1.20  2.80
assi (resi 50   and name HD#  ) (resi 50   and name HB#  )  3.50  1.70  2.80
assi (resi 50   and name HD#  ) (resi 50   and name HE  )  3.00  1.20  1.80
assi (resi 50   and name HB#  ) (resi 50   and name HG#  )  2.50  0.70  2.80
assi (resi 50   and name HE  ) (resi 50   and name HG#  )  3.00  1.20  1.80

! residue 50   Arg , NOEs forward in sequence, Cnoesy
assi (resi 50   and name HD#  ) (resi 51   and name HD2#  )  4.50  2.70  2.60

! residue 51   Asn , intraresidue NOEs, Nnoesy
assi (resi 51   and name HA  ) (resi 51   and name HN  )  3.00  1.20  0.80
assi (resi 51   and name HB#  ) (resi 51   and name HN  )  3.50  1.70  1.80
assi (resi 51   and name HD2#  ) (resi 51   and name HN  )  2.50  0.70  1.60
assi (resi 51   and name HD2#  ) (resi 51   and name HB#  )  3.50  1.70  2.60

! residue 51   Asn , NOEs forward in sequence, Nnoesy
assi (resi 51   and name HN  ) (resi 53   and name HN  )  5.00  3.20  0.80
assi (resi 51   and name HB#  ) (resi 54   and name HN  )  4.50  2.70  1.80
assi (resi 51   and name HN  ) (resi 125   and name HE2  )  5.00  3.20  0.80
assi (resi 51   and name HD2#  ) (resi 125   and name HE1  )  5.00  3.20  1.80

! residue 51   Asn , intraresidue NOEs, Cnoesy
assi (resi 51   and name HB#  ) (resi 51   and name HA  )  2.50  0.70  1.80
assi (resi 51   and name HD2#  ) (resi 51   and name HA  )  2.00  0.20  1.60
assi (resi 51   and name HD2#  ) (resi 51   and name HB#  )  3.50  1.70  2.60
assi (resi 51   and name HN  ) (resi 51   and name HB#  )  3.50  1.70  1.80

! residue 52   Pro , intraresidue NOEs

! residue 52   Pro , NOEs forward in sequence

! residue 53   Gln , intraresidue NOEs, Nnoesy
assi (resi 53   and name HN  ) (resi 53   and name HA  )  3.00  1.20  0.80
assi (resi 53   and name HN  ) (resi 53   and name HB#  )  4.00  2.20  1.80
assi (resi 53   and name HN  ) (resi 53   and name HG#  )  3.50  1.70  1.80

! residue 53   Gln , NOEs forward in sequence, Nnoesy
assi (resi 53   and name HN  ) (resi 55   and name HE#  )  5.00  3.20  1.80
assi (resi 53   and name HG#  ) (resi 54   and name HN  )  5.00  3.20  1.80
assi (resi 53   and name HB#  ) (resi 54   and name HN  )  4.50  2.70  1.80
assi (resi 53   and name HA  ) (resi 54   and name HN  )  3.00  1.20  0.80

! residue 53   Gln , intraresidue NOEs, Cnoesy
assi (resi 53   and name HA  ) (resi 53   and name HG#  )  3.00  1.20  1.80
assi (resi 53   and name HA  ) (resi 53   and name HB#  )  2.50  0.70  1.80
assi (resi 53   and name HG#  ) (resi 53   and name HB#  )  3.00  1.20  2.80

! residue 53   Gln , NOEs forward in sequence, Cnoesy
assi (resi 53   and name HA  ) (resi 55   and name HA2  )  4.50  2.70  0.80
assi (resi 53   and name HA  ) (resi 71   and name HA  )  5.00  3.20  0.80
assi (resi 53   and name HN  ) (resi 54   and name HA1  )  4.00  2.20  0.80

! residue 54   Gly , intraresidue NOEs, Nnoesy
assi (resi 54   and name HA2  ) (resi 54   and name HN  )  3.00  1.20  0.80
assi (resi 54   and name HA1  ) (resi 54   and name HN  )  2.50  0.70  0.80

! residue 54   Gly , NOEs forward in sequence, Nnoesy
assi (resi 54   and name HN  ) (resi 55   and name HN  )  4.00  2.20  0.80
assi (resi 54   and name HA1  ) (resi 55   and name HA  )  4.50  2.70  0.80

! residue 54   Gly , intraresidue NOEs, Cnoesy

! residue 54   Gly , NOEs forward in sequence, Cnoesy
assi (resi 54   and name HA2  ) (resi 55   and name HN  )  2.00  0.20  0.80

! residue 55   Phe , intraresidue NOEs, Nnoesy
assi (resi 55   and name HA  ) (resi 55   and name HN  )  3.00  1.20  0.80
assi (resi 55   and name HB#  ) (resi 55   and name HN  )  3.50  1.70  1.80

! residue 55   Phe , NOEs forward in sequence, Nnoesy
assi (resi 55   and name HN  ) (resi 69   and name HA  )  4.00  2.20  0.80
assi (resi 55   and name HN  ) (resi 56   and name HA  )  4.50  2.70  0.80
assi (resi 55   and name HA  ) (resi 56   and name HN  )  2.00  0.20  0.80

! residue 55   Phe , intraresidue NOEs, Cnoesy
assi (resi 55   and name HB#  ) (resi 55   and name HA  )  2.50  0.70  1.80
assi (resi 55   and name HN  ) (resi 55   and name HA  )  3.00  1.20  0.80
assi (resi 55   and name HB#  ) (resi 55   and name HA  )  2.50  0.70  1.80

! residue 55   Phe , NOEs forward in sequence, Cnoesy
assi (resi 55   and name HA  ) (resi 56   and name HG1#  )  4.50  2.70  1.60
assi (resi 55   and name HB#  ) (resi 69   and name HA  )  5.00  3.20  1.80
assi (resi 55   and name HB#  ) (resi 79   and name HD#  )  5.00  3.20  2.80

! residue 56   Val , intraresidue NOEs, Nnoesy
assi (resi 56   and name HA  ) (resi 56   and name HN  )  3.00  1.20  0.80
assi (resi 56   and name HB  ) (resi 56   and name HN  )  4.00  2.20  0.80
assi (resi 56   and name HG1#  ) (resi 56   and name HN  )  3.00  1.20  1.60
assi (resi 56   and name HG2#  ) (resi 56   and name HN  )  3.00  1.20  1.60

! residue 56   Val , NOEs forward in sequence, Nnoesy
assi (resi 56   and name HN  ) (resi 69   and name HA  )  4.50  2.70  0.80
assi (resi 56   and name HN  ) (resi 69   and name HB#  )  4.50  2.70  1.80
assi (resi 56   and name HB  ) (resi 57   and name HN  )  3.00  1.20  0.80
assi (resi 56   and name HG2#  ) (resi 57   and name HN  )  4.00  2.20  1.60
assi (resi 56   and name HA  ) (resi 68   and name HN  )  3.50  1.70  0.80
assi (resi 56   and name HB  ) (resi 68   and name HN  )  3.00  1.20  0.80

! residue 56   Val , intraresidue NOEs, Cnoesy
assi (resi 56   and name HA  ) (resi 56   and name HG1#  )  4.00  2.20  1.60
assi (resi 56   and name HA  ) (resi 56   and name HB  )  2.50  0.70  0.80
assi (resi 56   and name HG1#  ) (resi 56   and name HB  )  3.00  1.20  1.60
assi (resi 56   and name HG2#  ) (resi 56   and name HB  )  3.00  1.20  1.60
assi (resi 56   and name HG2#  ) (resi 56   and name HN  )  3.00  1.20  1.60
assi (resi 56   and name HG1#  ) (resi 56   and name HN  )  3.00  1.20  1.60
assi (resi 56   and name HG1#  ) (resi 56   and name HG2#  )  3.00  1.20  2.40

! residue 56   Val , NOEs forward in sequence, Cnoesy
assi (resi 56   and name HA  ) (resi 57   and name HB#  )  4.50  2.70  1.80
assi (resi 56   and name HA  ) (resi 68   and name HB2  )  5.00  3.20  0.80
assi (resi 56   and name HA  ) (resi 68   and name HN  )  3.50  1.70  0.80
assi (resi 56   and name HB  ) (resi 69   and name HB#  )  2.50  0.70  1.80
assi (resi 56   and name HB  ) (resi 69   and name HA  )  3.50  1.70  0.80
assi (resi 56   and name HB  ) (resi 67   and name HA  )  4.00  2.20  0.80
assi (resi 56   and name HG1#  ) (resi 69   and name HB#  )  3.50  1.70  2.60
assi (resi 56   and name HG2#  ) (resi 69   and name HB#  )  3.50  1.70  2.60
assi (resi 56   and name HG1#  ) (resi 67   and name HB2  )  4.50  2.70  1.60
assi (resi 56   and name HA  ) (resi 68   and name HA  )  4.50  2.70  0.80
assi (resi 56   and name HB  ) (resi 125   and name HD1  )  2.50  0.70  0.80
assi (resi 56   and name HG1#  ) (resi 125   and name HE1  )  2.00  0.20  1.60
assi (resi 56   and name HG1#  ) (resi 125   and name HD1  )  3.50  1.70  1.60

! residue 56   Val , NOEs forward in sequence, Label to Unlabel noesy
assi (resi 56   and name HA  ) (resi 125   and name HE1  )  4.50  2.70  0.80
assi (resi 56   and name HG1#  ) (resi 125   and name HE1  )  2.00  0.20  1.60

! residue 57   Leu , intraresidue NOEs, Nnoesy
assi (resi 57   and name HA  ) (resi 57   and name HN  )  3.00  1.20  0.80
assi (resi 57   and name HB#  ) (resi 57   and name HN  )  2.50  0.70  1.80
assi (resi 57   and name HG  ) (resi 57   and name HN  )  5.00  3.20  0.80

! residue 57   Leu , NOEs forward in sequence, Nnoesy
assi (resi 57   and name HN  ) (resi 68   and name HA  )  4.00  2.20  0.80
assi (resi 57   and name HN  ) (resi 68   and name HN  )  2.00  0.20  0.80
assi (resi 57   and name HN  ) (resi 69   and name HB#  )  4.50  2.70  1.80
assi (resi 57   and name HD2#  ) (resi 58   and name HN  )  3.00  1.20  1.60
assi (resi 57   and name HA  ) (resi 68   and name HN  )  4.00  2.20  0.80
assi (resi 57   and name HB#  ) (resi 68   and name HN  )  3.00  1.20  1.60

! residue 57   Leu , intraresidue NOEs, Cnoesy
assi (resi 57   and name HB#  ) (resi 57   and name HA  )  3.00  1.20  1.80
assi (resi 57   and name HD2#  ) (resi 57   and name HA  )  2.50  0.70  1.60
assi (resi 57   and name HD2#  ) (resi 57   and name HB#  )  4.00  2.20  2.60

! residue 57   Leu , NOEs forward in sequence, Cnoesy
assi (resi 57   and name HA  ) (resi 68   and name HN  )  4.00  2.20  0.80
assi (resi 57   and name HA  ) (resi 68   and name HB2  )  5.00  3.20  0.80
assi (resi 57   and name HD2#  ) (resi 58   and name HN  )  3.00  1.20  1.60
assi (resi 57   and name HD2#  ) (resi 58   and name HG  )  3.00  1.20  1.60
assi (resi 57   and name HG  ) (resi 58   and name HN  )  5.00  3.20  0.80
assi (resi 57   and name HB#  ) (resi 58   and name HA  )  5.00  3.20  1.80
assi (resi 57   and name HG  ) (resi 59   and name HD2#  )  4.50  2.70  1.60
assi (resi 57   and name HB#  ) (resi 67   and name HA  )  4.50  2.70  1.80

! residue 58   Ser , intraresidue NOEs, Nnoesy
assi (resi 58   and name HA  ) (resi 58   and name HN  )  3.00  1.20  0.80
assi (resi 58   and name HB#  ) (resi 58   and name HN  )  3.50  1.70  1.80

! residue 58   Ser , NOEs forward in sequence, Nnoesy
assi (resi 58   and name HN  ) (resi 67   and name HA  )  4.50  2.70  0.80
assi (resi 58   and name HN  ) (resi 59   and name HD2#  )  4.50  2.70  1.60
assi (resi 58   and name HA  ) (resi 67   and name HN  )  4.50  2.70  0.80
assi (resi 58   and name HA  ) (resi 68   and name HN  )  4.00  2.20  0.80

! residue 58   Ser , intraresidue NOEs, Cnoesy

! residue 58   Ser , NOEs forward in sequence, Cnoesy
assi (resi 58   and name HN  ) (resi 67   and name HA  )  4.50  2.70  0.80

! residue 59   Leu , intraresidue NOEs, Nnoesy
assi (resi 59   and name HN  ) (resi 59   and name HA  )  3.00  1.20  0.80
assi (resi 59   and name HN  ) (resi 59   and name HB#  )  4.00  2.20  1.80
assi (resi 59   and name HN  ) (resi 59   and name HD1#  )  5.00  3.20  1.60
assi (resi 59   and name HN  ) (resi 59   and name HD2#  )  4.00  2.20  1.60
assi (resi 59   and name HB#  ) (resi 59   and name HD2#  )  3.50  1.70  2.60

! residue 59   Leu , NOEs forward in sequence, Nnoesy
assi (resi 59   and name HN  ) (resi 66   and name HA  )  5.00  3.20  0.80
assi (resi 59   and name HN  ) (resi 60   and name HA  )  4.50  2.70  0.80
assi (resi 59   and name HN  ) (resi 65   and name HB  )  4.50  2.70  0.80
assi (resi 59   and name HN  ) (resi 66   and name HN  )  3.00  1.20  0.80
assi (resi 59   and name HA  ) (resi 60   and name HN  )  2.00  0.20  0.80
assi (resi 59   and name HB#  ) (resi 60   and name HN  )  3.50  1.70  1.80
assi (resi 59   and name HD2#  ) (resi 60   and name HN  )  4.50  2.70  1.60
assi (resi 59   and name HB#  ) (resi 66   and name HN  )  5.00  3.20  1.80
assi (resi 59   and name HD1#  ) (resi 106   and name HA  )  3.50  1.70  1.60
assi (resi 59   and name HD1#  ) (resi 107   and name HN  )  4.00  2.20  1.60

! residue 59   Leu , intraresidue NOEs, Cnoesy
assi (resi 59   and name HN  ) (resi 59   and name HA  )  3.00  1.20  0.80
assi (resi 59   and name HD1#  ) (resi 59   and name HA  )  5.00  3.20  1.60
assi (resi 59   and name HD2#  ) (resi 59   and name HA  )  2.50  0.70  1.60
assi (resi 59   and name HD2#  ) (resi 59   and name HB#  )  3.50  1.70  2.60
assi (resi 59   and name HD2#  ) (resi 59   and name HN  )  4.00  2.20  1.60
assi (resi 59   and name HD1#  ) (resi 59   and name HB#  )  3.50  1.70  2.60

! residue 59   Leu , NOEs forward in sequence, Cnoesy
assi (resi 59   and name HA  ) (resi 60   and name HB2  )  4.50  2.70  0.80
assi (resi 59   and name HB#  ) (resi 66   and name HG#  )  5.00  3.20  2.80
assi (resi 59   and name HN  ) (resi 67   and name HA  )  4.00  2.20  0.80

! residue 60   Cys , intraresidue NOEs, Nnoesy
assi (resi 60   and name HA  ) (resi 60   and name HN  )  3.00  1.20  0.80
assi (resi 60   and name HB1  ) (resi 60   and name HN  )  3.50  1.70  0.80
assi (resi 60   and name HB2  ) (resi 60   and name HN  )  2.50  0.70  0.80

! residue 60   Cys , NOEs forward in sequence, Nnoesy
assi (resi 60   and name HN  ) (resi 61   and name HN  )  4.00  2.20  0.80
assi (resi 60   and name HB1  ) (resi 61   and name HN  )  4.00  2.20  0.80

! residue 60   Cys , intraresidue NOEs, Cnoesy

! residue 60   Cys , NOEs forward in sequence, Cnoesy
assi (resi 60   and name HB1  ) (resi 65   and name HG1#  )  4.00  2.20  1.60

! residue 61   His , intraresidue NOEs, Nnoesy
assi (resi 60   and name HN  ) (resi 61   and name HA  )  3.00  1.20  0.80
assi (resi 60   and name HN  ) (resi 61   and name HB1  )  3.50  1.70  0.80
assi (resi 60   and name HN  ) (resi 61   and name HB2  )  3.50  1.70  0.80

! residue 61   His , NOEs forward in sequence, Nnoesy
assi (resi 61   and name HN  ) (resi 64   and name HN  )  4.00  2.20  0.80
assi (resi 61   and name HN  ) (resi 65   and name HG#  )  3.50  1.70  1.80
assi (resi 61   and name HB2  ) (resi 62   and name HN  )  2.50  0.70  0.80
assi (resi 61   and name HB1  ) (resi 62   and name HN  )  3.50  1.70  0.80
assi (resi 61   and name HA  ) (resi 62   and name HN  )  3.00  1.20  0.80
assi (resi 61   and name HN  ) (resi 62   and name HN  )  4.50  2.70  0.80
assi (resi 61   and name HA  ) (resi 63   and name HN  )  4.50  2.70  0.80
assi (resi 61   and name HB1  ) (resi 63   and name HN  )  5.00  3.20  0.80
assi (resi 61   and name HB2  ) (resi 64   and name HN  )  3.50  1.70  0.80
assi (resi 61   and name HN  ) (resi 64   and name HN  )  4.50  2.70  0.80

! residue 61   His , intraresidue NOEs, Cnoesy

! residue 61   His , NOEs forward in sequence, Cnoesy
assi (resi 61   and name HB2  ) (resi 64   and name HD#  )  5.00  3.20  1.80
assi (resi 61   and name HN  ) (resi 64   and name HG1#  )  3.50  1.70  1.60

! residue 62   Leu , intraresidue NOEs, Nnoesy
assi (resi 62   and name HN  ) (resi 62   and name HD1#  )  5.00  3.20  1.60
assi (resi 62   and name HN  ) (resi 62   and name HA  )  3.00  1.20  0.80
 
! residue 62   Leu , NOEs forward in sequence, Nnoesy
assi (resi 62   and name HN  ) (resi 106   and name HD2#  )  4.50  2.70  1.60
assi (resi 62   and name HN  ) (resi 63   and name HG#  )  3.50  1.70  1.80
assi (resi 62   and name HN  ) (resi 63   and name HN  )  3.50  1.70  0.80
assi (resi 62   and name HA  ) (resi 63   and name HN  )  2.50  0.70  0.80
assi (resi 62   and name HD1#  ) (resi 110   and name HN  )  5.00  3.20  1.60

! residue 62   Leu , intraresidue NOEs, Cnoesy
assi (resi 62   and name HA  ) (resi 62   and name HD1#  )  4.50  2.70  1.60
assi (resi 62   and name HA  ) (resi 62   and name HD2#  )  4.00  2.20  1.60
assi (resi 62   and name HA  ) (resi 62   and name HG#  )  4.50  2.70  1.80
assi (resi 62   and name HA  ) (resi 62   and name HN  )  3.00  1.20  0.80
assi (resi 62   and name HN  ) (resi 62   and name HD1#  )  5.00  3.20  1.60
assi (resi 62   and name HA ) (resi 62   and name HD1#  )  4.50  2.70  1.60

! residue 62   Leu , NOEs forward in sequence, Cnoesy
assi (resi 62   and name HA  ) (resi 63   and name HA  )  2.50  0.70  0.80
assi (resi 62   and name HD1#  ) (resi 109   and name HB1  )  4.00  2.20  1.60
assi (resi 62   and name HD1#  ) (resi 109   and name HB2  )  3.00  1.20  1.60
assi (resi 62   and name HD2#  ) (resi 109   and name HB1  )  4.00  2.20  1.60

! residue 63   Gln , intraresidue NOEs, Nnoesy
assi (resi 63   and name HA  ) (resi 63   and name HN  )  3.00  1.20  0.80
assi (resi 63   and name HB#  ) (resi 63   and name HN  )  4.00  2.20  1.80
assi (resi 63   and name HG#  ) (resi 63   and name HN  )  3.50  1.70  1.80

! residue 63   Gln , NOEs forward in sequence, Nnoesy
assi (resi 63   and name HA  ) (resi 64   and name HN  )  3.50  1.70  0.80
assi (resi 63   and name HG#  ) (resi 64   and name HN  )  4.00  2.20  1.80
assi (resi 63   and name HB#  ) (resi 64   and name HD#  )  4.00  2.20  2.80
assi (resi 63   and name HB#  ) (resi 64   and name HB#  )  4.00  2.20  2.80

! residue 63   Gln , intraresidue NOEs, Cnoesy
assi (resi 63   and name HA  ) (resi 63   and name HN  )  3.00  1.20  0.80
assi (resi 63   and name HA  ) (resi 63   and name HB#  )  2.50  0.70  1.80
assi (resi 63   and name HA  ) (resi 63   and name HG#  )  3.00  1.20  1.80
assi (resi 63   and name HG#  ) (resi 63   and name HN  )  3.50  1.70  1.80

! residue 63   Gln , NOEs forward in sequence, Cnoesy
assi (resi 63   and name HA  ) (resi 64   and name HA  )  3.50  1.70  0.80
assi (resi 63   and name HA  ) (resi 64   and name HB#  )  4.50  2.70  1.80

! residue 64   Lys , intraresidue NOEs, Nnoesy
assi (resi 64   and name HA  ) (resi 64   and name HN  )  3.00  1.20  0.80
assi (resi 64   and name HE#  ) (resi 64   and name HN  )  5.00  3.20  1.80
assi (resi 64   and name HD#  ) (resi 64   and name HN  )  3.50  1.70  1.80
assi (resi 64   and name HB#  ) (resi 64   and name HN  )  3.50  1.70  1.80
assi (resi 64   and name HG#  ) (resi 64   and name HN  )  4.50  2.70  1.80
assi (resi 64   and name HB#  ) (resi 64   and name HA  )  2.50  0.70  1.80

! residue 64   Lys , NOEs forward in sequence, Nnoesy
assi (resi 64   and name HA  ) (resi 65   and name HN  )  3.00  1.20  0.80
assi (resi 64   and name HN  ) (resi 65   and name HG#  )  5.00  3.20  1.80
assi (resi 64   and name HB#  ) (resi 65   and name HN  )  3.50  1.70  1.80
assi (resi 64   and name HD#  ) (resi 65   and name HN  )  5.00  3.20  1.80
assi (resi 64   and name HN  ) (resi 65   and name HN  )  4.50  2.70  0.80

! residue 64   Lys , intraresidue NOEs, Cnoesy
assi (resi 64   and name HN  ) (resi 64   and name HA  )  3.00  1.20  0.80
assi (resi 64   and name HN  ) (resi 64   and name HD#  )  3.50  1.70  1.80
assi (resi 64   and name HN  ) (resi 64   and name HB#  )  3.50  1.70  1.80
assi (resi 64   and name HA  ) (resi 64   and name HB#  )  2.50  0.70  1.80
assi (resi 64   and name HE#  ) (resi 64   and name HG#  )  2.50  0.70  2.80
assi (resi 64   and name HD#  ) (resi 64   and name HG#  )  2.50  0.70  2.80
assi (resi 64   and name HB#  ) (resi 64   and name HG#  )  2.50  0.70  2.80

! residue 64   Lys , NOEs forward in sequence, Cnoesy
assi (resi 64   and name HB#  ) (resi 65   and name HN  )  3.50  1.70  1.80
assi (resi 64   and name HG#  ) (resi 65   and name HN  )  3.00  1.20  1.80
assi (resi 64   and name HG#  ) (resi 66   and name HB#  )  4.00  2.20  2.80
assi (resi 64   and name HG#  ) (resi 66   and name HD#  )  4.50  2.70  2.80
assi (resi 64   and name HD#  ) (resi 66   and name HD#  )  4.00  2.20  2.80

! residue 65   Val , intraresidue NOEs, Nnoesy
assi (resi 65   and name HG2#  ) (resi 65   and name HN  )  2.00  0.20  1.60
assi (resi 65   and name HG1#  ) (resi 65   and name HN  )  2.00  3.50  1.60
assi (resi 66   and name HA  ) (resi 66   and name HN  )  3.00  1.20  0.80

! residue 65   Val , NOEs forward in sequence, Nnoesy
assi (resi 65   and name HB  ) (resi 66   and name HN  )  3.00  1.20  0.80
assi (resi 65   and name HG1#  ) (resi 66   and name HN  )  4.50  2.70  1.60

! residue 65   Val , intraresidue NOEs, Cnoesy
assi (resi 65   and name HB  ) (resi 65   and name HG1#  )  2.50  0.70  1.60
assi (resi 65   and name HG2#  ) (resi 65   and name HG1#  )  3.50  1.70  2.40
assi (resi 65   and name HB  ) (resi 65   and name HG2#  )  3.00  1.20  1.60

! residue 65   Val , NOEs forward in sequence, Cnoesy
assi (resi 65   and name HG1#  ) (resi 66   and name HN  )  4.50  2.70  1.60
assi (resi 65   and name HA  ) (resi 66   and name HN  )  2.00  3.50  0.80
assi (resi 65   and name HN  ) (resi 66   and name HA  )  4.50  2.70  0.80
assi (resi 65   and name HA  ) (resi 66   and name HA  )  4.50  2.70  0.80
assi (resi 65   and name HB  ) (resi 66   and name HA  )  4.50  2.70  0.80
assi (resi 65   and name HA  ) (resi 66   and name HB#  )  4.50  2.70  1.80
assi (resi 65   and name HN  ) (resi 66   and name HB#  )  4.50  2.70  1.80

! residue 66   Lys , intraresidue NOEs, Nnoesy
assi (resi 66   and name HA  ) (resi 66   and name HN  )  3.00  1.20  0.80
assi (resi 66   and name HB#  ) (resi 66   and name HN  )  3.50  1.70  1.80
assi (resi 66   and name HD#  ) (resi 66   and name HN  )  4.50  2.70  1.80
assi (resi 66   and name HG#  ) (resi 66   and name HN  )  3.50  1.70  1.80

! residue 66   Lys , NOEs forward in sequence, Nnoesy
assi (resi 66   and name HN  ) (resi 67   and name HA  )  5.00  3.20  0.80
assi (resi 66   and name HA  ) (resi 67   and name HN  )  2.50  0.70  0.80
assi (resi 66   and name HG#  ) (resi 67   and name HN  )  3.00  1.20  1.80
assi (resi 66   and name HD#  ) (resi 67   and name HN  )  4.50  2.70  1.80

! residue 66   Lys , intraresidue NOEs, Cnoesy
assi (resi 66   and name HN  ) (resi 66   and name HA  )  3.00  1.20  0.80
assi (resi 66   and name HB#  ) (resi 66   and name HA  )  2.50  0.70  1.80
assi (resi 66   and name HD#  ) (resi 66   and name HA  )  4.50  2.70  1.80
assi (resi 66   and name HG#  ) (resi 66   and name HA  )  4.00  2.20  1.80
assi (resi 66   and name HD#  ) (resi 66   and name HB#  )  2.50  0.70  2.80
assi (resi 66   and name HG#  ) (resi 66   and name HB#  )  3.00  1.20  2.80
assi (resi 66   and name HG#  ) (resi 66   and name HD#  )  3.00  1.20  2.80
assi (resi 66   and name HB#  ) (resi 66   and name HD#  )  2.50  0.70  2.80

! residue 66   Lys , NOEs forward in sequence, Cnoesy
assi (resi 66   and name HA  ) (resi 67   and name HN  )  2.00  3.50  0.80
assi (resi 66   and name HD#  ) (resi 67   and name HN  )  4.50  2.70  1.80
assi (resi 66   and name HG#  ) (resi 67   and name HA  )  4.00  2.20  1.80
assi (resi 66   and name HB#  ) (resi 126   and name HG#  )  3.00  1.20  2.80
assi (resi 66   and name HA  ) (resi 67   and name HA  )  4.50  2.70  0.80

! residue 67   His , intraresidue NOEs, Nnoesy
assi (resi 67   and name HA  ) (resi 67   and name HN  )  3.00  1.20  0.80
assi (resi 67   and name HB1  ) (resi 67   and name HN  )  4.00  2.20  0.80
assi (resi 67   and name HB2  ) (resi 67   and name HN  )  3.00  1.20  0.80

! residue 67   His , NOEs forward in sequence, Nnoesy
assi (resi 67   and name HA  ) (resi 68   and name HN  )  2.00  3.50  0.80
assi (resi 67   and name HB1  ) (resi 68   and name HN  )  3.00  1.20  0.80
assi (resi 67   and name HB2  ) (resi 68   and name HN  )  4.00  2.20  0.80
assi (resi 67   and name HA  ) (resi 69   and name HN  )  5.00  3.20  0.80

! residue 67   His , intraresidue NOEs, Cnoesy
assi (resi 67   and name HA  ) (resi 67   and name HN  )  3.00  1.20  0.80

! residue 67   His , NOEs forward in sequence, Cnoesy
assi (resi 67   and name HA  ) (resi 68   and name HA  )  4.50  2.70  0.80

! residue 68   Tyr , intraresidue NOEs, Nnoesy
assi (resi 68   and name HA  ) (resi 68   and name HN  )  3.00  1.20  0.80
assi (resi 68   and name HB1  ) (resi 68   and name HN  )  3.00  1.20  0.80
assi (resi 68   and name HB2  ) (resi 68   and name HN  )  3.00  1.20  0.80
assi (resi 68   and name HD#  ) (resi 68   and name HN  )  4.50  2.70  1.80

! residue 68   Tyr , NOEs forward in sequence, Nnoesy
assi (resi 68   and name HN  ) (resi 69   and name HA  )  4.50  2.70  0.80
assi (resi 68   and name HN  ) (resi 69   and name HB#  )  4.00  2.20  1.80
assi (resi 68   and name HB1  ) (resi 69   and name HN  )  4.00  2.20  0.80
assi (resi 68   and name HB2  ) (resi 69   and name HN  )  4.50  2.70  0.80
assi (resi 68   and name HD#  ) (resi 69   and name HN  )  4.00  2.20  1.80

! residue 68   Tyr , intraresidue NOEs, Cnoesy
assi (resi 68   and name HA  ) (resi 68   and name HB1  )  3.00  1.20  0.80

! residue 68   Tyr , NOEs forward in sequence, Cnoesy
assi (resi 68   and name HA  ) (resi 70   and name HG1#  )  4.50  2.70  1.60
assi (resi 68   and name HA  ) (resi 69   and name HA  )  4.50  2.70  0.80
assi (resi 68   and name HA  ) (resi 81   and name HD#  )  4.50  2.70  1.80

! residue 69   Leu , intraresidue NOEs, Nnoesy
assi (resi 69   and name HA  ) (resi 69   and name HN  )  3.00  1.20  0.80
assi (resi 69   and name HD1#  ) (resi 69   and name HN  )  3.00  1.20  1.60

! residue 69   Leu , NOEs forward in sequence, Nnoesy
assi (resi 69   and name HN  ) (resi 70   and name HG1#  )  3.50  1.70  1.60
assi (resi 69   and name HD1#  ) (resi 127   and name HD22  )  5.00  3.20  1.60
assi (resi 69   and name HN  ) (resi 125   and name HD1  )  2.00  3.50  0.80
assi (resi 69   and name HN  ) (resi 125   and name HE1  )  4.00  2.20  0.80
assi (resi 69   and name HN  ) (resi 125   and name HB1  )  2.50  0.70  0.80
assi (resi 69   and name HN  ) (resi 125   and name HB2  )  4.00  2.20  0.80
assi (resi 69   and name HD#  ) (resi 125   and name HD#  )  3.00  1.20  2.80
assi (resi 69   and name HN  ) (resi 126   and name HB  )  4.00  2.20  0.80

! residue 69   Leu , intraresidue NOEs, Cnoesy
assi (resi 69   and name HB#  ) (resi 69   and name HA  )  2.50  0.70  1.80
assi (resi 69   and name HB#  ) (resi 69   and name HD1#  )  3.50  1.70  2.60
assi (resi 69   and name HB#  ) (resi 69   and name HD2#  )  3.50  1.70  2.60

! residue 69   Leu , NOEs forward in sequence, Cnoesy
assi (resi 69   and name HD1#  ) (resi 70   and name HG1#  )  5.00  3.20  2.40
assi (resi 69   and name HD1#  ) (resi 125   and name HE2  )  3.50  1.70  1.60
assi (resi 69   and name HD1#  ) (resi 125   and name HE2  )  2.50  0.70  1.60

! residue 69   Leu , NOEs forward in sequence, Label to Unlabel noesy
assi (resi 69   and name HB#  ) (resi 125   and name HD1  )  2.00  3.50  1.80
assi (resi 69   and name HD1#  ) (resi 125   and name HE1  )  2.50  0.70  1.60
assi (resi 69   and name HD2#  ) (resi 125   and name HE1  )  5.00  3.20  1.60

! residue 70   Ile , intraresidue NOEs, Nnoesy

! residue 70   Ile , NOEs forward in sequence, Nnoesy
assi (resi 70   and name HN  ) (resi 127   and name HD22  )  2.00  3.50  0.80

! residue 70   Ile , NOEs forward in sequence, Label to Unlabel noesy
assi (resi 70   and name HG2#  ) (resi 128   and name HE22  )  3.00  1.20  1.60
assi (resi 70   and name HD1#  ) (resi 128   and name HE22  )  3.00  1.20  1.60
assi (resi 70   and name HD1#  ) (resi 126   and name HN  )  2.00  3.50  1.60
assi (resi 70   and name HG1#  ) (resi 126   and name HN  )  3.00  1.20  1.60

! residue 70   Ile , intraresidue NOEs, Cnoesy

! residue 70   Ile , NOEs forward in sequence, Cnoesy
assi (resi 70   and name HG1#  ) (resi 125   and name HD#  )  3.50  1.70  2.60
assi (resi 70   and name HG2#  ) (resi 125   and name HD#  )  5.00  3.20  2.60

! residue 70   Ile , NOEs forward in sequence, Label to Unlabel noesy
assi (resi 70   and name HG1#  ) (resi 125   and name HD1  )  4.00  2.20  1.60
assi (resi 70   and name HD1#  ) (resi 127   and name HN  )  2.50  0.70  1.60
assi (resi 70   and name HG1#  ) (resi 127   and name HD22  )  2.50  0.70  1.60
assi (resi 70   and name HG2#  ) (resi 127   and name HD22  )  5.00  3.20  1.60
assi (resi 70   and name HD1#  ) (resi 127   and name HD22  )  3.50  1.70  1.60
assi (resi 70   and name HG2#  ) (resi 128   and name HE22  )  4.00  2.20  1.60
assi (resi 70   and name HG1#  ) (resi 128   and name HE22  )  5.00  3.20  1.60
assi (resi 70   and name HG1#  ) (resi 130   and name HN  )  4.50  2.70  1.60
assi (resi 70   and name HD1#  ) (resi 130   and name HN  )  3.50  1.70  1.60

! residue 71   Leu , intraresidue NOEs, Nnoesy

! residue 71   Leu , NOEs forward in sequence, Nnoesy
assi (resi 71   and name HB#  ) (resi 80   and name HN  )  4.00  2.20  1.80

! residue 71   Leu , intraresidue NOEs, Cnoesy

! residue 71   Leu , NOEs forward in sequence, Cnoesy
assi (resi 71   and name HD1#  ) (resi 81   and name HN  )  3.50  1.70  1.60
assi (resi 71   and name HN  ) (resi 81   and name HA  )  4.00  2.20  0.80

! residue 71   Leu , NOEs forward in sequence, Label to Unlabel noesy
assi (resi 71   and name HD#  ) (resi 127   and name HD22  )  4.00  2.20  3.20
assi (resi 71   and name HD2#  ) (resi 128   and name HE22  )  3.50  1.70  1.60

! residue 72   Pro , intraresidue NOEs

! residue 72   Pro , NOEs forward in sequence

! residue 73   Ser , intraresidue NOEs, Nnoesy
assi (resi 73   and name HN  ) (resi 73   and name HA  )  3.00  1.20  0.80
assi (resi 73   and name HN  ) (resi 73   and name HB#  )  2.50  0.70  1.80

! residue 73   Ser , NOEs forward in sequence, Nnoesy
assi (resi 73   and name HN  ) (resi 79   and name HA  )  4.50  2.70  0.80
assi (resi 73   and name HN  ) (resi 74   and name HN  )  4.50  2.70  0.80
assi (resi 73   and name HA  ) (resi 74   and name HN  )  2.00  3.50  0.80
assi (resi 73   and name HB#  ) (resi 79   and name HN  )  4.00  2.20  1.80
assi (resi 73   and name HA  ) (resi 79   and name HN  )  4.00  2.20  0.80
assi (resi 73   and name HA  ) (resi 80   and name HN  )  4.00  2.20  0.80
assi (resi 73   and name HN  ) (resi 80   and name HN  )  4.50  2.70  0.80

! residue 73   Ser , intraresidue NOEs, Cnoesy

! residue 73   Ser , NOEs forward in sequence, Cnoesy
assi (resi 73   and name HB#  ) (resi 79   and name HA  )  3.00  1.20  1.80

! residue 74   Glu , intraresidue NOEs, Nnoesy
assi (resi 74   and name HN  ) (resi 74   and name HA  )  3.00  1.20  0.80
assi (resi 74   and name HN  ) (resi 74   and name HB#  )  3.50  1.70  1.80
assi (resi 74   and name HN  ) (resi 74   and name HG#  )  4.00  2.20  1.80

! residue 74   Glu , NOEs forward in sequence, Nnoesy
assi (resi 74   and name HN  ) (resi 75   and name HN  )  4.50  2.70  0.80
assi (resi 74   and name HN  ) (resi 80   and name HD#  )  3.50  1.70  1.80
assi (resi 74   and name HN  ) (resi 79   and name HA  )  4.50  2.70  0.80
assi (resi 74   and name HN  ) (resi 77   and name HA1  )  5.00  3.20  0.80
assi (resi 74   and name HG#  ) (resi 75   and name HN  )  4.00  2.20  1.80
assi (resi 74   and name HA  ) (resi 75   and name HN  )  2.50  0.70  0.80
assi (resi 74   and name HA  ) (resi 76   and name HN  )  4.00  2.20  0.80
assi (resi 74   and name HG#  ) (resi 76   and name HN  )  5.00  3.20  1.80
assi (resi 74   and name HB#  ) (resi 76   and name HN  )  2.50  0.70  1.80
assi (resi 74   and name HA  ) (resi 77   and name HN  )  5.00  3.20  0.80
assi (resi 74   and name HB#  ) (resi 77   and name HN  )  4.00  2.20  1.80

! residue 74   Glu , intraresidue NOEs, Cnoesy

! residue 74   Glu , NOEs forward in sequence, Cnoesy
assi (resi 74   and name HB#  ) (resi 76   and name HN  )  2.50  0.70  1.80
assi (resi 74   and name HB#  ) (resi 75   and name HN  )  2.00  3.50  1.80
assi (resi 74   and name HB#  ) (resi 75   and name HA  )  4.50  2.70  1.80
assi (resi 74   and name HB#  ) (resi 75   and name HG#  )  4.50  2.70  2.80
assi (resi 74   and name HB#  ) (resi 76   and name HG#  )  3.50  1.70  2.80
assi (resi 74   and name HB#  ) (resi 76   and name HB#  )  4.00  2.20  2.80
assi (resi 74   and name HN  ) (resi 79   and name HA  )  4.50  2.70  0.80

! residue 75   Glu , intraresidue NOEs, Nnoesy
assi (resi 75   and name HG#  ) (resi 75   and name HN  )  2.50  0.70  1.80
assi (resi 75   and name HA  ) (resi 75   and name HN  )  3.00  1.20  0.80

! residue 75   Glu , NOEs forward in sequence, Nnoesy
assi (resi 75   and name HN  ) (resi 76   and name HN  )  2.50  0.70  0.80
assi (resi 75   and name HG#  ) (resi 76   and name HN  )  4.50  2.70  1.80
assi (resi 75   and name HA  ) (resi 77   and name HN  )  3.50  1.70  0.80

! residue 75   Glu , intraresidue NOEs, Cnoesy
assi (resi 75   and name HN  ) (resi 75   and name HA  )  3.00  1.20  0.80

! residue 75   Glu , NOEs forward in sequence, Cnoesy

! residue 76   Glu , intraresidue NOEs, Nnoesy
assi (resi 76   and name HA  ) (resi 76   and name HN  )  3.00  1.20  0.80
assi (resi 76   and name HG#  ) (resi 76   and name HN  )  3.00  1.20  1.80
assi (resi 76   and name HB#  ) (resi 76   and name HN  )  3.00  1.20  1.80

! residue 76   Glu , NOEs forward in sequence, Nnoesy
assi (resi 76   and name HG#  ) (resi 77   and name HN  )  3.50  1.70  1.80
assi (resi 76   and name HB#  ) (resi 77   and name HN  )  4.50  2.70  1.80
assi (resi 76   and name HN  ) (resi 77   and name HN  )  2.00  3.50  0.80

! residue 76   Glu , intraresidue NOEs, Cnoesy
assi (resi 76   and name HB#  ) (resi 76   and name HG#  )  3.00  1.20  2.80
assi (resi 76   and name HB#  ) (resi 76   and name HA  )  2.50  0.70  1.80
assi (resi 76   and name HN  ) (resi 76   and name HA  )  3.00  1.20  0.80

! residue 76   Glu , NOEs forward in sequence, Cnoesy
assi (resi 76   and name HG#  ) (resi 77   and name HN  )  3.50  1.70  1.80
assi (resi 76   and name HA  ) (resi 77   and name HN  )  3.50  1.70  0.80
assi (resi 76   and name HG#  ) (resi 89   and name HD#  )  4.00  2.20  2.80

! residue 77   Gly , intraresidue NOEs, Nnoesy
assi (resi 77   and name HA1  ) (resi 77   and name HN  )  2.50  0.70  0.80
assi (resi 77   and name HA2  ) (resi 77   and name HN  )  3.00  1.20  0.80

! residue 77   Gly , NOEs forward in sequence, Nnoesy
assi (resi 77   and name HN  ) (resi 78   and name HA  )  4.50  2.70  0.80
assi (resi 77   and name HN  ) (resi 89   and name HD#  )  5.00  3.20  1.80
assi (resi 77   and name HN  ) (resi 78   and name HN  )  4.00  2.20  0.80
assi (resi 77   and name HA1  ) (resi 78   and name HN  )  3.00  1.20  0.80
assi (resi 77   and name HA2  ) (resi 78   and name HN  )  2.50  0.70  0.80

! residue 77   Gly , intraresidue NOEs, Cnoesy
assi (resi 77   and name HA1  ) (resi 77   and name HA2  )  2.00  3.50  0.80
assi (resi 77   and name HA1  ) (resi 77   and name HN  )  2.50  0.70  0.80
assi (resi 77   and name HA2  ) (resi 77   and name HN  )  3.00  1.20  0.80

! residue 77   Gly , NOEs forward in sequence, Cnoesy
assi (resi 77   and name HA1  ) (resi 78   and name HA  )  4.50  2.70  0.80
assi (resi 77   and name HA2  ) (resi 78   and name HA  )  4.50  2.70  0.80
assi (resi 77   and name HN  ) (resi 78   and name HA  )  4.50  2.70  0.80
assi (resi 77   and name HA2  ) (resi 90   and name HA  )  4.50  2.70  0.80

! residue 78   Arg , intraresidue NOEs, Nnoesy
assi (resi 78   and name HN  ) (resi 78   and name HD#  )  4.00  2.20  1.80
assi (resi 78   and name HN  ) (resi 78   and name HA  )  3.00  1.20  0.80

! residue 78   Arg , NOEs forward in sequence, Nnoesy
assi (resi 78   and name HN  ) (resi 90   and name HB#  )  3.50  1.70  1.80
assi (resi 78   and name HN  ) (resi 90   and name HA  )  2.50  0.70  0.80
assi (resi 78   and name HN  ) (resi 91   and name HN  )  4.50  2.70  0.80
assi (resi 78   and name HN  ) (resi 79   and name HN  )  4.00  2.20  0.80
assi (resi 78   and name HA  ) (resi 79   and name HN  )  3.00  1.20  0.80
assi (resi 78   and name HB#  ) (resi 79   and name HN  )  2.00  3.50  1.80
assi (resi 78   and name HG#  ) (resi 79   and name HN  )  4.00  2.20  1.80
assi (resi 78   and name HN  ) (resi 79   and name HN  )  4.50  2.70  0.80
assi (resi 78   and name HE  ) (resi 90   and name HA  )  4.50  2.70  0.80
assi (resi 78   and name HG#  ) (resi 91   and name HN  )  2.00  3.50  1.80
assi (resi 78   and name HB#  ) (resi 91   and name HN  )  3.00  1.20  1.80

! residue 78   Arg , intraresidue NOEs, Cnoesy
assi (resi 78   and name HA  ) (resi 78   and name HB#  )  2.50  0.70  1.80
assi (resi 78   and name HA  ) (resi 78   and name HG#  )  3.50  1.70  1.80
assi (resi 78   and name HA  ) (resi 78   and name HD#  )  3.50  1.70  1.80
assi (resi 78   and name HA  ) (resi 78   and name HE  )  3.00  1.20  0.80
assi (resi 78   and name HA  ) (resi 78   and name HN  )  3.00  1.20  0.80
assi (resi 78   and name HD#  ) (resi 78   and name HG#  )  2.50  0.70  2.80
assi (resi 78   and name HD#  ) (resi 78   and name HB#  )  3.50  1.70  2.80
assi (resi 78   and name HD#  ) (resi 78   and name HE  )  3.00  1.20  1.80
assi (resi 78   and name HN  ) (resi 78   and name HB#  )  3.50  1.70  1.80
assi (resi 78   and name HN  ) (resi 78   and name HG#  )  3.50  1.70  1.80

! residue 78   Arg , NOEs forward in sequence, Cnoesy
assi (resi 78   and name HA  ) (resi 79   and name HN  )  3.00  1.20  0.80
assi (resi 78   and name HA  ) (resi 80   and name HD#  )  5.00  3.20  1.80
assi (resi 78   and name HB#  ) (resi 79   and name HN  )  2.00  3.50  1.80
assi (resi 78   and name HG#  ) (resi 90   and name HN  )  4.50  2.70  1.80
assi (resi 78   and name HB#  ) (resi 79   and name HA  )  4.50  2.70  1.80
assi (resi 78   and name HA  ) (resi 79   and name HA  )  4.50  2.70  0.80
assi (resi 78   and name HG#  ) (resi 90   and name HA  )  3.00  1.20  1.80
assi (resi 78   and name HN  ) (resi 90   and name HB#  )  3.50  1.70  1.80

! residue 79   Leu , intraresidue NOEs, Nnoesy
assi (resi 79   and name HN  ) (resi 79   and name HA  )  3.00  1.20  0.80
assi (resi 79   and name HN  ) (resi 79   and name HB#  )  3.50  1.70  1.80
assi (resi 79   and name HN  ) (resi 79   and name HG  )  4.00  2.20  0.80
assi (resi 79   and name HN  ) (resi 79   and name HD#  )  4.50  2.70  1.80

! residue 79   Leu , NOEs forward in sequence, Nnoesy
assi (resi 79   and name HN  ) (resi 91   and name HA  )  2.50  0.70  0.80
assi (resi 79   and name HN  ) (resi 91   and name HB  )  4.50  2.70  0.80
assi (resi 79   and name HN  ) (resi 90   and name HA  )  3.00  1.20  0.80
assi (resi 79   and name HD#  ) (resi 80   and name HN  )  4.50  2.70  3.20
assi (resi 79   and name HG  ) (resi 80   and name HN  )  5.00  3.20  0.80
assi (resi 79   and name HA  ) (resi 80   and name HN  )  2.00  3.50  0.80
assi (resi 79   and name HB#  ) (resi 81   and name HN  )  4.50  2.70  1.80
assi (resi 79   and name HB#  ) (resi 90   and name HN  )  4.50  2.70  1.80
assi (resi 79   and name HN  ) (resi 91   and name HN  )  3.50  1.70  0.80
assi (resi 79   and name HB#  ) (resi 92   and name HN  )  4.50  2.70  1.80
assi (resi 79   and name HN  ) (resi 92   and name HN  )  4.50  2.70  0.80

! residue 79   Leu , intraresidue NOEs, Cnoesy
assi (resi 79   and name HD#  ) (resi 79   and name HA  )  3.00  1.20  3.20
assi (resi 79   and name HB#  ) (resi 79   and name HA  )  2.50  0.70  1.80
assi (resi 79   and name HN  ) (resi 79   and name HA  )  3.00  1.20  0.80
assi (resi 79   and name HB#  ) (resi 79   and name HD#  )  3.50  1.70  4.20
assi (resi 79   and name HB#  ) (resi 79   and name HG  )  2.50  0.70  1.80
assi (resi 79   and name HB#  ) (resi 79   and name HN  )  3.50  1.70  1.80
assi (resi 79   and name HD#  ) (resi 79   and name HG  )  2.50  0.70  3.20
assi (resi 79   and name HN  ) (resi 79   and name HG  )  4.00  2.20  0.80
assi (resi 79   and name HN  ) (resi 79   and name HD#  )  4.50  2.70  3.20

! residue 79   Leu , NOEs forward in sequence, Cnoesy
assi (resi 79   and name HA  ) (resi 80   and name HA  )  4.50  2.70  0.80
assi (resi 79   and name HA  ) (resi 91   and name HA  )  4.50  2.70  0.80
assi (resi 79   and name HB#  ) (resi 80   and name HA  )  4.50  2.70  1.80

! residue 80   Tyr , intraresidue NOEs, Nnoesy
assi (resi 80   and name HB1  ) (resi 80   and name HN  )  3.50  1.70  0.80
assi (resi 80   and name HB2  ) (resi 80   and name HN  )  2.50  0.70  0.80
assi (resi 80   and name HA  ) (resi 80   and name HN  )  3.00  1.20  0.80
assi (resi 80   and name HD#  ) (resi 80   and name HN  )  3.00  1.20  1.80

! residue 80   Tyr , NOEs forward in sequence, Nnoesy
assi (resi 80   and name HN  ) (resi 81   and name HD#  )  4.00  2.20  1.80
assi (resi 80   and name HA  ) (resi 81   and name HN  )  2.00  3.50  0.80
assi (resi 80   and name HB1  ) (resi 81   and name HN  )  3.50  1.70  0.80
assi (resi 80   and name HB2  ) (resi 81   and name HN  )  4.50  2.70  0.80

! residue 80   Tyr , intraresidue NOEs, Cnoesy
assi (resi 80   and name HA  ) (resi 80   and name HB1  )  2.50  0.70  0.80
assi (resi 80   and name HA  ) (resi 80   and name HB2  )  3.00  1.20  0.80
assi (resi 80   and name HA  ) (resi 80   and name HN  )  3.00  1.20  0.80
assi (resi 80   and name HB1  ) (resi 80   and name HN  )  3.50  1.70  0.80
assi (resi 80   and name HB1  ) (resi 80   and name HD#  )  3.50  1.70  1.80

! residue 80   Tyr , NOEs forward in sequence, Cnoesy
assi (resi 80   and name HA  ) (resi 89   and name HB#  )  3.00  1.20  1.80
assi (resi 80   and name HB1  ) (resi 81   and name HN  )  3.50  1.70  0.80
assi (resi 80   and name HA  ) (resi 89   and name HA  )  2.50  0.70  0.80

! residue 81   Phe , intraresidue NOEs, Nnoesy
assi (resi 81   and name HA  ) (resi 81   and name HN  )  3.00  1.20  0.80
assi (resi 81   and name HB#  ) (resi 81   and name HN  )  4.00  2.20  1.80
assi (resi 81   and name HE#  ) (resi 81   and name HN  )  5.00  3.20  1.80

! residue 81   Phe , NOEs forward in sequence, Nnoesy
assi (resi 81   and name HB#  ) (resi 83   and name HN  )  4.00  2.20  1.80
assi (resi 81   and name HA  ) (resi 89   and name HN  )  3.00  1.20  0.80
assi (resi 81   and name HN  ) (resi 89   and name HB#  )  4.00  2.20  1.80
assi (resi 81   and name HN  ) (resi 88   and name HN  )  5.00  3.20  0.80
assi (resi 81   and name HN  ) (resi 90   and name HN  )  4.50  2.70  0.80
assi (resi 81   and name HD#  ) (resi 90   and name HN  )  5.00  3.20  1.80

! residue 81   Phe , intraresidue NOEs, Cnoesy
assi (resi 81   and name HA  ) (resi 81   and name HN  )  3.00  1.20  0.80
assi (resi 81   and name HD#  ) (resi 81   and name HB#  )  3.50  1.70  2.80
assi (resi 81   and name HN  ) (resi 81   and name HB#  )  4.00  2.20  1.80

! residue 81   Phe , NOEs forward in sequence, Cnoesy
assi (resi 81   and name HA  ) (resi 127   and name HB2  )  5.00  3.20  0.80
assi (resi 81   and name HA  ) (resi 127   and name HA  )  4.50  2.70  0.80
assi (resi 81   and name HB#  ) (resi 126   and name HG#  )  4.50  2.70  2.80
assi (resi 81   and name HB#  ) (resi 82   and name HA  )  4.50  2.70  1.80
assi (resi 81   and name HN  ) (resi 82   and name HN  )  4.50  2.70  0.80

! residue 82   Ser , intraresidue NOEs, Nnoesy

! residue 82   Ser , NOEs forward in sequence, Nnoesy
assi (resi 82   and name HN  ) (resi 127   and name HD21  )  4.00  2.20  0.80
assi (resi 82   and name HN  ) (resi 127   and name HD22  )  4.50  2.70  0.80
assi (resi 82   and name HB1  ) (resi 83   and name HN  )  4.50  2.70  0.80
assi (resi 82   and name HB2  ) (resi 83   and name HN  )  3.50  1.70  0.80
assi (resi 82   and name HA  ) (resi 83   and name HN  )  3.50  1.70  0.80
assi (resi 82   and name HA  ) (resi 86   and name HN  )  4.50  2.70  0.80
assi (resi 82   and name HA  ) (resi 87   and name HN  )  5.00  3.20  0.80
assi (resi 82   and name HA  ) (resi 88   and name HN  )  4.50  2.70  0.80

! residue 82   Ser , intraresidue NOEs, Cnoesy
assi (resi 82   and name HA  ) (resi 82   and name HN  )  3.00  1.20  0.80

! residue 82   Ser , NOEs forward in sequence, Cnoesy
assi (resi 82   and name HA  ) (resi 87   and name HA  )  3.50  1.70  0.80

! residue 83   Met , intraresidue NOEs, Nnoesy
assi (resi 83   and name HN  ) (resi 83   and name HG#  )  4.50  2.70  1.80
assi (resi 83   and name HN  ) (resi 83   and name HB#  )  3.00  1.20  1.80
assi (resi 83   and name HN  ) (resi 83   and name HA  )  2.50  0.70  0.80

! residue 83   Met , NOEs forward in sequence, Nnoesy
assi (resi 83   and name HN  ) (resi 126   and name HG#  )  3.00  1.20  1.80
assi (resi 83   and name HN  ) (resi 127   and name HB1  )  4.00  2.20  0.80
assi (resi 83   and name HN  ) (resi 127   and name HA  )  2.50  0.70  0.80
assi (resi 83   and name HN  ) (resi 86   and name HA#  )  4.00  2.20  1.80
assi (resi 83   and name HN  ) (resi 84   and name HN  )  4.50  2.70  0.80
assi (resi 83   and name HG#  ) (resi 84   and name HN  )  2.50  0.70  1.80
assi (resi 83   and name HB#  ) (resi 84   and name HN  )  3.50  1.70  1.80
assi (resi 83   and name HA  ) (resi 84   and name HN  )  2.50  0.70  0.80
assi (resi 83   and name HG#  ) (resi 85   and name HN  )  4.00  2.20  1.80
assi (resi 83   and name HB#  ) (resi 85   and name HN  )  3.00  1.20  1.80
assi (resi 83   and name HA  ) (resi 85   and name HN  )  4.00  2.20  0.80

! residue 83   Met , intraresidue NOEs, Cnoesy
assi (resi 83   and name HA  ) (resi 83   and name HN  )  3.00  1.20  0.80
assi (resi 83   and name HG#  ) (resi 83   and name HN  )  4.50  2.70  1.80

! residue 83   Met , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 83   and name HA  ) (resi 126   and name HB  )  5.00  3.20  0.80
assi (resi 83   and name HA  ) (resi 84   and name HA  )  4.50  2.70  0.80
assi (resi 83   and name HG#  ) (resi 107   and name HD1#  )  4.00  2.20  2.60
assi (resi 83   and name HG#  ) (resi 107   and name HG  )  4.50  2.70  1.80
assi (resi 83   and name HG#  ) (resi 84   and name HN  )  2.50  0.70  1.80
assi (resi 83   and name HA  ) (resi 84   and name HN  )  2.50  0.70  0.80
assi (resi 83   and name HN  ) (resi 84   and name HN  )  4.50  2.70  0.80
assi (resi 83   and name HG#  ) (resi 84   and name HB#  )  4.00  2.20  2.80

! residue 84   Asp , intraresidue NOEs,  Nnoesy
assi (resi 84   and name HB#  ) (resi 84   and name HN  )  2.50  0.70  1.80
assi (resi 84   and name HA  ) (resi 84   and name HN  )  2.50  0.70  0.80

! residue 84   Asp , NOEs forward in sequence, Nnoesy
assi (resi 84   and name HN  ) (resi 107   and name HD1#  )  4.50  2.70  1.60
assi (resi 84   and name HN  ) (resi 126   and name HG#  )  4.50  2.70  1.80
assi (resi 84   and name HN  ) (resi 107   and name HG  )  4.00  2.20  0.80
assi (resi 84   and name HN  ) (resi 86   and name HG  )  4.50  2.70  0.80
assi (resi 84   and name HB#  ) (resi 85   and name HN  )  3.00  1.20  1.80
assi (resi 84   and name HA  ) (resi 85   and name HN  )  3.50  1.70  0.80
assi (resi 84   and name HN  ) (resi 85   and name HN  )  3.00  1.20  0.80
assi (resi 84   and name HA  ) (resi 86   and name HN  )  4.00  2.20  0.80

! residue 84   Asp , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 84   and name HN  ) (resi 84   and name HA  )  2.50  0.70  0.80
assi (resi 84   and name HB#  ) (resi 84   and name HA  )  3.00  1.20  1.80

! residue 84   Asp , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 84   and name HN  ) (resi 107   and name HD1#  )  4.50  2.70  1.60
assi (resi 84   and name HN  ) (resi 126   and name HG#  )  4.50  2.70  1.80
assi (resi 84   and name HN  ) (resi 86   and name HN  )  4.50  2.70  0.80
assi (resi 84   and name HA  ) (resi 85   and name HN  )  3.50  1.70  0.80
assi (resi 84   and name HA  ) (resi 86   and name HN  )  4.00  2.20  0.80
assi (resi 84   and name HA  ) (resi 107   and name HG  )  5.00  3.20  0.80
assi (resi 84   and name HB#  ) (resi 107   and name HD2#  )  4.50  2.70  2.60
assi (resi 84   and name HB#  ) (resi 107   and name HD1#  )  3.50  1.70  2.60
assi (resi 84   and name HB#  ) (resi 107   and name HB#  )  4.50  2.70  2.80
assi (resi 84   and name HB#  ) (resi 85   and name HB#  )  5.00  3.20  2.80

! residue 85   Asp , intraresidue NOEs, Nnoesy
assi (resi 85   and name HB#  ) (resi 85   and name HN  )  2.50  0.70  1.80
assi (resi 85   and name HA  ) (resi 85   and name HN  )  3.00  1.20  0.80

! residue 85   Asp , NOEs forward in sequence, Nnoesy
assi (resi 85   and name HN  ) (resi 107   and name HG  )  4.00  2.20  0.80
assi (resi 85   and name HN  ) (resi 107   and name HA  )  4.00  2.20  0.80
assi (resi 85   and name HN  ) (resi 86   and name HN  )  3.00  1.20  0.80
assi (resi 85   and name HA  ) (resi 86   and name HN  )  3.00  1.20  0.80

! residue 85   Asp , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 85   and name HN  ) (resi 85   and name HB#  )  2.50  0.70  1.80

! residue 85   Asp , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 85   and name HN  ) (resi 107   and name HA  )  4.00  2.20  0.80
assi (resi 85   and name HB#  ) (resi 86   and name HN  )  4.00  2.20  1.80

! residue 86   Gly , intraresidue NOEs, Nnoesy
assi (resi 86   and name HN  ) (resi 86   and name HA#  )  2.50  0.70  1.80

! residue 86   Gly , NOEs forward in sequence, Nnoesy
assi (resi 86   and name HN  ) (resi 87   and name HA  )  5.00  3.20  0.80
assi (resi 86   and name HN  ) (resi 87   and name HN  )  4.00  2.20  0.80
assi (resi 86   and name HA#  ) (resi 87   and name HN  )  3.50  1.70  1.80
assi (resi 86   and name HA#  ) (resi 88   and name HN  )  4.00  2.20  1.80

! residue 86   Gly , intraresidue NOEs, Cnoesy & CNnoesy

! residue 86   Gly , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 86   and name HA#  ) (resi 87   and name HA  )  4.50  2.70  1.80

! residue 87   Gln , intraresidue NOEs, Nnoesy
assi (resi 87   and name HE22  ) (resi 87   and name HB#  )  3.50  1.70  1.80
assi (resi 87   and name HE21  ) (resi 87   and name HB#  )  2.00  3.50  1.80
assi (resi 87   and name HE22  ) (resi 87   and name HG#  )  4.00  2.20  1.80
assi (resi 87   and name HE21  ) (resi 87   and name HG#  )  3.50  1.70  1.80
assi (resi 87   and name HA  ) (resi 87   and name HN  )  3.00  1.20  0.80

! residue 87   Gln , NOEs forward in sequence, Nnoesy
assi (resi 87   and name HN  ) (resi 88   and name HA  )  4.50  2.70  0.80
assi (resi 87   and name HN  ) (resi 88   and name HN  )  2.50  0.70  0.80

! residue 87   Gln , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 87   and name HN  ) (resi 87   and name HB#  )  3.50  1.70  1.80
assi (resi 87   and name HN  ) (resi 87   and name HG#  )  3.00  1.20  1.80
assi (resi 87   and name HN  ) (resi 87   and name HA  )  3.00  1.20  0.80
assi (resi 87   and name HB#  ) (resi 87   and name HA  )  2.50  0.70  1.80
assi (resi 87   and name HG#  ) (resi 87   and name HA  )  3.50  1.70  1.80
assi (resi 87   and name HG#  ) (resi 87   and name HB#  )  3.00  1.20  2.80
assi (resi 87   and name HG#  ) (resi 87   and name HA  )  3.50  1.70  1.80
assi (resi 87   and name HG#  ) (resi 87   and name HE22  )  4.00  2.20  1.80

! residue 87   Gln , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 87   and name HG#  ) (resi 88   and name HG2#  )  2.50  0.70  2.60
assi (resi 87   and name HG#  ) (resi 88   and name HN  )  4.00  2.20  1.80

! residue 88   Thr , intraresidue NOEs, Nnoesy
assi (resi 88   and name HG2#  ) (resi 88   and name HN  )  3.50  1.70  1.60
assi (resi 88   and name HB  ) (resi 88   and name HN  )  4.00  2.20  0.80
assi (resi 88   and name HA  ) (resi 88   and name HN  )  3.00  1.20  0.80

! residue 88   Thr , NOEs forward in sequence, Nnoesy
assi (resi 88   and name HB  ) (resi 89   and name HN  )  3.50  1.70  0.80
assi (resi 88   and name HA  ) (resi 89   and name HN  )  2.00  3.50  0.80
assi (resi 88   and name HN  ) (resi 89   and name HN  )  4.00  2.20  0.80
assi (resi 88   and name HA  ) (resi 90   and name HN  )  5.00  3.20  0.80
assi (resi 88   and name HB  ) (resi 90   and name HN  )  4.00  2.20  0.80

! residue 88   Thr , intraresidue NOEs, Cnoesy & CNnoesy

! residue 88   Thr , NOEs forward in sequence, Cnoesy & CNnoesy

! residue 89   Arg , intraresidue NOEs, Nnoesy
assi (resi 89   and name HB#  ) (resi 89   and name HN  )  3.00  1.20  1.80
assi (resi 89   and name HA  ) (resi 89   and name HN  )  3.00  1.20  0.80

! residue 89   Arg , NOEs forward in sequence, Nnoesy
assi (resi 89   and name HB#  ) (resi 90   and name HN  )  4.50  2.70  1.80

! residue 89   Arg , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 89   and name HA  ) (resi 89   and name HN  )  3.00  1.20  0.80
assi (resi 89   and name HA  ) (resi 89   and name HD#  )  4.50  2.70  1.80
assi (resi 89   and name HB#  ) (resi 89   and name HD#  )  3.50  1.70  2.80
assi (resi 89   and name HD#  ) (resi 89   and name HN  )  3.50  1.70  1.80

! residue 89   Arg , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 89   and name HA  ) (resi 90   and name HA  )  4.50  2.70  0.80
assi (resi 89   and name HN  ) (resi 90   and name HB#  )  5.00  3.20  1.80

! residue 90   Phe , intraresidue NOEs, Nnoesy
assi (resi 90   and name HA  ) (resi 90   and name HN  )  3.00  1.20  0.80
assi (resi 90   and name HB#  ) (resi 90   and name HN  )  3.50  1.70  1.80

! residue 90   Phe , NOEs forward in sequence, Nnoesy
assi (resi 90   and name HN  ) (resi 91   and name HN  )  4.50  2.70  0.80
assi (resi 90   and name HA  ) (resi 91   and name HN  )  2.50  0.70  0.80

! residue 90   Phe , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 90   and name HA  ) (resi 90   and name HB#  )  2.50  0.70  1.80

! residue 90   Phe , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 90   and name HN  ) (resi 91   and name HA  )  5.00  3.20  0.80

! residue 91   Thr , intraresidue NOEs, Nnoesy
assi (resi 91   and name HA  ) (resi 91   and name HN  )  3.00  1.20  0.80
assi (resi 91   and name HB  ) (resi 91   and name HN  )  2.50  0.70  0.80

! residue 91   Thr , NOEs forward in sequence, Nnoesy
assi (resi 91   and name HA  ) (resi 92   and name HN  )  2.50  0.70  0.80
assi (resi 91   and name HB  ) (resi 92   and name HN  )  4.00  2.20  0.80
assi (resi 91   and name HN  ) (resi 92   and name HN  )  4.50  2.70  0.80
assi (resi 91   and name HB  ) (resi 94   and name HN  )  4.50  2.70  0.80

! residue 91   Thr , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 91   and name HA  ) (resi 91   and name HB  )  3.00  1.20  0.80

! residue 91   Thr , NOEs forward in sequence, Cnoesy & CNnoesy

! residue 92   Asp , intraresidue NOEs, Nnoesy
assi (resi 92   and name HA  ) (resi 92   and name HN  )  3.00  1.20  0.80
assi (resi 92   and name HB#  ) (resi 92   and name HN  )  4.00  2.20  1.80

! residue 92   Asp , NOEs forward in sequence, Nnoesy
assi (resi 92   and name HN  ) (resi 93   and name HA  )  4.50  2.70  0.80
assi (resi 92   and name HN  ) (resi 93   and name HB#  )  4.00  2.20  1.80
assi (resi 92   and name HN  ) (resi 93   and name HN  )  2.00  3.50  0.80
assi (resi 92   and name HA  ) (resi 93   and name HN  )  3.50  1.70  0.80
assi (resi 92   and name HB#  ) (resi 93   and name HN  )  4.00  2.20  1.80
assi (resi 92   and name HA  ) (resi 94   and name HN  )  4.50  2.70  0.80
assi (resi 92   and name HA  ) (resi 95   and name HN  )  3.50  1.70  0.80

! residue 92   Asp , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 92   and name HN  ) (resi 92   and name HB#  )  4.00  2.20  1.80
assi (resi 92   and name HN  ) (resi 92   and name HA  )  3.00  1.20  0.80
assi (resi 92   and name HB#  ) (resi 92   and name HA  )  2.50  0.70  1.80

! residue 92   Asp , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 92   and name HN  ) (resi 93   and name HB#  )  4.00  2.20  1.80
assi (resi 92   and name HA  ) (resi 93   and name HN  )  3.50  1.70  0.80
assi (resi 92   and name HB#  ) (resi 93   and name HN  )  4.00  2.20  1.80
assi (resi 92   and name HA  ) (resi 94   and name HN  )  4.50  2.70  0.80
assi (resi 92   and name HA  ) (resi 95   and name HN  )  3.50  1.70  0.80

! residue 93   Leu , intraresidue NOEs, Nnoesy
assi (resi 93   and name HA  ) (resi 93   and name HN  )  2.50  0.70  0.80
assi (resi 93   and name HB#  ) (resi 93   and name HN  )  2.50  0.70  1.80
assi (resi 93   and name HG  ) (resi 93   and name HN  )  4.50  2.70  0.80
assi (resi 93   and name HD#  ) (resi 93   and name HN  )  5.00  3.20  3.20

! residue 93   Leu , NOEs forward in sequence, Nnoesy
assi (resi 93   and name HA  ) (resi 94   and name HN  )  3.50  1.70  0.80
assi (resi 93   and name HB#  ) (resi 94   and name HN  )  2.00  3.50  1.80
assi (resi 93   and name HG  ) (resi 94   and name HN  )  4.50  2.70  0.80
assi (resi 93   and name HB#  ) (resi 95   and name HN  )  5.00  3.20  1.80
assi (resi 93   and name HA  ) (resi 96   and name HN  )  3.50  1.70  0.80
assi (resi 93   and name HA  ) (resi 97   and name HN  )  4.00  2.20  0.80

! residue 93   Leu , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 93   and name HG  ) (resi 93   and name HN  ) 4.50  2.70  0.80
assi (resi 93   and name HA  ) (resi 93   and name HN  ) 2.50  0.70  0.80
assi (resi 93   and name HG  ) (resi 93   and name HB#  ) 3.00  1.20  1.80
assi (resi 93   and name HA  ) (resi 93   and name HB#  ) 3.00  1.20  1.80
assi (resi 93   and name HN  ) (resi 93   and name HB#  ) 2.50  0.70  1.80

! residue 93   Leu , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 93   and name HA  ) (resi 95   and name HN  ) 5.00  3.20  0.80
assi (resi 93   and name HA  ) (resi 96   and name HB#  ) 2.50  0.70  1.80
assi (resi 93   and name HB#  ) (resi 94   and name HA  ) 4.00  2.20  1.80
assi (resi 93   and name HG  ) (resi 94   and name HN  ) 4.50  2.70  0.80
assi (resi 93   and name HB#  ) (resi 94   and name HD2#  ) 4.00  2.20  2.60
assi (resi 93   and name HB#  ) (resi 95   and name HN  ) 5.00  3.20  1.80
assi (resi 93   and name HA  ) (resi 96   and name HD1#  ) 4.50  2.70  1.60
assi (resi 93   and name HG  ) (resi 97   and name HG2#  ) 4.00  2.20  1.60

! residue 94   Leu , intraresidue NOEs, Nnoesy
assi (resi 94   and name HA  ) (resi 94   and name HN  ) 3.00  1.20  0.80
assi (resi 94   and name HB#  ) (resi 94   and name HN  ) 3.50  1.70  1.80
assi (resi 94   and name HD1#  ) (resi 94   and name HN  ) 4.50  2.70  1.60
assi (resi 94   and name HD2#  ) (resi 94   and name HN  ) 3.00  1.20  1.60

! residue 94   Leu , NOEs forward in sequence, Nnoesy
assi (resi 94   and name HN  ) (resi 96   and name HB#  ) 5.00  3.20  1.80
assi (resi 94   and name HN  ) (resi 97   and name HG2#  ) 5.00  3.20  1.60
assi (resi 94   and name HN  ) (resi 95   and name HN  ) 3.00  1.20  0.80
assi (resi 94   and name HN  ) (resi 97   and name HN  ) 5.00  3.20  0.80
assi (resi 94   and name HA  ) (resi 95   and name HN  ) 3.50  1.70  0.80
assi (resi 94   and name HB#  ) (resi 95   and name HN  ) 3.50  1.70  1.80
assi (resi 94   and name HG  ) (resi 95   and name HN  ) 4.00  2.20  0.80
assi (resi 94   and name HA  ) (resi 97   and name HN  ) 3.50  1.70  0.80

! residue 94   Leu , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 94   and name HB#  ) (resi 94   and name HA  ) 2.50  0.70  1.80
assi (resi 94   and name HN  ) (resi 94   and name HA  ) 3.00  1.20  0.80
assi (resi 94   and name HG  ) (resi 94   and name HA  ) 3.00  1.20  0.80
assi (resi 94   and name HD1#  ) (resi 94   and name HN  ) 4.50  2.70  1.60
assi (resi 94   and name HG  ) (resi 94   and name HB#  ) 3.00  1.20  1.80
assi (resi 94   and name HG  ) (resi 94   and name HD1#  ) 3.00  1.20  1.60
assi (resi 94   and name HB#  ) (resi 94   and name HD1#  ) 2.50  0.70  2.60
assi (resi 94   and name HB#  ) (resi 94   and name HD2#  ) 3.00  1.20  2.60
assi (resi 94   and name HG  ) (resi 94   and name HD2#  ) 2.50  0.70  1.60

! residue 94   Leu , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 94   and name HA  ) (resi 97   and name HB  ) 3.50  1.70  0.80
assi (resi 94   and name HA  ) (resi 95   and name HN  ) 3.50  1.70  0.80
assi (resi 94   and name HG  ) (resi 95   and name HN  ) 4.00  2.20  0.80
assi (resi 94   and name HB#  ) (resi 95   and name HN  ) 3.50  1.70  1.80
assi (resi 94   and name HB#  ) (resi 97   and name HB  ) 5.00  3.20  1.80
assi (resi 94   and name HD2#  ) (resi 97   and name HB  ) 5.00  3.20  1.60

! residue 95   Gln , intraresidue NOEs, Nnoesy
assi (resi 95   and name HE21  ) (resi 95   and name HN  ) 3.50  1.70  0.80
assi (resi 95   and name HA  ) (resi 95   and name HN  ) 3.00  1.20  0.80
assi (resi 95   and name HG2  ) (resi 95   and name HN  ) 4.50  2.70  0.80
assi (resi 95   and name HG1  ) (resi 95   and name HN  ) 4.50  2.70  0.80
assi (resi 95   and name HB1  ) (resi 95   and name HN  ) 2.50  0.70  0.80
assi (resi 95   and name HB2  ) (resi 95   and name HN  ) 2.50  0.70  0.80

! residue 95   Gln , NOEs forward in sequence, Nnoesy
assi (resi 95   and name HN  ) (resi 97   and name HN  ) 4.00  2.20  0.80
assi (resi 95   and name HN  ) (resi 96   and name HN  ) 2.50  0.70  0.80
assi (resi 95   and name HB2  ) (resi 96   and name HN  ) 4.00  2.20  0.80
assi (resi 95   and name HG1  ) (resi 96   and name HN  ) 5.00  3.20  0.80
assi (resi 95   and name HA  ) (resi 96   and name HN  ) 3.50  1.70  0.80
assi (resi 95   and name HA  ) (resi 97   and name HN  ) 4.00  2.20  0.80
assi (resi 95   and name HA  ) (resi 98   and name HN  ) 3.50  1.70  0.80
assi (resi 95   and name HA  ) (resi 99   and name HN  ) 3.50  1.70  0.80

! residue 95   Gln , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 95   and name HB1  ) (resi 95   and name HN  ) 2.50  0.70  0.80
assi (resi 95   and name HB2  ) (resi 95   and name HN  ) 2.50  0.70  0.80
assi (resi 95   and name HG2  ) (resi 95   and name HN  ) 4.50  2.70  0.80
assi (resi 95   and name HG1  ) (resi 95   and name HN  ) 4.50  2.70  0.80
assi (resi 95   and name HE21  ) (resi 95   and name HN  ) 3.50  1.70  0.80
assi (resi 95   and name HB1  ) (resi 95   and name HA  ) 3.00  1.20  0.80
assi (resi 95   and name HB2  ) (resi 95   and name HA  ) 2.50  0.70  0.80

! residue 95   Gln , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 95   and name HA  ) (resi 98   and name HB#  ) 3.50  1.70  1.80

! residue 96   Leu , intraresidue NOEs, Nnoesy
assi (resi 96   and name HN  ) (resi 96   and name HD2#  ) 5.00  3.20  1.60
assi (resi 96   and name HN  ) (resi 96   and name HG  ) 4.50  2.70  0.80
assi (resi 96   and name HN  ) (resi 96   and name HB#  ) 2.50  0.70  1.80
assi (resi 96   and name HA  ) (resi 96   and name HN  ) 3.00  1.20  0.80

! residue 96   Leu , NOEs forward in sequence, Nnoesy
assi (resi 96   and name HN  ) (resi 97   and name HG2#  ) 4.50  2.70  1.60
assi (resi 96   and name HN  ) (resi 97   and name HB  ) 5.00  3.20  0.80
assi (resi 96   and name HN  ) (resi 97   and name HN  ) 2.50  0.70  0.80
assi (resi 96   and name HD2#  ) (resi 97   and name HN  ) 3.50  1.70  1.60
assi (resi 96   and name HG  ) (resi 97   and name HN  ) 4.50  2.70  0.80
assi (resi 96   and name HB#  ) (resi 97   and name HN  ) 2.50  0.70  1.80
assi (resi 96   and name HA  ) (resi 97   and name HN  ) 3.50  1.70  0.80
assi (resi 96   and name HA  ) (resi 98   and name HN  ) 5.00  3.20  0.80
assi (resi 96   and name HA  ) (resi 99   and name HN  ) 4.00  2.20  0.80
assi (resi 96   and name HN  ) (resi 99   and name HN  ) 5.00  3.20  0.80

! residue 96   Leu , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 96   and name HA  ) (resi 96   and name HD2#  ) 3.50  1.70  1.60
assi (resi 96   and name HB#  ) (resi 96   and name HG  ) 3.00  1.20  1.80
assi (resi 96   and name HD1#  ) (resi 96   and name HG  ) 2.50  0.70  1.60
assi (resi 96   and name HD2#  ) (resi 96   and name HG  ) 2.50  0.70  1.60
assi (resi 96   and name HB#  ) (resi 96   and name HD1#  ) 3.50  1.70  2.60
assi (resi 96   and name HB#  ) (resi 96   and name HD2#  ) 3.00  1.20  2.60

! residue 96   Leu , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 96   and name HD2#  ) (resi 97   and name HN  ) 3.50  1.70  1.60
assi (resi 96   and name HD2#  ) (resi 100   and name HB#  ) 3.00  1.20  2.60
assi (resi 96   and name HD2#  ) (resi 97   and name HA  ) 3.00  1.20  1.60
assi (resi 96   and name HN  ) (resi 97   and name HB  ) 5.00  3.20  0.80
assi (resi 96   and name HB#  ) (resi 97   and name HG2#  ) 3.50  1.70  2.60

! residue 97   Val , intraresidue NOEs, Nnoesy
assi (resi 97   and name HG2#  ) (resi 97   and name HN  ) 2.00  3.50  1.60
assi (resi 97   and name HG1#  ) (resi 97   and name HN  ) 4.50  2.70  1.60
assi (resi 97   and name HB  ) (resi 97   and name HN  ) 2.50  0.70  0.80
assi (resi 97   and name HA  ) (resi 97   and name HN  ) 3.00  1.20  0.80

! residue 97   Val , NOEs forward in sequence, Nnoesy
assi (resi 97   and name HN  ) (resi 100   and name HB#  ) 5.00  3.20  1.80
assi (resi 97   and name HN  ) (resi 99   and name HN  ) 4.50  2.70  0.80
assi (resi 97   and name HN  ) (resi 98   and name HN  ) 3.00  1.20  0.80
assi (resi 97   and name HA  ) (resi 98   and name HN  ) 3.50  1.70  0.80
assi (resi 97   and name HB  ) (resi 98   and name HN  ) 2.00  3.50  0.80
assi (resi 97   and name HG1#  ) (resi 98   and name HN  ) 3.00  1.20  1.60
assi (resi 97   and name HB  ) (resi 99   and name HN  ) 5.00  3.20  0.80

! residue 97   Val , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 97   and name HN  ) (resi 97   and name HG2#  ) 2.50  0.70  1.60
assi (resi 97   and name HB ) (resi 97   and name HG2#  ) 2.50  0.70  1.60
assi (resi 97   and name HG1# ) (resi 97   and name HG2#  ) 4.00  2.20  2.40
assi (resi 97   and name HB ) (resi 97   and name HG1#  ) 2.50  0.70  1.60

! residue 97   Val , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 97   and name HA  ) (resi 98   and name HN  ) 3.50  1.70  0.80
assi (resi 97   and name HB  ) (resi 98   and name HB#  ) 4.00  2.20  1.80
assi (resi 97   and name HG1#  ) (resi 98   and name HB#  ) 4.00  2.20  2.60
assi (resi 97   and name HB  ) (resi 98   and name HA  ) 4.00  2.20  0.80

! residue 98   Glu , intraresidue NOEs, Nnoesy
assi (resi 98   and name HA  ) (resi 98   and name HN  ) 3.00  1.20  0.80
assi (resi 98   and name HG#  ) (resi 98   and name HN  ) 3.00  1.20  1.80
assi (resi 98   and name HB#  ) (resi 98   and name HN  ) 2.50  0.70  1.80

! residue 98   Glu , NOEs forward in sequence, Nnoesy
assi (resi 98   and name HA  ) (resi 99   and name HN  ) 3.50  1.70  0.80
assi (resi 98   and name HN  ) (resi 99   and name HN  ) 3.00  1.20  0.80
assi (resi 98   and name HB#  ) (resi 99   and name HN  ) 4.00  2.20  1.80
assi (resi 98   and name HG#  ) (resi 99   and name HN  ) 2.00  3.50  1.80
assi (resi 98   and name HA  ) (resi 101   and name HE21  ) 2.00  3.50  0.80

! residue 98   Glu , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 98   and name HN  ) (resi 98   and name HG#  ) 3.00  1.20  1.80
assi (resi 98   and name HB#  ) (resi 98   and name HG#  ) 3.00  1.20  2.80

! residue 98   Glu , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 98   and name HG#  ) (resi 99   and name HA  ) 3.50  1.70  1.80

! residue 99   Phe , intraresidue NOEs, Nnoesy
assi (resi 99   and name HA  ) (resi 99   and name HN  ) 3.00  1.20  0.80
assi (resi 99   and name HB#  ) (resi 99   and name HN  ) 3.50  1.70  1.80

! residue 99   Phe , NOEs forward in sequence, Nnoesy
assi (resi 99   and name HB#  ) (resi 101   and name HN  ) 5.00  3.20  1.80
assi (resi 99   and name HA  ) (resi 101   and name HN  ) 3.50  1.70  0.80
assi (resi 99   and name HA  ) (resi 101   and name HE21  ) 4.00  2.20  0.80
assi (resi 99   and name HB#  ) (resi 102   and name HN  ) 4.00  2.20  1.80
assi (resi 99   and name HA  ) (resi 102   and name HN  ) 3.00  1.20  0.80
assi (resi 99   and name HA  ) (resi 103   and name HN  ) 5.00  3.20  0.80
assi (resi 99   and name HB#  ) (resi 103   and name HN  ) 4.00  2.20  1.80
assi (resi 99   and name HB#  ) (resi 104   and name HN  ) 4.50  2.70  1.80

! residue 99   Phe , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 99   and name HA  ) (resi 99   and name HN  ) 3.00  1.20  0.80

! residue 99   Phe , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 99   and name HA  ) (resi 101   and name HN  ) 3.50  1.70  0.80
assi (resi 99   and name HA  ) (resi 102   and name HN  ) 3.00  1.20  0.80
assi (resi 99   and name HB#  ) (resi 101   and name HN  ) 5.00  3.20  1.80

! residue 100  His , intraresidue NOEs

! residue 100  His , NOEs forward in sequence
assi (resi 100   and name HB#  ) (resi 101   and name HN  ) 4.00  2.20  1.80

! residue 101  Gln , intraresidue NOEs, Nnoesy
assi (resi 101   and name HB#  ) (resi 101   and name HN  ) 2.50  0.70  1.80
assi (resi 101   and name HG#  ) (resi 101   and name HN  ) 3.00  1.20  1.80
assi (resi 101   and name HA  ) (resi 101   and name HN  ) 3.00  1.20  0.80
assi (resi 101   and name HE22  ) (resi 101   and name HB#  ) 4.00  2.20  1.80
assi (resi 101   and name HE22  ) (resi 101   and name HG#  ) 4.00  2.20  1.80
assi (resi 101   and name HE21  ) (resi 101   and name HB#  ) 3.50  1.70  1.80
assi (resi 101   and name HE21  ) (resi 101   and name HG#  ) 3.00  1.20  1.80

! residue 101  Gln , NOEs forward in sequence, Nnoesy
assi (resi 101   and name HN  ) (resi 102   and name HN  ) 2.50  0.70  0.80
assi (resi 101   and name HG#  ) (resi 102   and name HN  ) 2.00  3.50  1.80
assi (resi 101   and name HA  ) (resi 102   and name HN  ) 3.50  1.70  0.80
assi (resi 101   and name HE21  ) (resi 102   and name HN  ) 4.50  2.70  0.80
assi (resi 101   and name HN  ) (resi 103   and name HN  ) 4.50  2.70  0.80
assi (resi 101   and name HG#  ) (resi 103   and name HN  ) 5.00  3.20  1.80

! residue 101  Gln , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 101   and name HN  ) (resi 101   and name HA  ) 3.00  1.20  0.80
assi (resi 101   and name HB#  ) (resi 101   and name HA  ) 2.50  0.70  1.80
assi (resi 101   and name HB#  ) (resi 101   and name HG#  ) 3.00  1.20  2.80
assi (resi 101   and name HB#  ) (resi 101   and name HE22  ) 4.00  2.20  1.80

! residue 101  Gln , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 101   and name HN  ) (resi 102   and name HN  ) 2.50  0.70  0.80
assi (resi 101   and name HG#  ) (resi 102   and name HN  ) 2.00  3.50  1.80
assi (resi 101   and name HG#  ) (resi 102   and name HD2#  ) 3.50  1.70  2.60

! residue 102  Leu , intraresidue NOEs, Nnoesy
assi (resi 102   and name HD2#  ) (resi 102   and name HN  ) 3.50  1.70  1.60
assi (resi 102   and name HG  ) (resi 102   and name HN  ) 4.50  2.70  0.80
assi (resi 102   and name HB#  ) (resi 102   and name HN  ) 4.00  2.20  1.80
assi (resi 102   and name HA  ) (resi 102   and name HN  ) 3.00  1.20  0.80

! residue 102  Leu , NOEs forward in sequence, Nnoesy
assi (resi 102   and name HN  ) (resi 103   and name HN  ) 3.00  1.20  0.80
assi (resi 102   and name HA  ) (resi 103   and name HN  ) 2.50  0.70  0.80
assi (resi 102   and name HB#  ) (resi 103   and name HN  ) 4.50  2.70  1.80

! residue 102  Leu , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 102   and name HA  ) (resi 102   and name HD1#  ) 3.50  1.70  1.60
assi (resi 102   and name HG  ) (resi 102   and name HN  ) 4.50  2.70  0.80
assi (resi 102   and name HB#  ) (resi 102   and name HN  ) 4.00  2.20  1.80
assi (resi 102   and name HA  ) (resi 102   and name HN  ) 3.00  1.20  0.80
assi (resi 102   and name HA  ) (resi 102   and name HG  ) 3.50  1.70  0.80
assi (resi 102   and name HD1#  ) (resi 102   and name HG  ) 2.50  0.70  1.60
assi (resi 102   and name HB#  ) (resi 102   and name HG  ) 2.50  0.70  1.80
assi (resi 102   and name HD1#  ) (resi 102   and name HD2#  ) 3.00  1.20  2.40
assi (resi 102   and name HD2#  ) (resi 102   and name HG  ) 3.00  1.20  1.60

! residue 102  Leu , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 102   and name HN  ) (resi 103   and name HN  ) 3.00  1.20  0.80
assi (resi 102   and name HN  ) (resi 103   and name HA  ) 4.50  2.70  0.80
assi (resi 102   and name HA  ) (resi 111   and name HD2#  ) 3.00  1.20  1.60
assi (resi 102   and name HA  ) (resi 112   and name HB#  ) 3.00  1.20  1.80
assi (resi 102   and name HD2#  ) (resi 112   and name HB#  ) 4.50  2.70  2.60
assi (resi 102   and name HB#  ) (resi 103   and name HN  ) 4.50  2.70  1.80
assi (resi 102   and name HA  ) (resi 112   and name HA  ) 3.50  1.70  0.80

! residue 103  Asn , intraresidue NOEs, Nnoesy
assi (resi 103   and name HA  ) (resi 103   and name HN  ) 3.00  1.20  0.80
assi (resi 103   and name HB2  ) (resi 103   and name HN  ) 3.00  1.20  0.80
assi (resi 103   and name HB1  ) (resi 103   and name HN  ) 2.50  0.70  0.80

! residue 103  Asn , NOEs forward in sequence, Nnoesy
assi (resi 103   and name HN  ) (resi 105   and name HN  ) 4.50  2.70  0.80
assi (resi 103   and name HN  ) (resi 104   and name HN  ) 4.50  2.70  0.80
assi (resi 103   and name HN  ) (resi 112   and name HA  ) 3.00  1.20  0.80
assi (resi 103   and name HN  ) (resi 112   and name HB#  ) 4.00  2.20  1.80
assi (resi 103   and name HN  ) (resi 111   and name HD2#  ) 3.00  1.20  1.60
assi (resi 103   and name HB1  ) (resi 104   and name HN  ) 4.00  2.20  0.80
assi (resi 103   and name HB2  ) (resi 104   and name HN  ) 4.00  2.20  0.80
assi (resi 103   and name HB1  ) (resi 105   and name HN  ) 4.50  2.70  0.80

! residue 103  Asn , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 103   and name HB1  ) (resi 103   and name HA  ) 3.00  1.20  0.80

! residue 103  Asn , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 103   and name HN  ) (resi 111   and name HD2#  ) 3.00  1.20  1.60
assi (resi 103   and name HN  ) (resi 112   and name HB#  ) 4.00  2.20  1.80

! residue 104  Arg , intraresidue NOEs, Nnoesy
assi (resi 104   and name HN  ) (resi 104   and name HA  ) 3.00  1.20  0.80
assi (resi 104   and name HN  ) (resi 104   and name HD#  ) 2.00  3.50  1.80
assi (resi 104   and name HN  ) (resi 104   and name HG#  ) 3.50  1.70  1.80
assi (resi 104   and name HN  ) (resi 104   and name HB#  ) 3.50  1.70  1.80
assi (resi 104   and name HN  ) (resi 104   and name HE  ) 4.50  2.70  0.80

! residue 104  Arg , NOEs forward in sequence, Nnoesy
assi (resi 104   and name HG#  ) (resi 105   and name HN  ) 5.00  3.20  1.80
assi (resi 104   and name HB#  ) (resi 105   and name HN  ) 4.00  2.20  1.80
assi (resi 104   and name HN  ) (resi 105   and name HN  ) 4.00  2.20  0.80

! residue 104  Arg , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 104   and name HN  ) (resi 104   and name HA  ) 3.00  1.20  0.80
assi (resi 104   and name HB#  ) (resi 104   and name HA  ) 2.50  0.70  1.80
assi (resi 104   and name HG#  ) (resi 104   and name HA  ) 2.50  0.70  1.80
assi (resi 104   and name HB#  ) (resi 104   and name HN  ) 3.50  1.70  1.80
assi (resi 104   and name HB#  ) (resi 104   and name HD#  ) 3.50  1.70  2.80

! residue 104  Arg , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 104   and name HA  ) (resi 111   and name HD2#  ) 4.00  2.20  1.60

! residue 105  Gly , intraresidue NOEs, Nnoesy
assi (resi 105   and name HA#  ) (resi 105   and name HN  ) 2.50  0.70  1.80

! residue 105  Gly , NOEs forward in sequence, Nnoesy
assi (resi 105   and name HN  ) (resi 111   and name HD2#  ) 3.50  1.70  1.60
assi (resi 105   and name HA#  ) (resi 111   and name HN  ) 5.00  3.20  1.80

! residue 105  Gly , intraresidue NOEs, Cnoesy & CNnoesy

! residue 105  Gly , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 105   and name HA#  ) (resi 106   and name HG2#  ) 4.50  2.70  2.60
assi (resi 105   and name HN  ) (resi 111   and name HD2#  ) 3.50  1.70  1.60

! residue 106  Ile , intraresidue NOEs, Nnoesy
assi (resi 106   and name HN  ) (resi 106   and name HB  ) 3.00  1.20  0.80
assi (resi 106   and name HN  ) (resi 106   and name HG2#  ) 2.50  0.70  1.60
assi (resi 106   and name HN  ) (resi 106   and name HA  ) 3.00  1.20  0.80

! residue 106  Ile , NOEs forward in sequence, Nnoesy
assi (resi 106   and name HN  ) (resi 111   and name HB#  ) 4.00  2.20  1.80
assi (resi 106   and name HG2#  ) (resi 107   and name HN  ) 4.00  2.20  1.60

! residue 106  Ile , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 106   and name HA  ) (resi 106   and name HG2#  ) 3.50  1.70  1.60
assi (resi 106   and name HA  ) (resi 106   and name HB  ) 2.50  0.70  0.80
assi (resi 106   and name HA  ) (resi 106   and name HG2#  ) 3.50  1.70  1.60

! residue 106  Ile , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 106   and name HA  ) (resi 107   and name HA  ) 4.50  2.70  0.80

! residue 107  Leu , intraresidue NOEs, Nnoesy
assi (resi 107   and name HA  ) (resi 107   and name HN  ) 2.50  0.70  0.80
assi (resi 107   and name HB#  ) (resi 107   and name HN  ) 2.50  0.70  1.80
assi (resi 107   and name HG  ) (resi 107   and name HN  ) 2.50  0.70  0.80
assi (resi 107   and name HD1#  ) (resi 107   and name HN  ) 5.00  3.20  1.60
assi (resi 107   and name HD2#  ) (resi 107   and name HN  ) 4.50  2.70  1.60

! residue 107  Leu , NOEs forward in sequence, Nnoesy

! residue 107  Leu , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 107   and name HD2#  ) (resi 107   and name HA  ) 4.00  2.20  1.60
assi (resi 107   and name HD1#  ) (resi 107   and name HA  ) 4.50  2.70  1.60
assi (resi 107   and name HG  ) (resi 107   and name HA  ) 2.50  0.70  0.80
assi (resi 107   and name HB#  ) (resi 107   and name HA  ) 3.00  1.20  1.80
assi (resi 107   and name HN  ) (resi 107   and name HD2#  ) 4.50  2.70  1.60
assi (resi 107   and name HA  ) (resi 107   and name HD2#  ) 4.00  2.20  1.60
assi (resi 107   and name HD2#  ) (resi 107   and name HB#  ) 2.00  3.50  2.60
assi (resi 107   and name HD1#  ) (resi 107   and name HB#  ) 2.50  0.70  2.60

! residue 107  Leu , NOEs forward in sequence, Cnoesy & CNnoesy

! residue 107  Leu , NOEs forward in sequence, filtered noesys
assi (resi 107   and name HN  ) (resi 126   and name HG#  )  5.00  3.20  1.80

! residue 108  Pro , intraresidue NOEs

! residue 108  Pro , NOEs forward in sequence

! residue 109  Cys , intraresidue NOEs, Nnoesy
assi (resi 109   and name HN  ) (resi 109   and name HA  )  2.50  0.70  0.80
assi (resi 109   and name HN  ) (resi 109   and name HB1  )  3.50  1.70  0.80
assi (resi 109   and name HN  ) (resi 109   and name HB2  )  2.50  0.70  0.80

! residue 109  Cys , NOEs forward in sequence, Nnoesy
assi (resi 109   and name HA  ) (resi 110   and name HN  )  3.00  1.20  0.80
assi (resi 109   and name HB1  ) (resi 110   and name HN  )  2.00  0.20  0.80
assi (resi 109   and name HB2  ) (resi 110   and name HN  )  2.50  0.70  0.80

! residue 109  Cys , intraresidue NOEs, Cnoesy & CNnoesy

! residue 109  Cys , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 109   and name HB1  ) (resi 110   and name HD2#  )  4.00  2.20  1.60

! residue 110  Leu , intraresidue NOEs, Nnoesy
assi (resi 110   and name HA  ) (resi 110   and name HN  )  2.50  0.70  0.80
assi (resi 110   and name HB#  ) (resi 110   and name HN  )  3.50  1.70  1.80
assi (resi 110   and name HG  ) (resi 110   and name HN  )  4.00  2.20  0.80
assi (resi 110   and name HD1#  ) (resi 110   and name HN  )  4.50  2.70  1.60
assi (resi 110   and name HD2#  ) (resi 110   and name HN  )  3.50  1.70  1.60

! residue 110  Leu , NOEs forward in sequence, Nnoesy
assi (resi 110   and name HN  ) (resi 111   and name HD1#  )  5.00  3.20  1.60
assi (resi 110   and name HN  ) (resi 111   and name HN  )  4.50  2.70  0.80
assi (resi 110   and name HD1#  ) (resi 111   and name HN  )  4.50  2.70  1.60
assi (resi 110   and name HG  ) (resi 111   and name HN  )  5.00  3.20  0.80
assi (resi 110   and name HB#  ) (resi 111   and name HN  )  3.00  1.20  1.80
assi (resi 110   and name HA  ) (resi 111   and name HN  )  2.00  0.20  0.80
assi (resi 110   and name HB#  ) (resi 112   and name HN  )  3.50  1.70  1.80

! residue 110  Leu , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 110   and name HD1#  ) (resi 110   and name HB#  )  3.50  1.70  2.60
assi (resi 110   and name HD2#  ) (resi 110   and name HB#  )  4.00  2.20  2.60
assi (resi 110   and name HD1#  ) (resi 110   and name HA  )  3.50  1.70  1.60
assi (resi 110   and name HD1#  ) (resi 110   and name HN  )  4.50  2.70  1.60

! residue 110  Leu , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 110   and name HA  ) (resi 111   and name HB#  )  4.50  2.70  1.80
assi (resi 110   and name HB#  ) (resi 111   and name HA  )  4.50  2.70  1.80

! residue 111  Leu , intraresidue NOEs, Nnoesy
assi (resi 111   and name HD2#  ) (resi 111   and name HN  )  3.50  1.70  1.60
assi (resi 111   and name HD1#  ) (resi 111   and name HN  )  2.00  0.20  1.60
assi (resi 111   and name HG  ) (resi 111   and name HN  )  4.00  2.20  0.80
assi (resi 111   and name HB#  ) (resi 111   and name HN  )  3.00  1.20  1.80
assi (resi 111   and name HA  ) (resi 111   and name HN  )  3.00  1.20  0.80
assi (resi 111   and name HG  ) (resi 111   and name HD1#  )  2.50  0.70  1.60
assi (resi 111   and name HG  ) (resi 111   and name HD2#  )  2.50  0.70  1.60

! residue 111  Leu , NOEs forward in sequence, Nnoesy
assi (resi 111   and name HN  ) (resi 112   and name HG#  )  3.00  1.20  1.80
assi (resi 111   and name HN  ) (resi 112   and name HG#  )  4.50  2.70  1.80
assi (resi 111   and name HN  ) (resi 112   and name HN  )  4.50  2.70  0.80
assi (resi 111   and name HD1#  ) (resi 112   and name HN  )  3.50  1.70  1.60
assi (resi 111   and name HB#  ) (resi 112   and name HN  )  4.00  2.20  1.80

! residue 111  Leu , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 111   and name HA  ) (resi 111   and name HD1#  )  3.50  1.70  1.60

! residue 111  Leu , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 111   and name HD1#  ) (resi 112   and name HG#  )  5.00  3.20  2.60
assi (resi 111   and name HD2#  ) (resi 112   and name HB#  )  3.50  1.70  2.60
assi (resi 111   and name HD2#  ) (resi 112   and name HB#  )  3.50  1.70  2.60

! residue 112  Arg , intraresidue NOEs, Nnoesy
assi (resi 112   and name HG#  ) (resi 112   and name HN  )  2.00  0.20  1.80
assi (resi 112   and name HB#  ) (resi 112   and name HN  )  2.50  0.70  1.80
assi (resi 112   and name HA  ) (resi 112   and name HN  )  3.00  1.20  0.80

! residue 112  Arg , NOEs forward in sequence, Nnoesy
assi (resi 112   and name HG#  ) (resi 113   and name HN  )  4.50  2.70  1.80
assi (resi 112   and name HB#  ) (resi 113   and name HN  )  4.00  2.20  1.80

! residue 112  Arg , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 112   and name HA  ) (resi 112   and name HB#  )  2.50  0.70  1.80
assi (resi 112   and name HG#  ) (resi 112   and name HB#  )  2.50  0.70  2.80
assi (resi 112   and name HA  ) (resi 112   and name HB#  )  2.50  0.70  1.80
assi (resi 112   and name HN  ) (resi 112   and name HB#  )  2.50  0.70  1.80

! residue 112  Arg , NOEs forward in sequence, Cnoesy & Cnnoesy

! residue 113  His , intraresidue NOEs, Nnoesy
assi (resi 113   and name HA  ) (resi 113   and name HN  )  3.00  1.20  0.80
assi (resi 113   and name HB1  ) (resi 113   and name HN  )  3.50  1.70  0.80
assi (resi 113   and name HB2  ) (resi 113   and name HN  )  4.00  2.20  0.80

! residue 113  His , NOEs forward in sequence, Nnoesy
assi (resi 113   and name HN  ) (resi 114   and name HN  )  4.50  2.70  0.80
assi (resi 113   and name HA  ) (resi 114   and name HN  )  2.50  0.70  0.80
assi (resi 113   and name HB1  ) (resi 114   and name HN  )  3.50  1.70  0.80

! residue 113  His , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 113   and name HB2  ) (resi 113   and name HA  )  2.50  0.70  0.80
assi (resi 113   and name HB2  ) (resi 113   and name HB1  )  1.80  0.00  0.80

! residue 113  His , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 113   and name HB2  ) (resi 114   and name HB1  )  5.00  3.20  0.80
assi (resi 113   and name HA  ) (resi 114   and name HB2  )  4.50  2.70  0.80

! residue 114  Cys , intraresidue NOEs, Nnoesy
assi (resi 114   and name HA  ) (resi 114   and name HN  )  3.00  1.20  0.80
assi (resi 114   and name HB1  ) (resi 114   and name HN  )  3.00  1.20  0.80
assi (resi 114   and name HB2  ) (resi 114   and name HN  )  3.50  1.70  0.80

! residue 114  Cys , NOEs forward in sequence, Nnoesy
assi (resi 114   and name HN  ) (resi 115   and name HA  )  4.50  2.70  0.80
assi (resi 114   and name HB1  ) (resi 115   and name HN  )  2.00  0.20  0.80
assi (resi 114   and name HB2  ) (resi 115   and name HN  )  3.50  1.70  0.80

! residue 114  Cys , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 114   and name HB1  ) (resi 114   and name HA  )  3.00  1.20  0.80
assi (resi 114   and name HB2  ) (resi 114   and name HA  )  2.50  0.70  0.80
assi (resi 114   and name HB2  ) (resi 114   and name HB1  )  1.80  0.00  0.80

! residue 114  Cys , NOEs forward in sequence, Cnoesy & CNnoesy

! residue 115  Cys , intraresidue NOEs, Nnoesy
assi (resi 115   and name HA  ) (resi 115   and name HN  )  3.00  1.20  0.80
assi (resi 115   and name HB1  ) (resi 115   and name HN  )  3.50  1.70  0.80
assi (resi 115   and name HB2  ) (resi 115   and name HN  )  4.00  2.20  0.80

! residue 115  Cys , NOEs forward in sequence, Nnoesy
assi (resi 115   and name HA  ) (resi 116   and name HN  )  2.00  0.20  0.80
assi (resi 115   and name HB2  ) (resi 116   and name HN  )  3.00  1.20  0.80

! residue 115  Cys , intraresidue NOEs, Cnoesy & CNnoesy
! residue 115  Cys , NOEs forward in sequence, Cnoesy & CNnoesy

! residue 116  Thr , intraresidue NOEs, Nnoesy
assi (resi 116   and name HA  ) (resi 116   and name HN  )  3.00  1.20  0.80
assi (resi 116   and name HB  ) (resi 116   and name HN  )  2.50  0.70  0.80

! residue 116  Thr , NOEs forward in sequence, Nnoesy
assi (resi 116   and name HN  ) (resi 117   and name HN  )  4.50  2.70  0.80
assi (resi 116   and name HB  ) (resi 117   and name HN  )  4.00  2.20  0.80

! residue 116  Thr , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 116   and name HA  ) (resi 116   and name HB  )  3.00  1.20  0.80

! residue 116  Thr , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 116   and name HB  ) (resi 117   and name HN  )  4.00  2.20  0.80

! residue 117  Arg , intraresidue NOEs, Nnoesy
assi (resi 117   and name HA  ) (resi 117   and name HN  )  3.00  1.20  0.80
assi (resi 117   and name HG#  ) (resi 117   and name HN  )  4.50  2.70  1.80
assi (resi 117   and name HD#  ) (resi 117   and name HE  )  3.00  1.20  1.80
assi (resi 117   and name HG#  ) (resi 117   and name HE  )  3.50  1.70  1.80

! residue 117  Arg , NOEs forward in sequence, Nnoesy

! residue 117  Arg , intraresidue NOEs, Cnoesy & CNnoesy
assi (resi 117   and name HN  ) (resi 117   and name HA  )  3.00  1.20  0.80
assi (resi 117   and name HG#  ) (resi 117   and name HA  )  2.50  0.70  1.80
assi (resi 117   and name HG#  ) (resi 117   and name HD#  )  2.50  0.70  2.80
assi (resi 117   and name HE  ) (resi 117   and name HD#  )  3.00  1.20  1.80

! residue 117  Arg , NOEs forward in sequence, Cnoesy & CNnoesy
assi (resi 117   and name HG#  ) (resi 118   and name HN  )  3.00  1.20  1.80

! residue 118  Val , intraresidue NOEs, Nnoesy

! residue 118  Val , NOEs forward in sequence, Nnoesy
assi (resi 118   and name HB  ) (resi 119   and name HN  )  2.00  0.20  0.80

! residue 118  Val , intraresidue NOEs, Cnoesy
! residue 118  Val , NOEs forward in sequence, Cnoesy

! residue 119  Ala , intraresidue NOEs, Nnoesy
assi (resi 119   and name HA  ) (resi 119   and name HN  )  3.00  1.20  0.80

! residue 119  Ala , NOEs forward in sequence, Nnoesy
assi (resi 119   and name HA  ) (resi 120   and name HN  )  2.50  0.70  0.80
assi (resi 119   and name HB#  ) (resi 120   and name HN  )  3.00  1.20  1.80

! residue 119  Ala , intraresidue NOEs, Cnoesy
! residue 119  Ala , NOEs forward in sequence, Cnoesy

! residue 120  Leu , intraresidue NOEs, Nnoesy
assi (resi 120   and name HD#  ) (resi 120   and name HN  )  3.00  1.20  1.80

! residue 120  Leu , NOEs forward in sequence, Nnoesy

! residue 120  Leu , intraresidue NOEs, Cnoesy
! residue 120  Leu , NOEs forward in sequence, cnoesy

! residue 121  Pro , intraresidue NOEs, Nnoesy

! residue 121  Pro , NOEs forward in sequence, Nnoesy

! residue 121  Pro , intraresidue NOEs, Cnoesy
! residue 121  Pro , NOEs forward in sequence, cnoesy

! residue 122  Gln , intraresidue NOEs, Nnoesy

! residue 122  Gln , NOEs forward in sequence, Nnoesy

! residue 122  Gln , intraresidue NOEs, Cnoesy
! residue 122  Gln , NOEs forward in sequence, cnoesy

! residue 123  Pro , intraresidue NOEs, Nnoesy

! residue 123  Pro , NOEs forward in sequence, Nnoesy

! residue 123  Pro , intraresidue NOEs, Cnoesy
! residue 123  Pro , NOEs forward in sequence, cnoesy

! residue 124  Glu , intraresidue NOEs, Nnoesy

! residue 124  Glu , NOEs forward in sequence, bound peptide only
assi (resi 124   and name HG#  ) (resi 125   and name HD2  )  3.00  1.20  1.80

! residue 124  Glu , intraresidue NOEs, Cnoesy
! residue 124  Glu , NOEs forward in sequence, cnoesy

! residue 125  Ptr , intraresidue NOEs, bound peptide only
assi (resi 125   and name HA  ) (resi 125   and name HN  )  3.00  1.20  0.80

! residue 125  Ptr , NOEs forward in sequence, bound peptide only
assi (resi 125   and name HD2  ) (resi 126   and name HN  )  4.00  2.20  0.80
assi (resi 125   and name HA  ) (resi 128   and name HB#  )  4.50  2.70  1.80

! residue 125  Ptr , intraresidue NOEs, Cnoesy
! residue 125  Ptr , NOEs forward in sequence, cnoesy

! residue 126  Val , intraresidue NOEs, Nnoesy

! residue 126  Val , NOEs forward in sequence, bound peptide only
assi (resi 126   and name HN  ) (resi 129   and name HA  )  3.00  1.20  0.80
assi (resi 126   and name HA  ) (resi 128   and name HA  )  2.50  0.70  0.80

! residue 126  Val , intraresidue NOEs, Cnoesy
! residue 126  Val , NOEs forward in sequence, cnoesy

! residue 126  Val , NOEs forward in sequence, Label to Unlabel noesy
assi (resi 126   and name HB  ) (resi 127   and name HD21  )  3.50  1.70  0.80
assi (resi 126   and name HG#  ) (resi 127   and name HD21  )  4.50  2.70  1.80
assi (resi 126   and name HB  ) (resi 127   and name HN  )  4.50  2.70  0.80
assi (resi 126   and name HA  ) (resi 127   and name HD21  )  5.00  3.20  0.80
assi (resi 126   and name HA  ) (resi 127   and name HN  )  3.50  1.70  0.80

! residue 127  Asn , intraresidue NOEs, bound peptide only 
assi (resi 127   and name HD2#  ) (resi 127   and name HB1  )  4.00  2.20  1.80
assi (resi 127   and name HD2#  ) (resi 127   and name HB2  )  4.00  2.20  1.80

! residue 127  Asn , NOEs forward in sequence, bound peptide only
assi (resi 127   and name HB2  ) (resi 128   and name HE21  )  3.00  1.20  0.80

! residue 127  Asn , intraresidue NOEs, Cnoesy
! residue 127  Asn , NOEs forward in sequence, cnoesy

! residue 128  Gln , intraresidue NOEs, bound peptide only
assi (resi 128   and name HE21  ) (resi 128   and name HB#  )  4.00  2.20  1.80
assi (resi 128   and name HE21  ) (resi 128   and name HG#  )  4.00  2.20  1.80

! residue 128  Gln , NOEs forward in sequence, bound peptide only
assi (resi 128   and name HN  ) (resi 130   and name HA  )  3.00  1.20  0.80
assi (resi 128   and name HA  ) (resi 129   and name HD#  )  3.50  1.70  1.80

! residue 128  Gln , intraresidue NOEs, Cnoesy
! residue 128  Gln , NOEs forward in sequence, cnoesy

! residue 129  Pro , intraresidue NOEs, Nnoesy

! residue 129  Pro , NOEs forward in sequence, bound peptide only
assi (resi 129   and name HA  ) (resi 130   and name HN  )  3.00  1.20  0.80

! residue 129  Pro , intraresidue NOEs, Cnoesy
! residue 129  Pro , NOEs forward in sequence, cnoesy

! residue 130  Asp , intraresidue NOEs, Nnoesy

! residue 130  Asp , NOEs forward in sequence, Nnoesy

! residue 130  Asp , intraresidue NOEs, Cnoesy
! residue 130  Asp , NOEs forward in sequence, cnoesy


! hGrb7-SH2 / pY1139 complex H-bonds

assign (resid  22 and name o ) 
       (resid  47 and name hn )  2.0 0.7 0.5
assign (resid  22 and name o ) 
       (resid  47 and name n )  3.0 0.7 0.5

assign (resid  45 and name o ) 
       (resid  21 and name hn )  2.0 0.7 0.5
assign (resid  45 and name o ) 
       (resid  21 and name n )  3.0 0.7 0.5

assign (resid  19 and name o ) 
       (resid  45 and name hn )  2.0 0.7 0.5
assign (resid  19 and name o ) 
       (resid  45 and name n )  3.0 0.7 0.5

assign (resid  33 and name o ) 
       (resid  36 and name hn )  2.0 0.7 0.5
assign (resid  33 and name o ) 
       (resid  36 and name n )  3.0 0.7 0.5

assign (resid  39 and name o ) 
       (resid  42 and name hn )  2.0 0.7 0.5
assign (resid  39 and name o ) 
       (resid  42 and name n )  3.0 0.7 0.5

assign (resid  60 and name o ) 
       (resid  41 and name hn )  2.0 0.7 0.5
assign (resid  60 and name o ) 
       (resid  41 and name n )  3.0 0.7 0.5

assign (resid  42 and name o ) 
       (resid  60 and name hn )  2.0 0.7 0.5
assign (resid  42 and name o ) 
       (resid  60 and name n )  3.0 0.7 0.5

assign (resid  41 and name o ) 
       (resid  114 and name hn )  2.0 0.7 0.5
assign (resid  41 and name o ) 
       (resid  114 and name n )  3.0 0.7 0.5

assign (resid  41 and name o ) 
       (resid  43 and name hn )  2.0 0.7 0.5
assign (resid  41 and name o ) 
       (resid  43 and name n )  3.0 0.7 0.5

assign (resid  58 and name o ) 
       (resid  44 and name hn )  2.0 0.7 0.5
assign (resid  58 and name o ) 
       (resid  44 and name n )  3.0 0.7 0.5

assign (resid  56 and name o ) 
       (resid  46 and name hn )  2.0 0.7 0.5
assign (resid  56 and name o ) 
       (resid  46 and name n )  3.0 0.7 0.5

assign (resid  44 and name o ) 
       (resid  58 and name hn )  2.0 0.7 0.5
assign (resid  44 and name o ) 
       (resid  58 and name n )  3.0 0.7 0.5

assign (resid  46 and name o ) 
       (resid  56 and name hn )  2.0 0.7 0.5
assign (resid  46 and name o ) 
       (resid  56 and name n )  3.0 0.7 0.5

assign (resid  54 and name o ) 
       (resid  48 and name hn )  2.0 0.7 0.5
assign (resid  54 and name o ) 
       (resid  48 and name n )  3.0 0.7 0.5

assign (resid  55 and name o ) 
       (resid  70 and name hn )  2.0 0.7 0.5
assign (resid  55 and name o ) 
       (resid  70 and name n )  3.0 0.7 0.5

assign (resid  68 and name o ) 
       (resid  57 and name hn )  2.0 0.7 0.5
assign (resid  68 and name o ) 
       (resid  57 and name n )  3.0 0.7 0.5

assign (resid  57 and name o ) 
       (resid  68 and name hn )  2.0 0.7 0.5
assign (resid  57 and name o ) 
       (resid  68 and name n )  3.0 0.7 0.5

assign (resid  66 and name o ) 
       (resid  59 and name hn )  2.0 0.7 0.5
assign (resid  66 and name o ) 
       (resid  59 and name n )  3.0 0.7 0.5

assign (resid  59 and name o ) 
       (resid  66 and name hn )  2.0 0.7 0.5
assign (resid  59 and name o ) 
       (resid  66 and name n )  3.0 0.7 0.5

assign (resid  64 and name o ) 
       (resid  61 and name hn )  2.0 0.7 0.5
assign (resid  64 and name o ) 
       (resid  61 and name n )  3.0 0.7 0.5

assign (resid  61 and name o ) 
       (resid  63 and name hn )  2.0 0.7 0.5
assign (resid  61 and name o ) 
       (resid  63 and name n )  3.0 0.7 0.5

assign (resid  61 and name o ) 
       (resid  64 and name hn )  2.0 0.7 0.5
assign (resid  61 and name o ) 
       (resid  64 and name n )  3.0 0.7 0.5

assign (resid  80 and name o ) 
       (resid  71 and name hn )  2.0 0.7 0.5
assign (resid  80 and name o ) 
       (resid  71 and name n )  3.0 0.7 0.5

assign (resid  71 and name o ) 
       (resid  80 and name hn )  2.0 0.7 0.5
assign (resid  71 and name o ) 
       (resid  80 and name n )  3.0 0.7 0.5

assign (resid  100 and name o ) 
       (resid  113 and name hn )  2.0 0.7 0.5
assign (resid  100 and name o ) 
       (resid  113 and name n )  3.0 0.7 0.5

assign (resid  78 and name o ) 
       (resid  74 and name hn )  2.0 0.7 0.5
assign (resid  78 and name o ) 
       (resid  74 and name n )  3.0 0.7 0.5

assign (resid  74 and name o ) 
       (resid  77 and name hn )  2.0 0.7 0.5
assign (resid  74 and name o ) 
       (resid  77 and name n )  3.0 0.7 0.5

assign (resid  111 and name o ) 
       (resid  105 and name hn )  2.0 0.7 0.5
assign (resid  111 and name o ) 
       (resid  105 and name n )  3.0 0.7 0.5

assign (resid  90 and name o ) 
       (resid  79 and name hn )  2.0 0.7 0.5
assign (resid  90 and name o ) 
       (resid  79 and name n )  3.0 0.7 0.5

assign (resid  93 and name o ) 
       (resid  96 and name hn )  2.0 0.7 0.5
assign (resid  93 and name o ) 
       (resid  96 and name n )  3.0 0.7 0.5

assign (resid  93 and name o ) 
       (resid  97 and name hn )  2.0 0.7 0.5
assign (resid  93 and name o ) 
       (resid  97 and name n )  3.0 0.7 0.5

assign (resid  92 and name o ) 
       (resid  96 and name hn )  2.0 0.7 0.5
assign (resid  92 and name o ) 
       (resid  96 and name n )  3.0 0.7 0.5

assign (resid  92 and name o ) 
       (resid  95 and name hn )  2.0 0.7 0.5
assign (resid  92 and name o ) 
       (resid  95 and name n )  3.0 0.7 0.5

assign (resid  94 and name o ) 
       (resid  98 and name hn )  2.0 0.7 0.5
assign (resid  94 and name o ) 
       (resid  98 and name n )  3.0 0.7 0.5

assign (resid  97 and name o ) 
       (resid  100 and name hn )  2.0 0.7 0.5
assign (resid  97 and name o ) 
       (resid  100 and name n )  3.0 0.7 0.5

assign (resid  95 and name o ) 
       (resid  99 and name hn )  2.0 0.7 0.5
assign (resid  95 and name o ) 
       (resid  99 and name n )  3.0 0.7 0.5

assign (resid  99 and name o ) 
       (resid  102 and name hn )  2.0 0.7 0.5
assign (resid  99 and name o ) 
       (resid  102 and name n )  3.0 0.7 0.5

assign (resid  99 and name o ) 
       (resid  103 and name hn )  2.0 0.7 0.5
assign (resid  99 and name o ) 
       (resid  103 and name n )  3.0 0.7 0.5

assign (resid  29 and name o ) 
       (resid  32 and name hn )  2.0 0.7 0.5
assign (resid  29 and name o ) 
       (resid  32 and name n )  3.0 0.7 0.5

assign (resid  29 and name o ) 
       (resid  33 and name hn )  2.0 0.7 0.5
assign (resid  29 and name o ) 
       (resid  33 and name n )  3.0 0.7 0.5

assign (resid  26 and name o ) 
       (resid  30 and name hn )  2.0 0.7 0.5
assign (resid  26 and name o ) 
       (resid  30 and name n )  3.0 0.7 0.5

assign (resid  26 and name o ) 
       (resid  29 and name hn )  2.0 0.7 0.5
assign (resid  26 and name o ) 
       (resid  29 and name n )  3.0 0.7 0.5

assign (resid  25 and name o ) 
       (resid  29 and name hn )  2.0 0.7 0.5
assign (resid  25 and name o ) 
       (resid  29 and name n )  3.0 0.7 0.5

assign (resid  25 and name o ) 
       (resid  28 and name hn )  2.0 0.7 0.5
assign (resid  25 and name o ) 
       (resid  28 and name n )  3.0 0.7 0.5

assign (resid  30 and name o ) 
       (resid  34 and name hn )  2.0 0.7 0.5
assign (resid  30 and name o ) 
       (resid  34 and name n )  3.0 0.7 0.5

assign (resid  28 and name o ) 
       (resid  31 and name hn )  2.0 0.7 0.5
assign (resid  28 and name o ) 
       (resid  31 and name n )  3.0 0.7 0.5

assign (resid  28 and name o ) 
       (resid  32 and name hn )  2.0 0.7 0.5
assign (resid  28 and name o ) 
       (resid  32 and name n )  3.0 0.7 0.5

assign (resid  79 and name o ) 
       (resid  90 and name hn )  2.0 0.7 0.5
assign (resid  79 and name o ) 
       (resid  90 and name n )  3.0 0.7 0.5

assign (resid  96 and name o ) 
       (resid  100 and name hn )  2.0 0.7 0.5
assign (resid  96 and name o ) 
       (resid  100 and name n )  3.0 0.7 0.5

assign (resid  32 and name o ) 
       (resid  35 and name hn )  2.0 0.7 0.5
assign (resid  32 and name o ) 
       (resid  35 and name n )  3.0 0.7 0.5

assign (resid  65 and name o ) 
       (resid  30 and name he2 )  2.0 0.7 0.5
assign (resid  65 and name o ) 
       (resid  30 and name ne2 )  3.0 0.7 0.5

assign (resid  33 and name o ) 
       (resid  60 and name hsg )  2.0 0.7 0.5
assign (resid  33 and name o ) 
       (resid  60 and name sg )  3.0 0.7 0.5

assign (resid  117 and name o ) 
       (resid  36 and name he2 )  2.0 0.7 0.5
assign (resid  117 and name o ) 
       (resid  36 and name ne2 )  3.0 0.7 0.5

assign (resid  36 and name oe1 ) 
       (resid  117 and name hn )  2.0 0.7 0.5
assign (resid  36 and name oe1 ) 
       (resid  117 and name n )  3.0 0.7 0.5

assign (resid  43 and name o ) 
       (resid  116 and name hg1 )  2.0 0.7 0.5
assign (resid  43 and name o ) 
       (resid  116 and name og1 )  3.0 0.7 0.5

assign (resid  58 and name og ) 
       (resid  67 and name hd1 )  2.0 0.7 0.5
assign (resid  58 and name og ) 
       (resid  67 and name nd1 )  3.0 0.7 0.5

assign (resid  58 and name og ) 
       (resid  46 and name hne )  2.0 0.7 0.5
assign (resid  58 and name og ) 
       (resid  46 and name ne )  3.0 0.7 0.5

assign (resid  40 and name od1 ) 
       (resid  62 and name hn )  2.0 0.7 0.5
assign (resid  40 and name od1 ) 
       (resid  62 and name n )  3.0 0.7 0.5


! H-bonds to phosphate

assign (resid  125 and name o#p ) 
       (resid  46 and name hh# )  2.0 0.7 0.5
assign (resid  125 and name o#p ) 
       (resid  46 and name nh# )  3.0 0.7 0.5

assign (resid  125 and name o#p ) 
       (resid  48 and name hg1 )  2.0 0.7 0.5
assign (resid  125 and name o#p ) 
       (resid  48 and name og1 )  3.0 0.7 0.5

assign (resid  125 and name o#p ) 
       (resid  26 and name hh# )  2.0 0.7 0.5
assign (resid  125 and name o#p ) 
       (resid  26 and name nh# )  3.0 0.7 0.5



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          HT1       GLY   1  20.098   9.623  -8.995
    2   2H    GLY   1          HT2       GLY   1  19.631  10.757  -7.831
    3   3H    GLY   1          HT3       GLY   1  18.499  10.174  -8.944
    4   1HA   GLY   1          HA1       GLY   1  18.459   8.042  -7.981
    5   2HA   GLY   1          HA2       GLY   1  19.884   8.405  -7.018
    6    H    SER   2           HN       SER   2  18.426   7.585  -5.288
    7    HA   SER   2           HA       SER   2  17.182   9.846  -3.978
    8   1HB   SER   2          HB2       SER   2  15.262   9.010  -5.135
    9   2HB   SER   2          HB1       SER   2  15.616   7.353  -4.662
   10    HG   SER   2           HG       SER   2  14.005   8.221  -3.337
   11    HA   PRO   3           HA       PRO   3  17.542   6.266  -0.703
   12   1HB   PRO   3          HB2       PRO   3  18.838   4.009  -1.629
   13   2HB   PRO   3          HB1       PRO   3  17.085   4.170  -1.478
   14   1HG   PRO   3          HG2       PRO   3  18.821   4.511  -3.892
   15   2HG   PRO   3          HG1       PRO   3  17.242   3.713  -3.749
   16   1HD   PRO   3          HD2       PRO   3  17.453   6.167  -4.778
   17   2HD   PRO   3          HD1       PRO   3  16.087   5.728  -3.735
   18    H    ALA   4           HN       ALA   4  19.079   7.441   0.315
   19    HA   ALA   4           HA       ALA   4  21.853   6.687  -0.122
   20   1HB   ALA   4          HB1       ALA   4  22.031   8.495  -1.513
   21   2HB   ALA   4          HB2       ALA   4  22.377   9.261   0.038
   22   3HB   ALA   4          HB3       ALA   4  20.770   9.402  -0.677
   23    H    SER   5           HN       SER   5  19.652   8.818   1.683
   24    HA   SER   5           HA       SER   5  21.343   8.547   4.053
   25   1HB   SER   5          HB2       SER   5  18.919  10.291   3.547
   26   2HB   SER   5          HB1       SER   5  19.886  10.301   5.022
   27    HG   SER   5           HG       SER   5  21.550  11.194   3.944
   28    H    GLY   6           HN       GLY   6  19.746   8.643   6.145
   29   1HA   GLY   6          HA2       GLY   6  17.817   7.655   7.169
   30   2HA   GLY   6          HA1       GLY   6  17.728   6.525   5.826
   31    H    THR   7           HN       THR   7  18.239   6.584   8.976
   32    HA   THR   7           HA       THR   7  20.051   4.278   8.869
   33    HB   THR   7           HB       THR   7  20.227   6.547  10.862
   34    HG1  THR   7           HG1      THR   7  21.271   7.123   9.012
   35   1HG2  THR   7          1HG2      THR   7  21.196   3.818  11.012
   36   2HG2  THR   7          2HG2      THR   7  21.116   5.066  12.255
   37   3HG2  THR   7          3HG2      THR   7  22.486   5.013  11.144
   38    H    SER   8           HN       SER   8  18.461   6.035  11.525
   39    HA   SER   8           HA       SER   8  16.581   3.855  11.907
   40   1HB   SER   8          HB2       SER   8  18.587   4.613  14.044
   41   2HB   SER   8          HB1       SER   8  17.226   3.514  14.268
   42    HG   SER   8           HG       SER   8  19.399   3.157  12.475
   43    H    LEU   9           HN       LEU   9  14.706   4.882  12.074
   44    HA   LEU   9           HA       LEU   9  14.402   6.997  14.048
   45   1HB   LEU   9          HB2       LEU   9  13.627   7.380  11.154
   46   2HB   LEU   9          HB1       LEU   9  13.229   8.477  12.462
   47    HG   LEU   9           HG       LEU   9  16.019   7.846  11.494
   48   1HD1  LEU   9          1HD1      LEU   9  15.277   9.219   9.840
   49   2HD1  LEU   9          2HD1      LEU   9  15.755  10.439  11.021
   50   3HD1  LEU   9          3HD1      LEU   9  14.059   9.981  10.863
   51   1HD2  LEU   9          1HD2      LEU   9  15.767  10.208  13.109
   52   2HD2  LEU   9          2HD2      LEU   9  16.804   8.800  13.340
   53   3HD2  LEU   9          3HD2      LEU   9  15.165   8.804  13.990
   54    H    SER  10           HN       SER  10  12.047   7.594  14.309
   55    HA   SER  10           HA       SER  10  10.164   5.577  13.397
   56   1HB   SER  10          HB2       SER  10  11.093   4.560  15.423
   57   2HB   SER  10          HB1       SER  10  10.716   6.019  16.341
   58    HG   SER  10           HG       SER  10   8.681   5.447  16.428
   59    H    ALA  11           HN       ALA  11   8.255   6.466  12.975
   60    HA   ALA  11           HA       ALA  11   7.282   8.727  14.521
   61   1HB   ALA  11          HB1       ALA  11   8.712   9.348  12.323
   62   2HB   ALA  11          HB2       ALA  11   7.378  10.326  12.932
   63   3HB   ALA  11          HB3       ALA  11   7.105   9.186  11.615
   64    H    ALA  12           HN       ALA  12   5.186   8.414  14.915
   65    HA   ALA  12           HA       ALA  12   3.461   7.276  12.867
   66   1HB   ALA  12          HB1       ALA  12   2.572   5.755  14.881
   67   2HB   ALA  12          HB2       ALA  12   4.279   5.837  15.316
   68   3HB   ALA  12          HB3       ALA  12   3.800   5.214  13.737
   69    H    ILE  13           HN       ILE  13   2.688   9.508  13.026
   70    HA   ILE  13           HA       ILE  13   1.382  10.353  15.453
   71    HB   ILE  13           HB       ILE  13   2.432  12.007  13.995
   72   1HG1  ILE  13          2HG1      ILE  13   0.565  13.619  13.886
   73   2HG1  ILE  13          1HG1      ILE  13  -0.578  12.302  14.125
   74   1HG2  ILE  13          1HG2      ILE  13   0.328  11.953  11.953
   75   2HG2  ILE  13          2HG2      ILE  13   1.424  10.572  11.921
   76   3HG2  ILE  13          3HG2      ILE  13   2.067  12.209  11.791
   77   1HD1  ILE  13          1HD1      ILE  13   0.244  11.910  16.333
   78   2HD1  ILE  13          2HD1      ILE  13  -0.108  13.630  16.162
   79   3HD1  ILE  13          3HD1      ILE  13   1.560  13.060  16.098
   80    H    HIS  14           HN       HIS  14  -0.462   9.367  16.043
   81    HA   HIS  14           HA       HIS  14  -2.648   9.240  14.084
   82   1HB   HIS  14          HB2       HIS  14  -2.072   7.000  16.032
   83   2HB   HIS  14          HB1       HIS  14  -3.308   7.030  14.778
   84    HD1  HIS  14           HD1      HIS  14   0.458   7.473  14.817
   85    HD2  HIS  14           HD2      HIS  14  -2.509   5.500  12.700
   86    HE1  HIS  14           HE1      HIS  14   1.654   6.230  12.995
   87    HE2  HIS  14           HE2      HIS  14  -0.150   4.926  11.816
   88    H    ARG  15           HN       ARG  15  -4.688   9.668  14.922
   89    HA   ARG  15           HA       ARG  15  -4.825  10.114  17.815
   90   1HB   ARG  15          HB2       ARG  15  -6.209  12.128  17.429
   91   2HB   ARG  15          HB1       ARG  15  -4.567  12.293  16.815
   92   1HG   ARG  15          HG2       ARG  15  -5.318  11.905  14.555
   93   2HG   ARG  15          HG1       ARG  15  -6.949  11.551  15.118
   94   1HD   ARG  15          HD2       ARG  15  -5.521  14.216  15.180
   95   2HD   ARG  15          HD1       ARG  15  -6.933  13.769  14.227
   96    HE   ARG  15           HE       ARG  15  -7.591  13.398  16.903
   97   1HH1  ARG  15          HH11      ARG  15  -6.759  16.018  14.755
   98   2HH1  ARG  15          HH12      ARG  15  -7.690  17.191  15.623
   99   1HH2  ARG  15          HH21      ARG  15  -8.817  14.940  18.048
  100   2HH2  ARG  15          HH22      ARG  15  -8.858  16.581  17.492
  101    H    THR  16           HN       THR  16  -5.935   8.364  15.439
  102    HA   THR  16           HA       THR  16  -8.454   7.813  16.800
  103    HB   THR  16           HB       THR  16  -9.706   7.713  14.706
  104    HG1  THR  16           HG1      THR  16  -8.766   8.244  12.775
  105   1HG2  THR  16          1HG2      THR  16  -8.567  10.324  14.181
  106   2HG2  THR  16          2HG2      THR  16  -8.913  10.061  15.891
  107   3HG2  THR  16          3HG2      THR  16 -10.194   9.874  14.694
  108    H    GLN  17           HN       GLN  17  -9.131   5.965  14.489
  109    HA   GLN  17           HA       GLN  17  -7.331   3.799  15.293
  110   1HB   GLN  17          HB2       GLN  17  -9.092   2.316  14.282
  111   2HB   GLN  17          HB1       GLN  17  -9.625   3.249  15.672
  112   1HG   GLN  17          HG2       GLN  17 -11.342   3.232  13.993
  113   2HG   GLN  17          HG1       GLN  17 -10.696   4.862  14.159
  114    H    LEU  18           HN       LEU  18  -6.549   5.835  13.414
  115    HA   LEU  18           HA       LEU  18  -6.747   5.236  10.740
  116   1HB   LEU  18          HB2       LEU  18  -4.184   6.122  12.046
  117   2HB   LEU  18          HB1       LEU  18  -4.720   6.454  10.412
  118    HG   LEU  18           HG       LEU  18  -5.919   7.590  12.940
  119   1HD1  LEU  18          1HD1      LEU  18  -5.055   9.725  12.035
  120   2HD1  LEU  18          2HD1      LEU  18  -4.224   8.815  10.775
  121   3HD1  LEU  18          3HD1      LEU  18  -3.784   8.580  12.466
  122   1HD2  LEU  18          1HD2      LEU  18  -7.574   7.198  11.134
  123   2HD2  LEU  18          2HD2      LEU  18  -6.600   8.218  10.074
  124   3HD2  LEU  18          3HD2      LEU  18  -7.337   8.902  11.524
  125    H    TRP  19           HN       TRP  19  -5.596   3.979   9.278
  126    HA   TRP  19           HA       TRP  19  -3.970   1.841  10.479
  127   1HB   TRP  19          HB2       TRP  19  -4.659   0.664   8.197
  128   2HB   TRP  19          HB1       TRP  19  -5.665   0.574   9.633
  129    HD1  TRP  19           HD1      TRP  19  -8.112   0.944   9.134
  130    HE1  TRP  19           HE1      TRP  19  -9.489   2.233   7.388
  131    HE3  TRP  19           HE3      TRP  19  -4.289   3.109   6.502
  132    HZ2  TRP  19           HZ2      TRP  19  -9.027   3.936   5.194
  133    HZ3  TRP  19           HZ3      TRP  19  -4.853   4.552   4.592
  134    HH2  TRP  19           HH2      TRP  19  -7.170   4.954   3.951
  135    H    PHE  20           HN       PHE  20  -2.814   4.225   9.888
  136    HA   PHE  20           HA       PHE  20  -1.312   3.734   7.410
  137   1HB   PHE  20          HB2       PHE  20  -1.526   6.303   8.991
  138   2HB   PHE  20          HB1       PHE  20  -0.702   6.097   7.452
  139    HD1  PHE  20           HD1      PHE  20  -1.784   6.990   5.662
  140    HD2  PHE  20           HD2      PHE  20  -4.101   5.368   8.844
  141    HE1  PHE  20           HE1      PHE  20  -3.846   7.628   4.482
  142    HE2  PHE  20           HE2      PHE  20  -6.165   5.997   7.666
  143    HZ   PHE  20           HZ       PHE  20  -6.040   7.130   5.483
  144    H    HIS  21           HN       HIS  21   0.886   3.525   7.463
  145    HA   HIS  21           HA       HIS  21   2.277   3.995  10.000
  146   1HB   HIS  21          HB2       HIS  21   1.639   1.633  10.061
  147   2HB   HIS  21          HB1       HIS  21   2.382   1.368   8.493
  148    HD1  HIS  21           HD1      HIS  21   5.091   1.778   8.480
  149    HD2  HIS  21           HD2      HIS  21   3.275   1.174  12.167
  150    HE1  HIS  21           HE1      HIS  21   6.950   1.150  10.051
  151    HE2  HIS  21           HE2      HIS  21   5.817   0.715  12.257
  152    H    GLY  22           HN       GLY  22   4.738   3.832   9.682
  153   1HA   GLY  22          HA2       GLY  22   5.359   5.123   7.125
  154   2HA   GLY  22          HA1       GLY  22   6.320   5.209   8.589
  155    H    ARG  23           HN       ARG  23   8.068   3.996   8.699
  156    HA   ARG  23           HA       ARG  23   8.758   2.301   6.502
  157   1HB   ARG  23          HB2       ARG  23  10.399   3.745   7.543
  158   2HB   ARG  23          HB1       ARG  23  10.228   2.888   9.065
  159   1HG   ARG  23          HG2       ARG  23  11.055   0.840   7.957
  160   2HG   ARG  23          HG1       ARG  23  11.314   1.779   6.485
  161   1HD   ARG  23          HD2       ARG  23  13.388   1.544   7.732
  162   2HD   ARG  23          HD1       ARG  23  12.873   3.230   7.690
  163    HE   ARG  23           HE       ARG  23  11.865   2.073  10.023
  164   1HH1  ARG  23          HH11      ARG  23  14.947   2.924   8.623
  165   2HH1  ARG  23          HH12      ARG  23  15.712   3.184  10.155
  166   1HH2  ARG  23          HH21      ARG  23  12.869   2.413  12.037
  167   2HH2  ARG  23          HH22      ARG  23  14.533   2.893  12.094
  168    H    ILE  24           HN       ILE  24   7.501   0.462   6.509
  169    HA   ILE  24           HA       ILE  24   8.057  -1.383   8.743
  170    HB   ILE  24           HB       ILE  24   5.642  -0.800   8.643
  171   1HG1  ILE  24          2HG1      ILE  24   6.311  -3.656   7.900
  172   2HG1  ILE  24          1HG1      ILE  24   6.372  -2.970   9.520
  173   1HG2  ILE  24          1HG2      ILE  24   4.274  -1.613   6.800
  174   2HG2  ILE  24          2HG2      ILE  24   5.717  -2.147   5.948
  175   3HG2  ILE  24          3HG2      ILE  24   5.451  -0.427   6.238
  176   1HD1  ILE  24          1HD1      ILE  24   4.178  -4.153   8.155
  177   2HD1  ILE  24          2HD1      ILE  24   3.791  -2.470   8.511
  178   3HD1  ILE  24          3HD1      ILE  24   4.266  -3.561   9.813
  179    H    SER  25           HN       SER  25   9.531  -2.792   8.088
  180    HA   SER  25           HA       SER  25  10.543  -3.239   5.628
  181   1HB   SER  25          HB2       SER  25  10.142  -5.352   7.758
  182   2HB   SER  25          HB1       SER  25  11.274  -5.466   6.411
  183    HG   SER  25           HG       SER  25  11.360  -3.821   8.683
  184    H    ARG  26           HN       ARG  26   8.962  -3.189   4.001
  185    HA   ARG  26           HA       ARG  26   6.674  -4.672   3.802
  186   1HB   ARG  26          HB2       ARG  26   7.464  -4.728   1.194
  187   2HB   ARG  26          HB1       ARG  26   6.661  -3.375   1.966
  188   1HG   ARG  26          HG2       ARG  26   8.501  -2.560   0.712
  189   2HG   ARG  26          HG1       ARG  26   8.879  -2.377   2.419
  190   1HD   ARG  26          HD2       ARG  26  10.330  -4.293   2.347
  191   2HD   ARG  26          HD1       ARG  26   9.854  -4.641   0.683
  192    HE   ARG  26           HE       ARG  26  11.392  -3.103   0.002
  193   1HH1  ARG  26          HH11      ARG  26  10.614  -2.467   3.345
  194   2HH1  ARG  26          HH12      ARG  26  11.662  -1.096   3.463
  195   1HH2  ARG  26          HH21      ARG  26  12.765  -1.281   0.156
  196   2HH2  ARG  26          HH22      ARG  26  12.881  -0.425   1.658
  197    H    GLU  27           HN       GLU  27   9.959  -5.753   3.131
  198    HA   GLU  27           HA       GLU  27   9.339  -8.217   1.960
  199   1HB   GLU  27          HB2       GLU  27  11.593  -8.929   2.688
  200   2HB   GLU  27          HB1       GLU  27  11.598  -7.351   1.913
  201   1HG   GLU  27          HG2       GLU  27  11.663  -6.293   4.137
  202   2HG   GLU  27          HG1       GLU  27  11.746  -7.895   4.867
  203    H    GLU  28           HN       GLU  28   9.941  -7.420   5.382
  204    HA   GLU  28           HA       GLU  28   9.177 -10.068   6.242
  205   1HB   GLU  28          HB2       GLU  28   9.764  -7.558   7.821
  206   2HB   GLU  28          HB1       GLU  28   9.463  -9.137   8.530
  207   1HG   GLU  28          HG2       GLU  28  11.438 -10.018   7.379
  208   2HG   GLU  28          HG1       GLU  28  11.744  -8.420   6.703
  209    H    SER  29           HN       SER  29   7.594  -7.102   5.591
  210    HA   SER  29           HA       SER  29   5.456  -7.191   7.390
  211   1HB   SER  29          HB2       SER  29   5.944  -5.216   6.033
  212   2HB   SER  29          HB1       SER  29   5.525  -6.101   4.567
  213    HG   SER  29           HG       SER  29   3.398  -6.303   5.409
  214    H    GLN  30           HN       GLN  30   5.877  -8.701   4.220
  215    HA   GLN  30           HA       GLN  30   3.226  -9.700   4.100
  216   1HB   GLN  30          HB2       GLN  30   4.020 -11.061   2.218
  217   2HB   GLN  30          HB1       GLN  30   4.526  -9.385   2.073
  218   1HG   GLN  30          HG2       GLN  30   6.741 -10.018   2.941
  219   2HG   GLN  30          HG1       GLN  30   6.223 -11.700   2.963
  220    H    ARG  31           HN       ARG  31   5.917 -10.639   5.909
  221    HA   ARG  31           HA       ARG  31   5.278 -13.434   6.077
  222   1HB   ARG  31          HB2       ARG  31   7.572 -12.576   6.470
  223   2HB   ARG  31          HB1       ARG  31   6.991 -11.721   7.891
  224   1HG   ARG  31          HG2       ARG  31   8.056 -13.685   8.655
  225   2HG   ARG  31          HG1       ARG  31   6.321 -13.944   8.838
  226   1HD   ARG  31          HD2       ARG  31   7.944 -14.923   6.494
  227   2HD   ARG  31          HD1       ARG  31   7.574 -15.899   7.912
  228    HE   ARG  31           HE       ARG  31   5.867 -15.403   5.714
  229   1HH1  ARG  31          HH11      ARG  31   5.831 -15.799   9.181
  230   2HH1  ARG  31          HH12      ARG  31   4.184 -16.329   9.229
  231   1HH2  ARG  31          HH21      ARG  31   3.703 -16.105   5.774
  232   2HH2  ARG  31          HH22      ARG  31   2.976 -16.506   7.294
  233    H    LEU  32           HN       LEU  32   4.574 -10.496   7.852
  234    HA   LEU  32           HA       LEU  32   3.151 -11.914   9.951
  235   1HB   LEU  32          HB2       LEU  32   3.444  -8.956   9.441
  236   2HB   LEU  32          HB1       LEU  32   2.824  -9.698  10.905
  237    HG   LEU  32           HG       LEU  32   5.565 -10.455  10.037
  238   1HD1  LEU  32          1HD1      LEU  32   5.645  -8.088   9.715
  239   2HD1  LEU  32          2HD1      LEU  32   6.475  -8.479  11.222
  240   3HD1  LEU  32          3HD1      LEU  32   4.846  -7.801  11.262
  241   1HD2  LEU  32          1HD2      LEU  32   4.559 -11.493  11.993
  242   2HD2  LEU  32          2HD2      LEU  32   4.276  -9.906  12.708
  243   3HD2  LEU  32          3HD2      LEU  32   5.926 -10.482  12.462
  244    H    ILE  33           HN       ILE  33   2.279  -9.255   7.720
  245    HA   ILE  33           HA       ILE  33  -0.520  -9.619   8.109
  246    HB   ILE  33           HB       ILE  33   0.987  -8.068   5.998
  247   1HG1  ILE  33          2HG1      ILE  33   0.185  -6.110   7.332
  248   2HG1  ILE  33          1HG1      ILE  33  -0.443  -7.233   8.532
  249   1HG2  ILE  33          1HG2      ILE  33  -1.903  -8.575   6.352
  250   2HG2  ILE  33          2HG2      ILE  33  -0.983  -8.212   4.893
  251   3HG2  ILE  33          3HG2      ILE  33  -1.429  -6.913   5.999
  252   1HD1  ILE  33          1HD1      ILE  33   2.444  -7.242   7.743
  253   2HD1  ILE  33          2HD1      ILE  33   1.689  -7.889   9.200
  254   3HD1  ILE  33          3HD1      ILE  33   1.816  -6.145   8.973
  255    H    GLY  34           HN       GLY  34   1.691 -11.422   6.328
  256   1HA   GLY  34          HA2       GLY  34  -0.286 -12.142   4.289
  257   2HA   GLY  34          HA1       GLY  34   1.406 -12.629   4.304
  258    H    GLN  35           HN       GLN  35  -0.474 -12.776   7.163
  259    HA   GLN  35           HA       GLN  35  -0.441 -15.698   7.086
  260   1HB   GLN  35          HB2       GLN  35  -0.691 -15.641   9.476
  261   2HB   GLN  35          HB1       GLN  35   0.594 -14.518   9.057
  262   1HG   GLN  35          HG2       GLN  35  -1.042 -12.663   9.225
  263   2HG   GLN  35          HG1       GLN  35  -2.244 -13.827   9.774
  264    H    GLN  36           HN       GLN  36  -2.412 -12.900   6.770
  265    HA   GLN  36           HA       GLN  36  -4.861 -13.991   7.683
  266   1HB   GLN  36          HB2       GLN  36  -4.130 -11.674   5.937
  267   2HB   GLN  36          HB1       GLN  36  -5.808 -12.195   6.018
  268   1HG   GLN  36          HG2       GLN  36  -6.037 -10.969   7.842
  269   2HG   GLN  36          HG1       GLN  36  -4.945 -12.078   8.668
  270    H    GLY  37           HN       GLY  37  -6.367 -15.237   6.686
  271   1HA   GLY  37          HA2       GLY  37  -5.581 -16.358   4.088
  272   2HA   GLY  37          HA1       GLY  37  -6.688 -17.101   5.237
  273    H    LEU  38           HN       LEU  38  -7.101 -13.738   4.587
  274    HA   LEU  38           HA       LEU  38  -9.693 -14.260   3.447
  275   1HB   LEU  38          HB2       LEU  38  -8.232 -11.681   4.008
  276   2HB   LEU  38          HB1       LEU  38  -9.862 -11.769   3.371
  277    HG   LEU  38           HG       LEU  38  -9.904 -11.322   5.759
  278   1HD1  LEU  38          1HD1      LEU  38 -11.463 -13.076   4.476
  279   2HD1  LEU  38          2HD1      LEU  38 -11.662 -12.677   6.183
  280   3HD1  LEU  38          3HD1      LEU  38 -10.794 -14.138   5.715
  281   1HD2  LEU  38          1HD2      LEU  38  -8.970 -12.741   7.389
  282   2HD2  LEU  38          2HD2      LEU  38  -7.706 -12.515   6.181
  283   3HD2  LEU  38          3HD2      LEU  38  -8.639 -14.011   6.210
  284    H    VAL  39           HN       VAL  39 -10.231 -12.529   1.568
  285    HA   VAL  39           HA       VAL  39  -8.734 -13.476  -0.688
  286    HB   VAL  39           HB       VAL  39 -10.361 -12.252  -2.052
  287   1HG1  VAL  39          1HG1      VAL  39 -11.045 -14.432  -1.554
  288   2HG1  VAL  39          2HG1      VAL  39 -12.438 -13.437  -1.128
  289   3HG1  VAL  39          3HG1      VAL  39 -11.367 -14.042   0.136
  290   1HG2  VAL  39          1HG2      VAL  39 -12.338 -11.442  -0.331
  291   2HG2  VAL  39          2HG2      VAL  39 -11.180 -10.380  -1.133
  292   3HG2  VAL  39          3HG2      VAL  39 -10.870 -10.942   0.510
  293    H    ASP  40           HN       ASP  40  -8.429 -11.813  -2.525
  294    HA   ASP  40           HA       ASP  40  -6.326 -10.083  -1.694
  295   1HB   ASP  40          HB2       ASP  40  -7.661  -9.759  -4.356
  296   2HB   ASP  40          HB1       ASP  40  -5.950  -9.677  -3.954
  297    H    GLY  41           HN       GLY  41  -8.204  -9.369  -0.123
  298   1HA   GLY  41          HA2       GLY  41  -9.062  -6.745  -1.193
  299   2HA   GLY  41          HA1       GLY  41 -10.229  -7.766  -0.371
  300    H    LEU  42           HN       LEU  42  -7.371  -8.289   1.178
  301    HA   LEU  42           HA       LEU  42  -8.124  -6.307   3.190
  302   1HB   LEU  42          HB2       LEU  42  -6.421  -8.787   3.372
  303   2HB   LEU  42          HB1       LEU  42  -6.567  -7.636   4.680
  304    HG   LEU  42           HG       LEU  42  -7.999  -9.665   4.921
  305   1HD1  LEU  42          1HD1      LEU  42  -9.816  -8.528   5.834
  306   2HD1  LEU  42          2HD1      LEU  42  -9.736  -7.242   4.629
  307   3HD1  LEU  42          3HD1      LEU  42  -8.505  -7.351   5.887
  308   1HD2  LEU  42          1HD2      LEU  42  -8.540  -9.929   2.528
  309   2HD2  LEU  42          2HD2      LEU  42  -9.548  -8.485   2.623
  310   3HD2  LEU  42          3HD2      LEU  42  -9.971  -9.914   3.559
  311    H    PHE  43           HN       PHE  43  -7.265  -4.474   2.539
  312    HA   PHE  43           HA       PHE  43  -4.385  -4.425   1.915
  313   1HB   PHE  43          HB2       PHE  43  -4.761  -2.625   0.459
  314   2HB   PHE  43          HB1       PHE  43  -6.152  -3.676   0.199
  315    HD1  PHE  43           HD1      PHE  43  -8.332  -2.855   0.504
  316    HD2  PHE  43           HD2      PHE  43  -5.024  -0.630   1.987
  317    HE1  PHE  43           HE1      PHE  43  -9.827  -0.963   0.998
  318    HE2  PHE  43           HE2      PHE  43  -6.513   1.263   2.483
  319    HZ   PHE  43           HZ       PHE  43  -8.919   1.097   1.988
  320    H    LEU  44           HN       LEU  44  -3.127  -2.590   2.563
  321    HA   LEU  44           HA       LEU  44  -4.129  -1.105   4.898
  322   1HB   LEU  44          HB2       LEU  44  -2.709  -2.971   5.668
  323   2HB   LEU  44          HB1       LEU  44  -1.408  -2.400   4.642
  324    HG   LEU  44           HG       LEU  44  -1.268  -0.333   5.975
  325   1HD1  LEU  44          1HD1      LEU  44  -3.337  -1.651   7.725
  326   2HD1  LEU  44          2HD1      LEU  44  -3.602  -0.240   6.704
  327   3HD1  LEU  44          3HD1      LEU  44  -2.489  -0.144   8.068
  328   1HD2  LEU  44          1HD2      LEU  44   0.002  -2.471   6.509
  329   2HD2  LEU  44          2HD2      LEU  44  -1.160  -2.705   7.815
  330   3HD2  LEU  44          3HD2      LEU  44  -0.126  -1.276   7.799
  331    H    VAL  45           HN       VAL  45  -2.671   0.878   5.344
  332    HA   VAL  45           HA       VAL  45  -1.503   1.838   2.809
  333    HB   VAL  45           HB       VAL  45  -3.289   3.434   4.644
  334   1HG1  VAL  45          1HG1      VAL  45  -1.775   5.020   3.893
  335   2HG1  VAL  45          2HG1      VAL  45  -3.041   5.102   2.669
  336   3HG1  VAL  45          3HG1      VAL  45  -1.551   4.219   2.338
  337   1HG2  VAL  45          1HG2      VAL  45  -4.711   3.577   2.591
  338   2HG2  VAL  45          2HG2      VAL  45  -4.590   1.959   3.285
  339   3HG2  VAL  45          3HG2      VAL  45  -3.654   2.376   1.847
  340    H    ARG  46           HN       ARG  46   0.591   1.469   3.541
  341    HA   ARG  46           HA       ARG  46   1.561   3.519   5.389
  342   1HB   ARG  46          HB2       ARG  46   2.436   2.112   6.918
  343   2HB   ARG  46          HB1       ARG  46   1.228   0.993   6.321
  344   1HG   ARG  46          HG2       ARG  46   4.126   1.095   5.515
  345   2HG   ARG  46          HG1       ARG  46   3.367  -0.084   6.571
  346   1HD   ARG  46          HD2       ARG  46   2.041  -0.948   4.753
  347   2HD   ARG  46          HD1       ARG  46   2.624   0.310   3.673
  348    HE   ARG  46           HE       ARG  46   3.863  -2.147   4.115
  349   1HH1  ARG  46          HH11      ARG  46   4.700   1.196   3.899
  350   2HH1  ARG  46          HH12      ARG  46   6.343   0.904   3.479
  351   1HH2  ARG  46          HH21      ARG  46   6.065  -2.554   3.533
  352   2HH2  ARG  46          HH22      ARG  46   7.119  -1.213   3.250
  353    H    GLU  47           HN       GLU  47   4.073   3.742   5.164
  354    HA   GLU  47           HA       GLU  47   4.951   2.535   2.704
  355   1HB   GLU  47          HB2       GLU  47   3.964   4.709   2.010
  356   2HB   GLU  47          HB1       GLU  47   5.274   5.503   2.876
  357   1HG   GLU  47          HG2       GLU  47   6.063   3.343   1.037
  358   2HG   GLU  47          HG1       GLU  47   5.407   4.771   0.271
  359    H    SER  48           HN       SER  48   6.851   5.204   3.304
  360    HA   SER  48           HA       SER  48   8.636   3.599   4.994
  361   1HB   SER  48          HB2       SER  48   9.042   3.280   2.497
  362   2HB   SER  48          HB1       SER  48   9.551   4.964   2.461
  363    HG   SER  48           HG       SER  48  10.693   3.116   4.257
  364    H    GLN  49           HN       GLN  49  10.173   4.721   6.115
  365    HA   GLN  49           HA       GLN  49   9.711   7.605   6.320
  366   1HB   GLN  49          HB2       GLN  49  10.644   7.515   8.515
  367   2HB   GLN  49          HB1       GLN  49   9.561   6.131   8.401
  368   1HG   GLN  49          HG2       GLN  49  11.508   5.383   9.503
  369   2HG   GLN  49          HG1       GLN  49  11.583   4.737   7.869
  370    H    ARG  50           HN       ARG  50  11.382   5.556   4.577
  371    HA   ARG  50           HA       ARG  50  13.965   6.922   4.636
  372   1HB   ARG  50          HB2       ARG  50  13.992   4.448   4.666
  373   2HB   ARG  50          HB1       ARG  50  13.088   4.426   3.160
  374   1HG   ARG  50          HG2       ARG  50  15.352   3.999   2.626
  375   2HG   ARG  50          HG1       ARG  50  14.998   5.644   2.096
  376   1HD   ARG  50          HD2       ARG  50  16.318   4.955   4.718
  377   2HD   ARG  50          HD1       ARG  50  17.200   5.370   3.249
  378    HE   ARG  50           HE       ARG  50  15.988   7.174   5.058
  379   1HH1  ARG  50          HH11      ARG  50  16.574   6.687   1.651
  380   2HH1  ARG  50          HH12      ARG  50  16.495   8.375   1.270
  381   1HH2  ARG  50          HH21      ARG  50  15.889   9.392   4.558
  382   2HH2  ARG  50          HH22      ARG  50  16.108   9.911   2.919
  383    H    ASN  51           HN       ASN  51  11.290   5.984   2.440
  384    HA   ASN  51           HA       ASN  51  12.350   7.679   0.342
  385   1HB   ASN  51          HB2       ASN  51   9.630   6.379   0.530
  386   2HB   ASN  51          HB1       ASN  51  10.410   6.994  -0.925
  387   1HD2  ASN  51          1HD2      ASN  51  12.926   5.749   0.663
  388   2HD2  ASN  51          2HD2      ASN  51  12.885   4.122   0.099
  389    HA   PRO  52           HA       PRO  52  10.690  11.326   2.604
  390   1HB   PRO  52          HB2       PRO  52  11.240  12.885   0.281
  391   2HB   PRO  52          HB1       PRO  52  12.166  12.821   1.780
  392   1HG   PRO  52          HG2       PRO  52  12.632  11.425  -0.788
  393   2HG   PRO  52          HG1       PRO  52  13.793  11.916   0.456
  394   1HD   PRO  52          HD2       PRO  52  13.108   9.347   0.106
  395   2HD   PRO  52          HD1       PRO  52  13.432  10.012   1.721
  396    H    GLN  53           HN       GLN  53  10.109  10.690  -0.824
  397    HA   GLN  53           HA       GLN  53   7.316  11.552  -0.488
  398   1HB   GLN  53          HB2       GLN  53   7.251  12.021  -2.870
  399   2HB   GLN  53          HB1       GLN  53   8.569  12.910  -2.132
  400   1HG   GLN  53          HG2       GLN  53   8.916  10.326  -3.638
  401   2HG   GLN  53          HG1       GLN  53   9.079  11.923  -4.355
  402    H    GLY  54           HN       GLY  54   7.366   9.297   0.524
  403   1HA   GLY  54          HA2       GLY  54   6.750   7.407  -1.639
  404   2HA   GLY  54          HA1       GLY  54   7.765   6.935  -0.294
  405    H    PHE  55           HN       PHE  55   4.808   6.753  -1.592
  406    HA   PHE  55           HA       PHE  55   3.575   5.939   0.937
  407   1HB   PHE  55          HB2       PHE  55   2.288   7.479  -1.314
  408   2HB   PHE  55          HB1       PHE  55   1.352   6.599  -0.110
  409    HD1  PHE  55           HD1      PHE  55   4.308   8.889   0.009
  410    HD2  PHE  55           HD2      PHE  55   0.405   7.989   1.440
  411    HE1  PHE  55           HE1      PHE  55   4.431  10.819   1.520
  412    HE2  PHE  55           HE2      PHE  55   0.512   9.927   2.953
  413    HZ   PHE  55           HZ       PHE  55   2.527  11.346   2.995
  414    H    VAL  56           HN       VAL  56   2.654   3.918   0.925
  415    HA   VAL  56           HA       VAL  56   2.376   2.536  -1.656
  416    HB   VAL  56           HB       VAL  56   3.993   1.048  -1.105
  417   1HG1  VAL  56          1HG1      VAL  56   4.333   1.052   1.692
  418   2HG1  VAL  56          2HG1      VAL  56   4.160   2.727   1.171
  419   3HG1  VAL  56          3HG1      VAL  56   5.404   1.711   0.454
  420   1HG2  VAL  56          1HG2      VAL  56   3.435  -0.731   0.418
  421   2HG2  VAL  56          2HG2      VAL  56   2.002  -0.271  -0.498
  422   3HG2  VAL  56          3HG2      VAL  56   2.194   0.261   1.177
  423    H    LEU  57           HN       LEU  57   0.750   1.117  -1.883
  424    HA   LEU  57           HA       LEU  57  -1.233   1.017   0.286
  425   1HB   LEU  57          HB2       LEU  57  -1.885   1.990  -2.023
  426   2HB   LEU  57          HB1       LEU  57  -1.757   0.341  -2.608
  427    HG   LEU  57           HG       LEU  57  -3.698   1.424  -0.576
  428   1HD1  LEU  57          1HD1      LEU  57  -4.389  -0.147  -3.015
  429   2HD1  LEU  57          2HD1      LEU  57  -4.010   1.570  -3.152
  430   3HD1  LEU  57          3HD1      LEU  57  -5.347   1.040  -2.131
  431   1HD2  LEU  57          1HD2      LEU  57  -4.564  -0.900  -0.439
  432   2HD2  LEU  57          2HD2      LEU  57  -2.966  -0.692   0.281
  433   3HD2  LEU  57          3HD2      LEU  57  -3.129  -1.443  -1.308
  434    H    SER  58           HN       SER  58  -1.197  -0.899   1.319
  435    HA   SER  58           HA       SER  58   0.141  -3.134  -0.004
  436   1HB   SER  58          HB2       SER  58  -0.720  -2.981   2.885
  437   2HB   SER  58          HB1       SER  58   0.497  -4.040   2.172
  438    HG   SER  58           HG       SER  58   0.706  -1.217   2.159
  439    H    LEU  59           HN       LEU  59  -0.798  -5.052  -0.432
  440    HA   LEU  59           HA       LEU  59  -3.688  -5.236   0.081
  441   1HB   LEU  59          HB2       LEU  59  -2.056  -6.472  -2.133
  442   2HB   LEU  59          HB1       LEU  59  -3.775  -6.716  -1.893
  443    HG   LEU  59           HG       LEU  59  -2.433  -4.097  -2.565
  444   1HD1  LEU  59          1HD1      LEU  59  -4.455  -5.401  -4.297
  445   2HD1  LEU  59          2HD1      LEU  59  -2.821  -6.065  -4.290
  446   3HD1  LEU  59          3HD1      LEU  59  -3.085  -4.376  -4.725
  447   1HD2  LEU  59          1HD2      LEU  59  -4.686  -3.195  -2.736
  448   2HD2  LEU  59          2HD2      LEU  59  -4.375  -3.791  -1.106
  449   3HD2  LEU  59          3HD2      LEU  59  -5.359  -4.741  -2.219
  450    H    CYS  60           HN       CYS  60  -4.410  -7.647  -0.057
  451    HA   CYS  60           HA       CYS  60  -2.548  -9.458   1.204
  452   1HB   CYS  60          HB2       CYS  60  -3.781  -8.294   3.071
  453   2HB   CYS  60          HB1       CYS  60  -5.272  -8.935   2.396
  454    HG   CYS  60           HG       CYS  60  -3.083 -10.385   4.403
  455    H    HIS  61           HN       HIS  61  -2.626 -10.341  -0.792
  456    HA   HIS  61           HA       HIS  61  -5.107 -11.142  -1.915
  457   1HB   HIS  61          HB2       HIS  61  -3.632 -10.448  -3.465
  458   2HB   HIS  61          HB1       HIS  61  -2.258 -11.158  -2.676
  459    HD1  HIS  61           HD1      HIS  61  -2.099 -13.883  -3.079
  460    HD2  HIS  61           HD2      HIS  61  -4.624 -11.763  -5.590
  461    HE1  HIS  61           HE1      HIS  61  -2.550 -15.405  -5.023
  462    HE2  HIS  61           HE2      HIS  61  -4.243 -14.183  -6.407
  463    H    LEU  62           HN       LEU  62  -5.111 -13.583  -2.786
  464    HA   LEU  62           HA       LEU  62  -4.924 -15.103  -0.296
  465   1HB   LEU  62          HB2       LEU  62  -6.185 -16.834  -1.890
  466   2HB   LEU  62          HB1       LEU  62  -7.011 -15.564  -1.011
  467    HG   LEU  62           HG       LEU  62  -7.103 -14.177  -2.992
  468   1HD1  LEU  62          1HD1      LEU  62  -4.889 -15.548  -3.849
  469   2HD1  LEU  62          2HD1      LEU  62  -5.853 -14.436  -4.825
  470   3HD1  LEU  62          3HD1      LEU  62  -6.163 -16.174  -4.895
  471   1HD2  LEU  62          1HD2      LEU  62  -8.144 -16.944  -3.035
  472   2HD2  LEU  62          2HD2      LEU  62  -8.270 -16.012  -4.527
  473   3HD2  LEU  62          3HD2      LEU  62  -9.004 -15.403  -3.043
  474    H    GLN  63           HN       GLN  63  -2.651 -14.561  -1.398
  475    HA   GLN  63           HA       GLN  63  -1.608 -17.132  -1.302
  476   1HB   GLN  63          HB2       GLN  63  -1.075 -15.488  -3.777
  477   2HB   GLN  63          HB1       GLN  63  -0.064 -16.836  -3.287
  478   1HG   GLN  63          HG2       GLN  63  -3.001 -17.021  -3.917
  479   2HG   GLN  63          HG1       GLN  63  -1.697 -17.432  -5.026
  480    H    LYS  64           HN       LYS  64  -1.175 -13.684  -1.682
  481    HA   LYS  64           HA       LYS  64   0.775 -13.744   0.438
  482   1HB   LYS  64          HB2       LYS  64   2.547 -12.623  -0.813
  483   2HB   LYS  64          HB1       LYS  64   2.152 -14.165  -1.556
  484   1HG   LYS  64          HG2       LYS  64   0.828 -13.031  -3.253
  485   2HG   LYS  64          HG1       LYS  64   1.182 -11.475  -2.500
  486   1HD   LYS  64          HD2       LYS  64   2.622 -11.869  -4.432
  487   2HD   LYS  64          HD1       LYS  64   3.563 -11.798  -2.941
  488   1HE   LYS  64          HE2       LYS  64   4.324 -13.619  -4.375
  489   2HE   LYS  64          HE1       LYS  64   3.647 -14.236  -2.869
  490   1HZ   LYS  64          HZ1       LYS  64   2.984 -15.342  -5.074
  491   2HZ   LYS  64          HZ2       LYS  64   1.962 -14.009  -5.276
  492   3HZ   LYS  64          HZ3       LYS  64   1.773 -15.024  -3.937
  493    H    VAL  65           HN       VAL  65   1.818 -11.165  -0.068
  494    HA   VAL  65           HA       VAL  65  -0.442  -9.334  -0.213
  495    HB   VAL  65           HB       VAL  65   0.259  -8.100   1.770
  496   1HG1  VAL  65          1HG1      VAL  65   0.047 -10.337   3.374
  497   2HG1  VAL  65          2HG1      VAL  65  -0.727 -10.827   1.869
  498   3HG1  VAL  65          3HG1      VAL  65  -1.290  -9.390   2.721
  499   1HG2  VAL  65          1HG2      VAL  65   2.119 -10.276   2.591
  500   2HG2  VAL  65          2HG2      VAL  65   2.067  -8.586   3.092
  501   3HG2  VAL  65          3HG2      VAL  65   2.687  -9.014   1.499
  502    H    LYS  66           HN       LYS  66   0.384  -7.056  -0.618
  503    HA   LYS  66           HA       LYS  66   3.185  -7.039  -1.477
  504   1HB   LYS  66          HB2       LYS  66   2.431  -5.806  -3.600
  505   2HB   LYS  66          HB1       LYS  66   2.266  -7.551  -3.540
  506   1HG   LYS  66          HG2       LYS  66  -0.007  -5.710  -2.871
  507   2HG   LYS  66          HG1       LYS  66   0.341  -6.217  -4.523
  508   1HD   LYS  66          HD2       LYS  66  -0.370  -7.992  -2.187
  509   2HD   LYS  66          HD1       LYS  66  -1.352  -7.658  -3.609
  510   1HE   LYS  66          HE2       LYS  66   1.254  -9.169  -3.510
  511   2HE   LYS  66          HE1       LYS  66  -0.345  -9.823  -3.854
  512   1HZ   LYS  66          HZ1       LYS  66   1.506  -8.528  -5.612
  513   2HZ   LYS  66          HZ2       LYS  66  -0.037  -7.841  -5.696
  514   3HZ   LYS  66          HZ3       LYS  66   0.167  -9.496  -5.980
  515    H    HIS  67           HN       HIS  67   3.730  -4.765  -2.427
  516    HA   HIS  67           HA       HIS  67   2.484  -2.638  -0.838
  517   1HB   HIS  67          HB2       HIS  67   5.445  -3.266  -0.899
  518   2HB   HIS  67          HB1       HIS  67   4.725  -1.863  -0.120
  519    HD1  HIS  67           HD1      HIS  67   3.053  -2.447   1.928
  520    HD2  HIS  67           HD2      HIS  67   5.555  -5.507   0.648
  521    HE1  HIS  67           HE1      HIS  67   3.019  -4.159   3.770
  522    HE2  HIS  67           HE2      HIS  67   4.437  -6.056   2.914
  523    H    TYR  68           HN       TYR  68   1.814  -1.252  -2.382
  524    HA   TYR  68           HA       TYR  68   3.490  -0.781  -4.744
  525   1HB   TYR  68          HB2       TYR  68   0.649   0.094  -4.193
  526   2HB   TYR  68          HB1       TYR  68   1.502   0.253  -5.722
  527    HD1  TYR  68           HD1      TYR  68  -1.015  -0.950  -5.924
  528    HD2  TYR  68           HD2      TYR  68   2.624  -2.792  -4.712
  529    HE1  TYR  68           HE1      TYR  68  -1.889  -3.134  -6.633
  530    HE2  TYR  68           HE2      TYR  68   1.759  -4.981  -5.420
  531    HH   TYR  68           HH       TYR  68   0.069  -5.889  -6.956
  532    H    LEU  69           HN       LEU  69   5.082   0.616  -3.832
  533    HA   LEU  69           HA       LEU  69   4.023   3.275  -3.140
  534   1HB   LEU  69          HB2       LEU  69   4.814   2.835  -1.109
  535   2HB   LEU  69          HB1       LEU  69   5.864   1.560  -1.664
  536    HG   LEU  69           HG       LEU  69   7.011   3.472  -0.543
  537   1HD1  LEU  69          1HD1      LEU  69   7.854   2.208  -2.910
  538   2HD1  LEU  69          2HD1      LEU  69   8.832   2.900  -1.623
  539   3HD1  LEU  69          3HD1      LEU  69   8.349   3.896  -2.992
  540   1HD2  LEU  69          1HD2      LEU  69   6.837   5.177  -2.902
  541   2HD2  LEU  69          2HD2      LEU  69   6.846   5.575  -1.192
  542   3HD2  LEU  69          3HD2      LEU  69   5.358   5.041  -1.955
  543    H    ILE  70           HN       ILE  70   4.570   4.646  -4.761
  544    HA   ILE  70           HA       ILE  70   7.443   4.702  -5.176
  545    HB   ILE  70           HB       ILE  70   5.705   4.198  -7.564
  546   1HG1  ILE  70          2HG1      ILE  70   8.058   2.889  -6.207
  547   2HG1  ILE  70          1HG1      ILE  70   6.450   2.226  -6.400
  548   1HG2  ILE  70          1HG2      ILE  70   8.216   5.692  -7.294
  549   2HG2  ILE  70          2HG2      ILE  70   7.073   5.647  -8.637
  550   3HG2  ILE  70          3HG2      ILE  70   8.285   4.378  -8.463
  551   1HD1  ILE  70          1HD1      ILE  70   8.732   2.021  -8.110
  552   2HD1  ILE  70          2HD1      ILE  70   7.366   2.715  -8.984
  553   3HD1  ILE  70          3HD1      ILE  70   7.198   1.159  -8.176
  554    H    LEU  71           HN       LEU  71   4.427   6.193  -5.827
  555    HA   LEU  71           HA       LEU  71   5.817   8.778  -5.537
  556   1HB   LEU  71          HB2       LEU  71   3.692   8.510  -7.601
  557   2HB   LEU  71          HB1       LEU  71   4.976   9.689  -7.493
  558    HG   LEU  71           HG       LEU  71   5.572   6.800  -8.068
  559   1HD1  LEU  71          1HD1      LEU  71   3.986   7.379  -9.750
  560   2HD1  LEU  71          2HD1      LEU  71   5.597   7.432 -10.473
  561   3HD1  LEU  71          3HD1      LEU  71   4.777   8.932 -10.035
  562   1HD2  LEU  71          1HD2      LEU  71   7.313   8.593  -7.414
  563   2HD2  LEU  71          2HD2      LEU  71   7.059   9.203  -9.049
  564   3HD2  LEU  71          3HD2      LEU  71   7.636   7.554  -8.803
  565    HA   PRO  72           HA       PRO  72   2.115   9.535  -3.126
  566   1HB   PRO  72          HB2       PRO  72   3.081  11.484  -1.640
  567   2HB   PRO  72          HB1       PRO  72   3.812   9.880  -1.547
  568   1HG   PRO  72          HG2       PRO  72   4.794  12.323  -2.949
  569   2HG   PRO  72          HG1       PRO  72   5.711  11.094  -2.062
  570   1HD   PRO  72          HD2       PRO  72   5.308  11.209  -4.859
  571   2HD   PRO  72          HD1       PRO  72   5.988   9.851  -3.942
  572    H    SER  73           HN       SER  73   1.349  11.991  -2.261
  573    HA   SER  73           HA       SER  73   0.043  13.125  -4.481
  574   1HB   SER  73          HB2       SER  73  -0.886  13.277  -2.229
  575   2HB   SER  73          HB1       SER  73   0.482  14.262  -1.710
  576    HG   SER  73           HG       SER  73  -1.175  15.647  -2.206
  577    H    GLU  74           HN       GLU  74   1.329  13.892  -6.069
  578    HA   GLU  74           HA       GLU  74   3.459  15.782  -5.379
  579   1HB   GLU  74          HB2       GLU  74   2.822  14.328  -7.948
  580   2HB   GLU  74          HB1       GLU  74   4.151  15.464  -7.753
  581   1HG   GLU  74          HG2       GLU  74   5.311  14.050  -6.310
  582   2HG   GLU  74          HG1       GLU  74   3.881  13.076  -5.969
  583    H    GLU  75           HN       GLU  75   3.742  17.475  -7.326
  584    HA   GLU  75           HA       GLU  75   1.233  18.965  -7.343
  585   1HB   GLU  75          HB2       GLU  75   3.179  20.133  -6.479
  586   2HB   GLU  75          HB1       GLU  75   4.080  19.784  -7.946
  587   1HG   GLU  75          HG2       GLU  75   2.640  21.203  -9.228
  588   2HG   GLU  75          HG1       GLU  75   1.597  21.468  -7.835
  589    H    GLU  76           HN       GLU  76   2.378  16.695  -9.138
  590    HA   GLU  76           HA       GLU  76   1.748  17.945 -11.714
  591   1HB   GLU  76          HB2       GLU  76   2.803  15.865 -12.684
  592   2HB   GLU  76          HB1       GLU  76   3.911  16.929 -11.830
  593   1HG   GLU  76          HG2       GLU  76   3.729  15.463  -9.850
  594   2HG   GLU  76          HG1       GLU  76   2.716  14.372 -10.792
  595    H    GLY  77           HN       GLY  77   0.568  16.081  -9.194
  596   1HA   GLY  77          HA2       GLY  77  -1.910  15.561 -10.448
  597   2HA   GLY  77          HA1       GLY  77  -0.956  14.093 -10.399
  598    H    ARG  78           HN       ARG  78  -1.801  12.880  -8.825
  599    HA   ARG  78           HA       ARG  78  -1.897  14.046  -6.153
  600   1HB   ARG  78          HB2       ARG  78  -3.999  12.521  -5.812
  601   2HB   ARG  78          HB1       ARG  78  -4.166  14.122  -6.507
  602   1HG   ARG  78          HG2       ARG  78  -3.960  11.617  -8.145
  603   2HG   ARG  78          HG1       ARG  78  -5.487  12.316  -7.616
  604   1HD   ARG  78          HD2       ARG  78  -3.522  13.321  -9.624
  605   2HD   ARG  78          HD1       ARG  78  -5.274  13.210  -9.728
  606    HE   ARG  78           HE       ARG  78  -3.809  15.464  -8.945
  607   1HH1  ARG  78          HH11      ARG  78  -6.659  13.698  -7.996
  608   2HH1  ARG  78          HH12      ARG  78  -7.430  15.074  -7.291
  609   1HH2  ARG  78          HH21      ARG  78  -4.820  17.275  -8.021
  610   2HH2  ARG  78          HH22      ARG  78  -6.388  17.105  -7.306
  611    H    LEU  79           HN       LEU  79  -3.214  10.863  -6.344
  612    HA   LEU  79           HA       LEU  79  -0.814   9.867  -5.086
  613   1HB   LEU  79          HB2       LEU  79  -3.416   8.494  -5.750
  614   2HB   LEU  79          HB1       LEU  79  -2.083   7.723  -4.913
  615    HG   LEU  79           HG       LEU  79  -3.681   8.389  -3.273
  616   1HD1  LEU  79          1HD1      LEU  79  -1.133   8.912  -3.010
  617   2HD1  LEU  79          2HD1      LEU  79  -2.296   9.448  -1.797
  618   3HD1  LEU  79          3HD1      LEU  79  -1.696  10.584  -3.005
  619   1HD2  LEU  79          1HD2      LEU  79  -4.774  10.401  -3.164
  620   2HD2  LEU  79          2HD2      LEU  79  -4.576  10.237  -4.908
  621   3HD2  LEU  79          3HD2      LEU  79  -3.481  11.271  -3.989
  622    H    TYR  80           HN       TYR  80   0.863   9.492  -6.406
  623    HA   TYR  80           HA       TYR  80   0.283   8.488  -9.057
  624   1HB   TYR  80          HB2       TYR  80   2.530   9.982  -7.860
  625   2HB   TYR  80          HB1       TYR  80   2.889   8.940  -9.233
  626    HD1  TYR  80           HD1      TYR  80  -0.395  10.500  -8.944
  627    HD2  TYR  80           HD2      TYR  80   3.501  10.863 -10.614
  628    HE1  TYR  80           HE1      TYR  80  -1.225  12.211 -10.495
  629    HE2  TYR  80           HE2      TYR  80   2.678  12.586 -12.166
  630    HH   TYR  80           HH       TYR  80   0.069  13.071 -13.157
  631    H    PHE  81           HN       PHE  81  -0.241   6.347  -8.487
  632    HA   PHE  81           HA       PHE  81   2.047   4.685  -8.698
  633   1HB   PHE  81          HB2       PHE  81   1.243   3.113  -6.846
  634   2HB   PHE  81          HB1       PHE  81   2.080   4.580  -6.353
  635    HD1  PHE  81           HD1      PHE  81  -1.407   4.684  -7.501
  636    HD2  PHE  81           HD2      PHE  81   1.183   4.489  -4.130
  637    HE1  PHE  81           HE1      PHE  81  -3.290   5.257  -6.028
  638    HE2  PHE  81           HE2      PHE  81  -0.695   5.066  -2.650
  639    HZ   PHE  81           HZ       PHE  81  -2.935   5.450  -3.599
  640    H    SER  82           HN       SER  82   1.363   2.299  -8.675
  641    HA   SER  82           HA       SER  82  -1.196   1.881  -9.976
  642   1HB   SER  82          HB2       SER  82   1.399   1.239 -11.366
  643   2HB   SER  82          HB1       SER  82  -0.236   1.032 -11.996
  644    HG   SER  82           HG       SER  82   1.314   3.306 -11.780
  645    H    MET  83           HN       MET  83   0.983  -0.436 -10.919
  646    HA   MET  83           HA       MET  83   0.936  -2.053  -8.529
  647   1HB   MET  83          HB2       MET  83  -0.350  -3.008 -11.101
  648   2HB   MET  83          HB1       MET  83  -0.146  -3.949  -9.630
  649   1HG   MET  83          HG2       MET  83  -1.651  -2.463  -8.450
  650   2HG   MET  83          HG1       MET  83  -1.837  -1.480  -9.898
  651   1HE   MET  83          HE1       MET  83  -1.883  -3.771 -12.145
  652   2HE   MET  83          HE2       MET  83  -2.968  -2.381 -12.150
  653   3HE   MET  83          HE3       MET  83  -3.621  -4.011 -12.324
  654    H    ASP  84           HN       ASP  84   1.720  -4.448  -9.718
  655    HA   ASP  84           HA       ASP  84   4.427  -3.938 -10.284
  656   1HB   ASP  84          HB2       ASP  84   3.584  -6.109  -9.414
  657   2HB   ASP  84          HB1       ASP  84   2.848  -6.424 -10.982
  658    H    ASP  85           HN       ASP  85   1.590  -4.195 -12.323
  659    HA   ASP  85           HA       ASP  85   3.241  -3.359 -14.595
  660   1HB   ASP  85          HB2       ASP  85   2.078  -4.929 -16.100
  661   2HB   ASP  85          HB1       ASP  85   3.001  -5.767 -14.855
  662    H    GLY  86           HN       GLY  86   1.507  -1.734 -12.995
  663   1HA   GLY  86          HA2       GLY  86  -0.577  -1.151 -15.011
  664   2HA   GLY  86          HA1       GLY  86  -0.890  -1.024 -13.288
  665    H    GLN  87           HN       GLN  87  -1.439   1.130 -14.775
  666    HA   GLN  87           HA       GLN  87   0.575   3.034 -13.865
  667   1HB   GLN  87          HB2       GLN  87   0.350   4.314 -16.005
  668   2HB   GLN  87          HB1       GLN  87   1.167   2.766 -16.174
  669   1HG   GLN  87          HG2       GLN  87  -0.886   1.771 -17.034
  670   2HG   GLN  87          HG1       GLN  87  -1.716   3.311 -16.854
  671    H    THR  88           HN       THR  88  -1.123   3.278 -12.203
  672    HA   THR  88           HA       THR  88  -3.367   4.872 -13.190
  673    HB   THR  88           HB       THR  88  -4.577   4.198 -11.139
  674    HG1  THR  88           HG1      THR  88  -2.964   3.688  -9.740
  675   1HG2  THR  88          1HG2      THR  88  -4.197   1.541 -11.830
  676   2HG2  THR  88          2HG2      THR  88  -3.871   2.443 -13.311
  677   3HG2  THR  88          3HG2      THR  88  -5.412   2.645 -12.475
  678    H    ARG  89           HN       ARG  89  -0.545   5.535 -12.045
  679    HA   ARG  89           HA       ARG  89  -0.519   6.915  -9.762
  680   1HB   ARG  89          HB2       ARG  89   1.160   8.379 -10.708
  681   2HB   ARG  89          HB1       ARG  89   1.367   6.753 -11.338
  682   1HG   ARG  89          HG2       ARG  89   1.275   7.540 -13.398
  683   2HG   ARG  89          HG1       ARG  89  -0.354   8.146 -13.102
  684   1HD   ARG  89          HD2       ARG  89   0.597  10.222 -12.185
  685   2HD   ARG  89          HD1       ARG  89   2.218   9.610 -12.504
  686    HE   ARG  89           HE       ARG  89   1.975  10.316 -14.649
  687   1HH1  ARG  89          HH11      ARG  89  -1.215   9.834 -13.312
  688   2HH1  ARG  89          HH12      ARG  89  -2.030  10.347 -14.750
  689   1HH2  ARG  89          HH21      ARG  89   0.902  10.997 -16.537
  690   2HH2  ARG  89          HH22      ARG  89  -0.830  11.010 -16.580
  691    H    PHE  90           HN       PHE  90  -2.974   7.447  -9.778
  692    HA   PHE  90           HA       PHE  90  -3.185  10.332 -10.186
  693   1HB   PHE  90          HB2       PHE  90  -5.516  10.043 -11.110
  694   2HB   PHE  90          HB1       PHE  90  -4.228   9.528 -12.188
  695    HD1  PHE  90           HD1      PHE  90  -4.598   7.612 -13.355
  696    HD2  PHE  90           HD2      PHE  90  -6.357   8.021  -9.503
  697    HE1  PHE  90           HE1      PHE  90  -5.684   5.421 -13.621
  698    HE2  PHE  90           HE2      PHE  90  -7.439   5.830  -9.759
  699    HZ   PHE  90           HZ       PHE  90  -7.105   4.525 -11.820
  700    H    THR  91           HN       THR  91  -6.019  10.366  -9.432
  701    HA   THR  91           HA       THR  91  -5.886  10.663  -6.732
  702    HB   THR  91           HB       THR  91  -8.299  10.537  -6.739
  703    HG1  THR  91           HG1      THR  91  -9.400   9.709  -8.555
  704   1HG2  THR  91          1HG2      THR  91  -6.934  11.956  -8.863
  705   2HG2  THR  91          2HG2      THR  91  -8.197  12.501  -7.760
  706   3HG2  THR  91          3HG2      THR  91  -8.626  11.616  -9.224
  707    H    ASP  92           HN       ASP  92  -7.002   9.348  -5.019
  708    HA   ASP  92           HA       ASP  92  -7.056   6.484  -5.488
  709   1HB   ASP  92          HB2       ASP  92  -4.692   6.973  -4.906
  710   2HB   ASP  92          HB1       ASP  92  -5.242   7.654  -3.379
  711    H    LEU  93           HN       LEU  93  -6.811   8.574  -2.612
  712    HA   LEU  93           HA       LEU  93  -8.433   7.298  -0.891
  713   1HB   LEU  93          HB2       LEU  93  -7.256   9.373  -0.370
  714   2HB   LEU  93          HB1       LEU  93  -8.393  10.279  -1.349
  715    HG   LEU  93           HG       LEU  93 -10.208   9.672   0.201
  716   1HD1  LEU  93          1HD1      LEU  93  -8.059   8.013   1.371
  717   2HD1  LEU  93          2HD1      LEU  93  -9.795   7.720   1.272
  718   3HD1  LEU  93          3HD1      LEU  93  -9.154   8.813   2.498
  719   1HD2  LEU  93          1HD2      LEU  93  -9.006  10.838   2.275
  720   2HD2  LEU  93          2HD2      LEU  93  -9.463  11.724   0.820
  721   3HD2  LEU  93          3HD2      LEU  93  -7.800  11.179   1.034
  722    H    LEU  94           HN       LEU  94  -9.826  10.034  -2.704
  723    HA   LEU  94           HA       LEU  94 -12.475   9.475  -2.220
  724   1HB   LEU  94          HB2       LEU  94 -11.553  11.538  -3.276
  725   2HB   LEU  94          HB1       LEU  94 -11.369  10.645  -4.772
  726    HG   LEU  94           HG       LEU  94 -13.375  12.092  -4.736
  727   1HD1  LEU  94          1HD1      LEU  94 -14.590  10.651  -5.985
  728   2HD1  LEU  94          2HD1      LEU  94 -14.517   9.368  -4.778
  729   3HD1  LEU  94          3HD1      LEU  94 -13.135   9.667  -5.832
  730   1HD2  LEU  94          1HD2      LEU  94 -14.933  12.043  -3.125
  731   2HD2  LEU  94          2HD2      LEU  94 -13.673  11.272  -2.162
  732   3HD2  LEU  94          3HD2      LEU  94 -14.880  10.286  -2.986
  733    H    GLN  95           HN       GLN  95 -10.470   8.284  -4.897
  734    HA   GLN  95           HA       GLN  95 -12.551   6.892  -6.214
  735   1HB   GLN  95          HB2       GLN  95 -10.486   7.509  -7.354
  736   2HB   GLN  95          HB1       GLN  95  -9.558   6.463  -6.295
  737   1HG   GLN  95          HG2       GLN  95 -11.739   5.417  -8.069
  738   2HG   GLN  95          HG1       GLN  95 -10.087   5.621  -8.635
  739    H    LEU  96           HN       LEU  96 -10.120   5.895  -3.858
  740    HA   LEU  96           HA       LEU  96 -10.611   3.167  -3.787
  741   1HB   LEU  96          HB2       LEU  96  -8.753   4.283  -2.615
  742   2HB   LEU  96          HB1       LEU  96  -9.895   4.979  -1.479
  743    HG   LEU  96           HG       LEU  96 -10.529   2.455  -1.065
  744   1HD1  LEU  96          1HD1      LEU  96  -7.742   2.313  -2.181
  745   2HD1  LEU  96          2HD1      LEU  96  -9.173   1.438  -2.723
  746   3HD1  LEU  96          3HD1      LEU  96  -8.451   1.064  -1.157
  747   1HD2  LEU  96          1HD2      LEU  96  -8.344   4.129   0.054
  748   2HD2  LEU  96          2HD2      LEU  96  -8.485   2.455   0.592
  749   3HD2  LEU  96          3HD2      LEU  96  -9.841   3.566   0.801
  750    H    VAL  97           HN       VAL  97 -12.058   5.732  -1.802
  751    HA   VAL  97           HA       VAL  97 -13.705   4.279  -0.186
  752    HB   VAL  97           HB       VAL  97 -14.467   6.883  -1.517
  753   1HG1  VAL  97          1HG1      VAL  97 -16.247   6.986  -0.176
  754   2HG1  VAL  97          2HG1      VAL  97 -15.321   6.458   1.229
  755   3HG1  VAL  97          3HG1      VAL  97 -15.994   5.266   0.118
  756   1HG2  VAL  97          1HG2      VAL  97 -12.975   7.957  -0.255
  757   2HG2  VAL  97          2HG2      VAL  97 -12.248   6.382   0.062
  758   3HG2  VAL  97          3HG2      VAL  97 -13.430   7.051   1.187
  759    H    GLU  98           HN       GLU  98 -14.911   5.804  -3.187
  760    HA   GLU  98           HA       GLU  98 -17.278   4.239  -3.242
  761   1HB   GLU  98          HB2       GLU  98 -17.132   6.443  -4.294
  762   2HB   GLU  98          HB1       GLU  98 -15.956   5.827  -5.446
  763   1HG   GLU  98          HG2       GLU  98 -17.634   4.305  -6.353
  764   2HG   GLU  98          HG1       GLU  98 -18.814   4.916  -5.195
  765    H    PHE  99           HN       PHE  99 -14.348   4.076  -5.282
  766    HA   PHE  99           HA       PHE  99 -15.248   1.796  -6.689
  767   1HB   PHE  99          HB2       PHE  99 -12.463   2.920  -6.382
  768   2HB   PHE  99          HB1       PHE  99 -12.883   1.598  -7.460
  769    HD1  PHE  99           HD1      PHE  99 -13.030   2.176  -9.646
  770    HD2  PHE  99           HD2      PHE  99 -14.267   5.001  -6.715
  771    HE1  PHE  99           HE1      PHE  99 -13.599   3.773 -11.428
  772    HE2  PHE  99           HE2      PHE  99 -14.843   6.599  -8.489
  773    HZ   PHE  99           HZ       PHE  99 -14.509   5.986 -10.851
  774    H    HIS 100           HN       HIS 100 -14.281   2.009  -3.489
  775    HA   HIS 100           HA       HIS 100 -12.625  -0.121  -2.983
  776   1HB   HIS 100          HB2       HIS 100 -13.551  -0.240  -0.797
  777   2HB   HIS 100          HB1       HIS 100 -13.730   1.440  -1.280
  778    HD1  HIS 100           HD1      HIS 100 -16.311   1.535  -2.744
  779    HD2  HIS 100           HD2      HIS 100 -15.767  -0.886   0.588
  780    HE1  HIS 100           HE1      HIS 100 -18.618   1.102  -1.844
  781    HE2  HIS 100           HE2      HIS 100 -18.256  -0.287   0.227
  782    H    GLN 101           HN       GLN 101 -15.967  -0.117  -3.925
  783    HA   GLN 101           HA       GLN 101 -16.541  -2.842  -3.458
  784   1HB   GLN 101          HB2       GLN 101 -18.444  -2.406  -5.061
  785   2HB   GLN 101          HB1       GLN 101 -18.366  -1.336  -3.669
  786   1HG   GLN 101          HG2       GLN 101 -17.111   0.272  -5.215
  787   2HG   GLN 101          HG1       GLN 101 -17.694  -0.743  -6.527
  788    H    LEU 102           HN       LEU 102 -15.557  -1.087  -6.402
  789    HA   LEU 102           HA       LEU 102 -14.416  -3.571  -7.419
  790   1HB   LEU 102          HB2       LEU 102 -16.461  -1.928  -8.903
  791   2HB   LEU 102          HB1       LEU 102 -15.395  -3.067  -9.699
  792    HG   LEU 102           HG       LEU 102 -17.480  -4.153  -9.411
  793   1HD1  LEU 102          1HD1      LEU 102 -16.586  -6.075  -8.758
  794   2HD1  LEU 102          2HD1      LEU 102 -16.333  -5.492  -7.113
  795   3HD1  LEU 102          3HD1      LEU 102 -15.133  -5.159  -8.362
  796   1HD2  LEU 102          1HD2      LEU 102 -17.724  -2.559  -7.126
  797   2HD2  LEU 102          2HD2      LEU 102 -17.743  -4.224  -6.552
  798   3HD2  LEU 102          3HD2      LEU 102 -18.901  -3.700  -7.773
  799    H    ASN 103           HN       ASN 103 -12.555  -2.138  -6.679
  800    HA   ASN 103           HA       ASN 103 -11.857  -0.166  -8.749
  801   1HB   ASN 103          HB2       ASN 103 -10.347   0.849  -7.210
  802   2HB   ASN 103          HB1       ASN 103 -11.847   0.577  -6.347
  803   1HD2  ASN 103          1HD2      ASN 103 -10.812  -2.435  -6.381
  804   2HD2  ASN 103          2HD2      ASN 103  -9.794  -2.450  -4.993
  805    H    ARG 104           HN       ARG 104  -9.037  -0.180  -8.201
  806    HA   ARG 104           HA       ARG 104  -8.332  -2.650  -9.607
  807   1HB   ARG 104          HB2       ARG 104  -6.894  -0.011  -9.311
  808   2HB   ARG 104          HB1       ARG 104  -6.162  -1.426 -10.053
  809   1HG   ARG 104          HG2       ARG 104  -7.011   0.079 -11.743
  810   2HG   ARG 104          HG1       ARG 104  -7.913  -1.437 -11.760
  811   1HD   ARG 104          HD2       ARG 104  -9.746  -0.412 -10.578
  812   2HD   ARG 104          HD1       ARG 104  -8.830   1.080 -10.376
  813    HE   ARG 104           HE       ARG 104  -9.013   0.514 -13.110
  814   1HH1  ARG 104          HH11      ARG 104 -11.082   1.429 -10.453
  815   2HH1  ARG 104          HH12      ARG 104 -12.214   2.266 -11.460
  816   1HH2  ARG 104          HH21      ARG 104 -10.501   1.615 -14.436
  817   2HH2  ARG 104          HH22      ARG 104 -11.885   2.372 -13.720
  818    H    GLY 105           HN       GLY 105  -8.693  -3.586  -7.324
  819   1HA   GLY 105          HA2       GLY 105  -7.040  -3.183  -5.162
  820   2HA   GLY 105          HA1       GLY 105  -7.711  -4.747  -5.593
  821    H    ILE 106           HN       ILE 106  -6.381  -6.313  -6.345
  822    HA   ILE 106           HA       ILE 106  -3.521  -5.664  -6.450
  823    HB   ILE 106           HB       ILE 106  -4.165  -7.425  -4.890
  824   1HG1  ILE 106          2HG1      ILE 106  -2.682  -8.534  -7.285
  825   2HG1  ILE 106          1HG1      ILE 106  -1.966  -7.572  -5.995
  826   1HG2  ILE 106          1HG2      ILE 106  -5.268  -8.802  -7.331
  827   2HG2  ILE 106          2HG2      ILE 106  -6.163  -8.250  -5.916
  828   3HG2  ILE 106          3HG2      ILE 106  -5.022  -9.588  -5.770
  829   1HD1  ILE 106          1HD1      ILE 106  -3.374 -10.139  -5.401
  830   2HD1  ILE 106          2HD1      ILE 106  -2.156  -9.291  -4.451
  831   3HD1  ILE 106          3HD1      ILE 106  -1.696 -10.119  -5.938
  832    H    LEU 107           HN       LEU 107  -2.156  -6.689  -8.057
  833    HA   LEU 107           HA       LEU 107  -2.531  -6.113 -10.598
  834   1HB   LEU 107          HB2       LEU 107  -1.201  -8.540  -9.461
  835   2HB   LEU 107          HB1       LEU 107  -1.143  -8.174 -11.180
  836    HG   LEU 107           HG       LEU 107  -0.256  -6.188  -9.110
  837   1HD1  LEU 107          1HD1      LEU 107   1.890  -7.028  -9.101
  838   2HD1  LEU 107          2HD1      LEU 107   1.655  -7.941 -10.591
  839   3HD1  LEU 107          3HD1      LEU 107   0.931  -8.507  -9.086
  840   1HD2  LEU 107          1HD2      LEU 107  -0.545  -5.123 -11.158
  841   2HD2  LEU 107          2HD2      LEU 107   0.011  -6.522 -12.073
  842   3HD2  LEU 107          3HD2      LEU 107   1.164  -5.551 -11.165
  843    HA   PRO 108           HA       PRO 108  -5.258  -9.382 -12.342
  844   1HB   PRO 108          HB2       PRO 108  -4.332 -11.753 -12.907
  845   2HB   PRO 108          HB1       PRO 108  -3.390 -10.343 -13.420
  846   1HG   PRO 108          HG2       PRO 108  -2.926 -12.195 -11.119
  847   2HG   PRO 108          HG1       PRO 108  -1.745 -11.434 -12.201
  848   1HD   PRO 108          HD2       PRO 108  -2.588 -10.498  -9.643
  849   2HD   PRO 108          HD1       PRO 108  -1.542  -9.674 -10.811
  850    H    CYS 109           HN       CYS 109  -5.888  -9.366  -9.534
  851    HA   CYS 109           HA       CYS 109  -7.324 -11.903  -9.405
  852   1HB   CYS 109          HB2       CYS 109  -5.786 -10.979  -6.980
  853   2HB   CYS 109          HB1       CYS 109  -6.600 -12.515  -7.236
  854    HG   CYS 109           HG       CYS 109  -4.651 -13.773  -8.367
  855    H    LEU 110           HN       LEU 110  -8.344 -11.661  -6.817
  856    HA   LEU 110           HA       LEU 110 -10.616 -10.197  -7.125
  857   1HB   LEU 110          HB2       LEU 110  -9.123 -10.946  -4.632
  858   2HB   LEU 110          HB1       LEU 110 -10.630 -10.057  -4.549
  859    HG   LEU 110           HG       LEU 110 -11.004 -12.435  -4.198
  860   1HD1  LEU 110          1HD1      LEU 110 -12.481 -10.820  -5.752
  861   2HD1  LEU 110          2HD1      LEU 110 -12.931 -12.481  -5.368
  862   3HD1  LEU 110          3HD1      LEU 110 -12.140 -12.113  -6.901
  863   1HD2  LEU 110          1HD2      LEU 110 -10.591 -14.071  -5.931
  864   2HD2  LEU 110          2HD2      LEU 110  -9.084 -13.262  -5.500
  865   3HD2  LEU 110          3HD2      LEU 110  -9.926 -12.825  -6.988
  866    H    LEU 111           HN       LEU 111 -10.347  -8.196  -8.020
  867    HA   LEU 111           HA       LEU 111  -8.607  -6.212  -7.023
  868   1HB   LEU 111          HB2       LEU 111  -9.664  -4.708  -8.536
  869   2HB   LEU 111          HB1       LEU 111  -9.510  -6.258  -9.326
  870    HG   LEU 111           HG       LEU 111 -11.621  -5.306  -9.921
  871   1HD1  LEU 111          1HD1      LEU 111 -11.546  -7.739  -9.502
  872   2HD1  LEU 111          2HD1      LEU 111 -13.145  -7.030  -9.273
  873   3HD1  LEU 111          3HD1      LEU 111 -12.155  -7.443  -7.874
  874   1HD2  LEU 111          1HD2      LEU 111 -11.601  -4.106  -7.467
  875   2HD2  LEU 111          2HD2      LEU 111 -12.864  -5.322  -7.282
  876   3HD2  LEU 111          3HD2      LEU 111 -12.964  -4.136  -8.583
  877    H    ARG 112           HN       ARG 112 -11.710  -7.266  -5.972
  878    HA   ARG 112           HA       ARG 112 -12.514  -4.830  -4.708
  879   1HB   ARG 112          HB2       ARG 112 -13.432  -7.636  -4.070
  880   2HB   ARG 112          HB1       ARG 112 -14.280  -6.137  -3.716
  881   1HG   ARG 112          HG2       ARG 112 -14.529  -5.732  -6.129
  882   2HG   ARG 112          HG1       ARG 112 -13.734  -7.273  -6.450
  883   1HD   ARG 112          HD2       ARG 112 -16.158  -7.496  -6.583
  884   2HD   ARG 112          HD1       ARG 112 -15.506  -8.445  -5.248
  885    HE   ARG 112           HE       ARG 112 -16.255  -5.937  -4.263
  886   1HH1  ARG 112          HH11      ARG 112 -17.729  -8.807  -5.590
  887   2HH1  ARG 112          HH12      ARG 112 -19.212  -8.599  -4.720
  888   1HH2  ARG 112          HH21      ARG 112 -18.205  -5.660  -3.119
  889   2HH2  ARG 112          HH22      ARG 112 -19.483  -6.812  -3.318
  890    H    HIS 113           HN       HIS 113 -12.265  -4.167  -2.591
  891    HA   HIS 113           HA       HIS 113 -10.986  -5.946  -0.686
  892   1HB   HIS 113          HB2       HIS 113  -9.156  -4.386  -0.184
  893   2HB   HIS 113          HB1       HIS 113  -9.074  -4.967  -1.845
  894    HD1  HIS 113           HD1      HIS 113 -10.871  -1.993  -0.263
  895    HD2  HIS 113           HD2      HIS 113  -8.264  -2.907  -3.364
  896    HE1  HIS 113           HE1      HIS 113 -10.446   0.181  -1.441
  897    HE2  HIS 113           HE2      HIS 113  -8.939  -0.413  -3.370
  898    H    CYS 114           HN       CYS 114 -10.614  -4.760   1.465
  899    HA   CYS 114           HA       CYS 114 -12.602  -2.668   1.930
  900   1HB   CYS 114          HB2       CYS 114 -13.791  -4.736   2.402
  901   2HB   CYS 114          HB1       CYS 114 -12.494  -5.272   3.468
  902    HG   CYS 114           HG       CYS 114 -14.316  -4.595   5.292
  903    H    CYS 115           HN       CYS 115 -10.936  -4.642   4.350
  904    HA   CYS 115           HA       CYS 115  -9.068  -2.452   4.903
  905   1HB   CYS 115          HB2       CYS 115 -10.832  -3.735   7.003
  906   2HB   CYS 115          HB1       CYS 115  -9.573  -2.545   7.309
  907    HG   CYS 115           HG       CYS 115 -10.856  -0.404   6.367
  908    H    THR 116           HN       THR 116  -7.961  -3.526   7.255
  909    HA   THR 116           HA       THR 116  -6.997  -6.164   6.360
  910    HB   THR 116           HB       THR 116  -5.367  -3.885   7.489
  911    HG1  THR 116           HG1      THR 116  -4.267  -4.149   5.484
  912   1HG2  THR 116          1HG2      THR 116  -4.545  -6.721   6.934
  913   2HG2  THR 116          2HG2      THR 116  -4.430  -5.838   8.456
  914   3HG2  THR 116          3HG2      THR 116  -3.410  -5.381   7.092
  915    H    ARG 117           HN       ARG 117  -5.992  -7.472   8.115
  916    HA   ARG 117           HA       ARG 117  -7.331  -6.925  10.688
  917   1HB   ARG 117          HB2       ARG 117  -8.277  -8.873   9.534
  918   2HB   ARG 117          HB1       ARG 117  -6.681  -9.604   9.447
  919   1HG   ARG 117          HG2       ARG 117  -6.592  -9.745  11.873
  920   2HG   ARG 117          HG1       ARG 117  -8.170  -8.964  11.986
  921   1HD   ARG 117          HD2       ARG 117  -8.382 -11.374  12.239
  922   2HD   ARG 117          HD1       ARG 117  -9.177 -10.830  10.762
  923    HE   ARG 117           HE       ARG 117  -6.561 -11.590  10.128
  924   1HH1  ARG 117          HH11      ARG 117  -9.549 -13.032  11.208
  925   2HH1  ARG 117          HH12      ARG 117  -9.220 -14.566  10.474
  926   1HH2  ARG 117          HH21      ARG 117  -6.127 -13.606   9.161
  927   2HH2  ARG 117          HH22      ARG 117  -7.278 -14.892   9.312
  928    H    VAL 118           HN       VAL 118  -5.591  -5.839  11.604
  929    HA   VAL 118           HA       VAL 118  -3.406  -7.588  12.441
  930    HB   VAL 118           HB       VAL 118  -1.825  -5.582  12.157
  931   1HG1  VAL 118          1HG1      VAL 118  -1.817  -6.195   9.528
  932   2HG1  VAL 118          2HG1      VAL 118  -2.794  -7.520  10.158
  933   3HG1  VAL 118          3HG1      VAL 118  -1.167  -7.251  10.782
  934   1HG2  VAL 118          1HG2      VAL 118  -2.805  -4.496   9.826
  935   2HG2  VAL 118          2HG2      VAL 118  -2.796  -3.714  11.405
  936   3HG2  VAL 118          3HG2      VAL 118  -4.233  -4.576  10.859
  937    H    ALA 119           HN       ALA 119  -4.192  -4.117  12.801
  938    HA   ALA 119           HA       ALA 119  -3.592  -4.229  15.607
  939   1HB   ALA 119          HB1       ALA 119  -4.503  -2.028  13.789
  940   2HB   ALA 119          HB2       ALA 119  -2.924  -2.243  14.543
  941   3HB   ALA 119          HB3       ALA 119  -4.319  -1.804  15.528
  942    H    LEU 120           HN       LEU 120  -6.367  -2.575  14.283
  943    HA   LEU 120           HA       LEU 120  -8.024  -3.694  16.408
  944   1HB   LEU 120          HB2       LEU 120  -8.596  -1.478  14.438
  945   2HB   LEU 120          HB1       LEU 120  -9.650  -1.964  15.752
  946    HG   LEU 120           HG       LEU 120  -6.898  -0.759  16.044
  947   1HD1  LEU 120          1HD1      LEU 120  -9.144   0.565  15.396
  948   2HD1  LEU 120          2HD1      LEU 120  -7.865   1.247  16.401
  949   3HD1  LEU 120          3HD1      LEU 120  -9.298   0.544  17.152
  950   1HD2  LEU 120          1HD2      LEU 120  -7.463  -0.687  18.453
  951   2HD2  LEU 120          2HD2      LEU 120  -7.289  -2.327  17.828
  952   3HD2  LEU 120          3HD2      LEU 120  -8.896  -1.658  18.114
  953    HA   PRO1135           HA       PRO1135  17.656  -4.563 -11.622
  954   1HB   PRO1135          HB2       PRO1135  16.566  -2.335  -9.966
  955   2HB   PRO1135          HB1       PRO1135  17.404  -2.275 -11.521
  956   1HG   PRO1135          HG2       PRO1135  14.768  -1.932 -11.388
  957   2HG   PRO1135          HG1       PRO1135  15.501  -2.847 -12.719
  958   1HD   PRO1135          HD2       PRO1135  14.012  -3.837 -10.330
  959   2HD   PRO1135          HD1       PRO1135  14.047  -4.476 -11.986
  960    H    GLN1136           HN       GLN1136  16.326  -3.605  -8.452
  961    HA   GLN1136           HA       GLN1136  18.280  -5.176  -7.047
  962   1HB   GLN1136          HB2       GLN1136  18.453  -2.163  -6.902
  963   2HB   GLN1136          HB1       GLN1136  19.312  -3.275  -5.851
  964   1HG   GLN1136          HG2       GLN1136  20.486  -4.189  -7.799
  965   2HG   GLN1136          HG1       GLN1136  19.645  -3.034  -8.832
  966    HA   PRO1137           HA       PRO1137  15.338  -3.041  -3.878
  967   1HB   PRO1137          HB2       PRO1137  13.376  -1.564  -5.464
  968   2HB   PRO1137          HB1       PRO1137  14.358  -1.012  -4.108
  969   1HG   PRO1137          HG2       PRO1137  14.783  -0.162  -6.633
  970   2HG   PRO1137          HG1       PRO1137  16.100  -0.361  -5.462
  971   1HD   PRO1137          HD2       PRO1137  15.248  -2.182  -7.686
  972   2HD   PRO1137          HD1       PRO1137  16.883  -1.709  -7.185
  973    H    GLU1138           HN       GLU1138  12.406  -2.709  -4.310
  974    HA   GLU1138           HA       GLU1138  11.648  -5.254  -5.530
  975   1HB   GLU1138          HB2       GLU1138  10.590  -4.745  -2.790
  976   2HB   GLU1138          HB1       GLU1138  10.861  -6.269  -3.618
  977   1HG   GLU1138          HG2       GLU1138  13.281  -5.991  -3.295
  978   2HG   GLU1138          HG1       GLU1138  12.966  -4.495  -2.412
  979   2HN   PTR1139          HN        PTR1139  10.179  -2.983  -3.266
  980   2HN   PTR1139          HN        PTR1139  10.179  -2.983  -3.266
  981    HA   PTR1139           HA       PTR1139   7.902  -2.432  -3.274
  982    HA   PTR1139           HA       PTR1139   7.902  -2.432  -3.274
  983   1HB   PTR1139          HB1       PTR1139   7.970  -0.227  -4.716
  984   1HB   PTR1139          HB1       PTR1139   7.970  -0.227  -4.716
  985   2HB   PTR1139          HB2       PTR1139   9.676  -0.623  -4.765
  986   2HB   PTR1139          HB2       PTR1139   9.676  -0.623  -4.765
  987    HD1  PTR1139           HD1      PTR1139   6.852   0.209  -2.625
  988    HD1  PTR1139           HD1      PTR1139   6.852   0.209  -2.625
  989    HD2  PTR1139           HD2      PTR1139  11.040  -0.463  -2.748
  990    HD2  PTR1139           HD2      PTR1139  11.040  -0.463  -2.748
  991    HE1  PTR1139           HE1      PTR1139   7.063   1.130  -0.356
  992    HE1  PTR1139           HE1      PTR1139   7.063   1.130  -0.356
  993    HE2  PTR1139           HE2      PTR1139  11.262   0.505  -0.444
  994    HE2  PTR1139           HE2      PTR1139  11.262   0.505  -0.444
  995    H    VAL1140           HN       VAL1140   7.030  -0.791  -5.674
  996    HA   VAL1140           HA       VAL1140   6.285  -2.613  -7.738
  997    HB   VAL1140           HB       VAL1140   4.054  -1.774  -5.847
  998   1HG1  VAL1140          1HG1      VAL1140   3.132  -1.822  -8.001
  999   2HG1  VAL1140          2HG1      VAL1140   2.721  -3.396  -7.314
 1000   3HG1  VAL1140          3HG1      VAL1140   4.056  -3.253  -8.458
 1001   1HG2  VAL1140          1HG2      VAL1140   5.229  -3.568  -4.784
 1002   2HG2  VAL1140          2HG2      VAL1140   5.286  -4.490  -6.285
 1003   3HG2  VAL1140          3HG2      VAL1140   3.745  -4.230  -5.468
 1004    H    ASN1141           HN       ASN1141   4.934  -1.653  -9.275
 1005    HA   ASN1141           HA       ASN1141   4.109   0.130 -10.535
 1006   1HB   ASN1141          HB2       ASN1141   5.578   2.055  -8.705
 1007   2HB   ASN1141          HB1       ASN1141   4.329   2.425  -9.874
 1008   1HD2  ASN1141          1HD2      ASN1141   4.885   2.511  -6.771
 1009   2HD2  ASN1141          2HD2      ASN1141   3.325   2.217  -6.126
 1010    H    GLN1142           HN       GLN1142   6.945  -0.373  -8.797
 1011    HA   GLN1142           HA       GLN1142   8.638  -1.116 -10.772
 1012   1HB   GLN1142          HB2       GLN1142   8.694   1.752 -10.024
 1013   2HB   GLN1142          HB1       GLN1142  10.242   0.954 -10.104
 1014   1HG   GLN1142          HG2       GLN1142  10.087   0.609 -12.396
 1015   2HG   GLN1142          HG1       GLN1142   8.338   0.791 -12.406
 1016    HA   PRO1143           HA       PRO1143  10.662  -2.470  -7.099
 1017   1HB   PRO1143          HB2       PRO1143  13.295  -1.572  -7.281
 1018   2HB   PRO1143          HB1       PRO1143  12.695  -3.057  -8.022
 1019   1HG   PRO1143          HG2       PRO1143  13.163  -0.376  -9.242
 1020   2HG   PRO1143          HG1       PRO1143  13.411  -1.986  -9.938
 1021   1HD   PRO1143          HD2       PRO1143  11.288  -0.443 -10.581
 1022   2HD   PRO1143          HD1       PRO1143  11.189  -2.214 -10.522
 1023    H    ASP1144           HN       ASP1144  10.351   0.689  -7.990
 1024    HA   ASP1144           HA       ASP1144   9.363   1.977  -6.160
 1025   1HB   ASP1144          HB2       ASP1144  10.872   2.788  -4.394
 1026   2HB   ASP1144          HB1       ASP1144  10.761   1.033  -4.358
  Start of MODEL    2
    1   1H    GLY   1          HT1       GLY   1  24.377   4.513  -4.879
    2   2H    GLY   1          HT2       GLY   1  25.932   5.160  -5.033
    3   3H    GLY   1          HT3       GLY   1  24.608   6.189  -4.816
    4   1HA   GLY   1          HA1       GLY   1  24.955   4.187  -2.753
    5   2HA   GLY   1          HA2       GLY   1  26.227   5.395  -2.841
    6    H    SER   2           HN       SER   2  22.853   4.815  -2.202
    7    HA   SER   2           HA       SER   2  22.755   7.244  -0.629
    8   1HB   SER   2          HB2       SER   2  22.001   8.142  -2.714
    9   2HB   SER   2          HB1       SER   2  20.896   6.796  -2.970
   10    HG   SER   2           HG       SER   2  20.222   9.009  -1.949
   11    HA   PRO   3           HA       PRO   3  18.764   4.655   0.405
   12   1HB   PRO   3          HB2       PRO   3  18.671   2.187  -0.835
   13   2HB   PRO   3          HB1       PRO   3  17.772   3.612  -1.362
   14   1HG   PRO   3          HG2       PRO   3  20.361   2.519  -2.385
   15   2HG   PRO   3          HG1       PRO   3  18.991   3.191  -3.290
   16   1HD   PRO   3          HD2       PRO   3  21.199   4.633  -2.865
   17   2HD   PRO   3          HD1       PRO   3  19.591   5.383  -2.812
   18    H    ALA   4           HN       ALA   4  20.215   4.607   2.227
   19    HA   ALA   4           HA       ALA   4  21.567   2.020   2.624
   20   1HB   ALA   4          HB1       ALA   4  22.680   4.462   2.839
   21   2HB   ALA   4          HB2       ALA   4  23.223   3.055   3.753
   22   3HB   ALA   4          HB3       ALA   4  22.133   4.224   4.499
   23    H    SER   5           HN       SER   5  20.718   0.642   4.034
   24    HA   SER   5           HA       SER   5  18.680   1.635   5.906
   25   1HB   SER   5          HB2       SER   5  17.867  -0.051   4.327
   26   2HB   SER   5          HB1       SER   5  19.133  -1.165   4.843
   27    HG   SER   5           HG       SER   5  18.182  -1.243   6.880
   28    H    GLY   6           HN       GLY   6  18.915   1.396   8.060
   29   1HA   GLY   6          HA2       GLY   6  20.437  -0.548   9.369
   30   2HA   GLY   6          HA1       GLY   6  21.466   0.857   9.142
   31    H    THR   7           HN       THR   7  17.989   0.864   9.746
   32    HA   THR   7           HA       THR   7  18.383   1.673  12.507
   33    HB   THR   7           HB       THR   7  18.593   3.791  11.324
   34    HG1  THR   7           HG1      THR   7  17.491   3.917  13.262
   35   1HG2  THR   7          1HG2      THR   7  15.968   3.053  10.074
   36   2HG2  THR   7          2HG2      THR   7  17.481   3.479   9.273
   37   3HG2  THR   7          3HG2      THR   7  16.570   4.709  10.149
   38    H    SER   8           HN       SER   8  16.269   1.971  13.639
   39    HA   SER   8           HA       SER   8  13.971   0.738  12.360
   40   1HB   SER   8          HB2       SER   8  15.192  -1.202  13.222
   41   2HB   SER   8          HB1       SER   8  15.257  -0.468  14.823
   42    HG   SER   8           HG       SER   8  13.540  -1.860  14.824
   43    H    LEU   9           HN       LEU   9  12.542   2.320  12.732
   44    HA   LEU   9           HA       LEU   9  12.120   3.142  15.523
   45   1HB   LEU   9          HB2       LEU   9  12.060   4.963  13.115
   46   2HB   LEU   9          HB1       LEU   9  11.623   5.428  14.748
   47    HG   LEU   9           HG       LEU   9  14.369   4.575  13.828
   48   1HD1  LEU   9          1HD1      LEU   9  14.324   6.706  13.075
   49   2HD1  LEU   9          2HD1      LEU   9  14.677   7.060  14.766
   50   3HD1  LEU   9          3HD1      LEU   9  13.024   7.183  14.166
   51   1HD2  LEU   9          1HD2      LEU   9  13.166   4.952  16.498
   52   2HD2  LEU   9          2HD2      LEU   9  14.755   5.674  16.245
   53   3HD2  LEU   9          3HD2      LEU   9  14.522   3.944  15.993
   54    H    SER  10           HN       SER  10   9.934   4.484  15.568
   55    HA   SER  10           HA       SER  10   7.937   3.403  13.756
   56   1HB   SER  10          HB2       SER  10   8.071   1.671  15.481
   57   2HB   SER  10          HB1       SER  10   7.826   2.884  16.738
   58    HG   SER  10           HG       SER  10   5.968   1.538  15.596
   59    H    ALA  11           HN       ALA  11   5.674   4.238  14.510
   60    HA   ALA  11           HA       ALA  11   5.801   6.810  15.861
   61   1HB   ALA  11          HB1       ALA  11   5.470   6.508  12.941
   62   2HB   ALA  11          HB2       ALA  11   6.143   7.842  13.877
   63   3HB   ALA  11          HB3       ALA  11   4.394   7.653  13.743
   64    H    ALA  12           HN       ALA  12   3.468   7.849  15.679
   65    HA   ALA  12           HA       ALA  12   1.379   5.815  15.716
   66   1HB   ALA  12          HB1       ALA  12   1.959   7.554  18.110
   67   2HB   ALA  12          HB2       ALA  12   2.233   5.815  18.001
   68   3HB   ALA  12          HB3       ALA  12   0.591   6.456  17.936
   69    H    ILE  13           HN       ILE  13   0.950   7.158  13.770
   70    HA   ILE  13           HA       ILE  13   0.013   9.849  14.141
   71    HB   ILE  13           HB       ILE  13   1.036   9.183  12.025
   72   1HG1  ILE  13          2HG1      ILE  13  -1.896   9.875  11.725
   73   2HG1  ILE  13          1HG1      ILE  13  -0.598  11.024  12.028
   74   1HG2  ILE  13          1HG2      ILE  13  -1.000   7.072  12.166
   75   2HG2  ILE  13          2HG2      ILE  13   0.591   7.071  11.405
   76   3HG2  ILE  13          3HG2      ILE  13  -0.783   7.797  10.572
   77   1HD1  ILE  13          1HD1      ILE  13  -1.135   9.428   9.551
   78   2HD1  ILE  13          2HD1      ILE  13   0.417  10.210   9.849
   79   3HD1  ILE  13          3HD1      ILE  13  -1.053  11.179   9.740
   80    H    HIS  14           HN       HIS  14  -1.359   6.737  14.468
   81    HA   HIS  14           HA       HIS  14  -4.031   7.246  13.757
   82   1HB   HIS  14          HB2       HIS  14  -2.879   5.307  15.769
   83   2HB   HIS  14          HB1       HIS  14  -4.558   5.308  15.244
   84    HD1  HIS  14           HD1      HIS  14  -1.147   5.126  13.532
   85    HD2  HIS  14           HD2      HIS  14  -4.979   3.548  13.268
   86    HE1  HIS  14           HE1      HIS  14  -1.061   3.472  11.643
   87    HE2  HIS  14           HE2      HIS  14  -3.345   2.412  11.617
   88    H    ARG  15           HN       ARG  15  -5.366   8.696  14.617
   89    HA   ARG  15           HA       ARG  15  -5.246   9.130  17.506
   90   1HB   ARG  15          HB2       ARG  15  -5.808  11.508  17.157
   91   2HB   ARG  15          HB1       ARG  15  -4.250  11.065  16.466
   92   1HG   ARG  15          HG2       ARG  15  -5.225  10.963  14.247
   93   2HG   ARG  15          HG1       ARG  15  -6.826  11.284  14.906
   94   1HD   ARG  15          HD2       ARG  15  -4.463  13.168  14.801
   95   2HD   ARG  15          HD1       ARG  15  -6.002  13.312  13.958
   96    HE   ARG  15           HE       ARG  15  -6.540  13.246  16.693
   97   1HH1  ARG  15          HH11      ARG  15  -4.958  15.317  14.372
   98   2HH1  ARG  15          HH12      ARG  15  -5.297  16.770  15.250
   99   1HH2  ARG  15          HH21      ARG  15  -6.988  15.156  17.849
  100   2HH2  ARG  15          HH22      ARG  15  -6.449  16.680  17.224
  101    H    THR  16           HN       THR  16  -7.054   8.137  15.019
  102    HA   THR  16           HA       THR  16  -9.495   8.324  16.598
  103    HB   THR  16           HB       THR  16 -10.834   8.883  14.574
  104    HG1  THR  16           HG1      THR  16  -8.346   9.543  13.403
  105   1HG2  THR  16          1HG2      THR  16 -10.194  11.254  14.387
  106   2HG2  THR  16          2HG2      THR  16  -8.741  10.906  15.324
  107   3HG2  THR  16          3HG2      THR  16 -10.332  10.699  16.056
  108    H    GLN  17           HN       GLN  17  -9.210   7.294  13.231
  109    HA   GLN  17           HA       GLN  17  -9.110   4.498  13.996
  110   1HB   GLN  17          HB2       GLN  17 -11.160   3.954  12.679
  111   2HB   GLN  17          HB1       GLN  17 -11.470   4.859  14.152
  112   1HG   GLN  17          HG2       GLN  17 -12.855   5.718  12.407
  113   2HG   GLN  17          HG1       GLN  17 -11.633   6.923  12.804
  114    H    LEU  18           HN       LEU  18  -7.587   6.546  12.336
  115    HA   LEU  18           HA       LEU  18  -7.832   5.710   9.619
  116   1HB   LEU  18          HB2       LEU  18  -5.666   7.213  11.077
  117   2HB   LEU  18          HB1       LEU  18  -5.605   6.873   9.360
  118    HG   LEU  18           HG       LEU  18  -6.376   9.140   9.747
  119   1HD1  LEU  18          1HD1      LEU  18  -8.601   7.344   8.792
  120   2HD1  LEU  18          2HD1      LEU  18  -7.259   7.943   7.815
  121   3HD1  LEU  18          3HD1      LEU  18  -8.449   9.071   8.465
  122   1HD2  LEU  18          1HD2      LEU  18  -8.227   9.715  11.039
  123   2HD2  LEU  18          2HD2      LEU  18  -7.394   8.504  12.014
  124   3HD2  LEU  18          3HD2      LEU  18  -8.827   8.057  11.086
  125    H    TRP  19           HN       TRP  19  -5.705   4.947   8.482
  126    HA   TRP  19           HA       TRP  19  -4.379   2.867  10.046
  127   1HB   TRP  19          HB2       TRP  19  -4.739   1.465   7.785
  128   2HB   TRP  19          HB1       TRP  19  -5.828   1.371   9.160
  129    HD1  TRP  19           HD1      TRP  19  -8.246   1.407   8.423
  130    HE1  TRP  19           HE1      TRP  19  -9.612   2.507   6.543
  131    HE3  TRP  19           HE3      TRP  19  -4.488   3.950   6.048
  132    HZ2  TRP  19           HZ2      TRP  19  -9.164   4.214   4.350
  133    HZ3  TRP  19           HZ3      TRP  19  -5.048   5.287   4.064
  134    HH2  TRP  19           HH2      TRP  19  -7.338   5.416   3.233
  135    H    PHE  20           HN       PHE  20  -2.962   4.965   9.600
  136    HA   PHE  20           HA       PHE  20  -1.352   4.405   7.201
  137   1HB   PHE  20          HB2       PHE  20  -1.644   7.034   8.664
  138   2HB   PHE  20          HB1       PHE  20  -0.630   6.756   7.254
  139    HD1  PHE  20           HD1      PHE  20  -1.455   7.573   5.293
  140    HD2  PHE  20           HD2      PHE  20  -4.187   6.149   8.227
  141    HE1  PHE  20           HE1      PHE  20  -3.337   8.178   3.828
  142    HE2  PHE  20           HE2      PHE  20  -6.074   6.745   6.766
  143    HZ   PHE  20           HZ       PHE  20  -5.651   7.761   4.563
  144    H    HIS  21           HN       HIS  21   0.784   4.035   7.408
  145    HA   HIS  21           HA       HIS  21   2.094   4.553   9.986
  146   1HB   HIS  21          HB2       HIS  21   1.157   2.136   9.747
  147   2HB   HIS  21          HB1       HIS  21   2.481   1.898   8.616
  148    HD1  HIS  21           HD1      HIS  21   3.118   0.061  10.535
  149    HD2  HIS  21           HD2      HIS  21   3.639   4.066  11.513
  150    HE1  HIS  21           HE1      HIS  21   4.634   0.071  12.541
  151    HE2  HIS  21           HE2      HIS  21   4.870   2.501  13.163
  152    H    GLY  22           HN       GLY  22   4.592   4.138   9.730
  153   1HA   GLY  22          HA2       GLY  22   5.360   5.278   7.156
  154   2HA   GLY  22          HA1       GLY  22   6.306   5.323   8.635
  155    H    ARG  23           HN       ARG  23   8.116   4.263   8.325
  156    HA   ARG  23           HA       ARG  23   8.496   2.283   6.364
  157   1HB   ARG  23          HB2       ARG  23  10.199   3.853   7.416
  158   2HB   ARG  23          HB1       ARG  23  10.293   2.699   8.730
  159   1HG   ARG  23          HG2       ARG  23  10.871   2.077   5.840
  160   2HG   ARG  23          HG1       ARG  23  12.087   2.425   7.067
  161   1HD   ARG  23          HD2       ARG  23  11.213   0.474   8.367
  162   2HD   ARG  23          HD1       ARG  23  10.179   0.093   6.990
  163    HE   ARG  23           HE       ARG  23  11.977  -0.880   6.009
  164   1HH1  ARG  23          HH11      ARG  23  13.155   1.448   8.330
  165   2HH1  ARG  23          HH12      ARG  23  14.822   1.092   8.027
  166   1HH2  ARG  23          HH21      ARG  23  14.169  -1.352   5.615
  167   2HH2  ARG  23          HH22      ARG  23  15.398  -0.499   6.488
  168    H    ILE  24           HN       ILE  24   7.334   0.468   6.530
  169    HA   ILE  24           HA       ILE  24   7.916  -1.231   8.867
  170    HB   ILE  24           HB       ILE  24   5.491  -0.561   8.783
  171   1HG1  ILE  24          2HG1      ILE  24   6.100  -3.496   8.370
  172   2HG1  ILE  24          1HG1      ILE  24   6.226  -2.624   9.894
  173   1HG2  ILE  24          1HG2      ILE  24   4.047  -1.458   7.094
  174   2HG2  ILE  24          2HG2      ILE  24   5.391  -2.295   6.322
  175   3HG2  ILE  24          3HG2      ILE  24   5.323  -0.533   6.302
  176   1HD1  ILE  24          1HD1      ILE  24   4.183  -4.004   9.680
  177   2HD1  ILE  24          2HD1      ILE  24   3.670  -2.968   8.348
  178   3HD1  ILE  24          3HD1      ILE  24   3.858  -2.294   9.967
  179    H    SER  25           HN       SER  25   9.230  -2.833   8.257
  180    HA   SER  25           HA       SER  25  10.290  -3.407   5.888
  181   1HB   SER  25          HB2       SER  25  10.946  -4.605   7.894
  182   2HB   SER  25          HB1       SER  25   9.416  -5.480   7.910
  183    HG   SER  25           HG       SER  25  11.215  -5.601   5.729
  184    H    ARG  26           HN       ARG  26   8.999  -3.148   4.086
  185    HA   ARG  26           HA       ARG  26   6.493  -4.253   3.669
  186   1HB   ARG  26          HB2       ARG  26   6.813  -3.862   1.295
  187   2HB   ARG  26          HB1       ARG  26   7.445  -2.509   2.204
  188   1HG   ARG  26          HG2       ARG  26   9.190  -4.715   1.150
  189   2HG   ARG  26          HG1       ARG  26   8.791  -3.270   0.222
  190   1HD   ARG  26          HD2       ARG  26   9.586  -2.160   2.547
  191   2HD   ARG  26          HD1       ARG  26  10.588  -3.608   2.529
  192    HE   ARG  26           HE       ARG  26  10.790  -2.444   0.010
  193   1HH1  ARG  26          HH11      ARG  26  11.600  -1.665   3.319
  194   2HH1  ARG  26          HH12      ARG  26  12.908  -0.618   2.883
  195   1HH2  ARG  26          HH21      ARG  26  12.499  -1.054  -0.559
  196   2HH2  ARG  26          HH22      ARG  26  13.418  -0.271   0.683
  197    H    GLU  27           HN       GLU  27   9.664  -5.624   2.828
  198    HA   GLU  27           HA       GLU  27   8.701  -7.973   1.631
  199   1HB   GLU  27          HB2       GLU  27  11.301  -7.402   3.054
  200   2HB   GLU  27          HB1       GLU  27  10.976  -8.898   2.189
  201   1HG   GLU  27          HG2       GLU  27  10.948  -6.147   0.971
  202   2HG   GLU  27          HG1       GLU  27  12.276  -7.302   0.861
  203    H    GLU  28           HN       GLU  28   9.427  -7.202   4.999
  204    HA   GLU  28           HA       GLU  28   8.911  -9.891   5.891
  205   1HB   GLU  28          HB2       GLU  28  10.522  -8.468   7.072
  206   2HB   GLU  28          HB1       GLU  28   9.237  -7.336   7.467
  207   1HG   GLU  28          HG2       GLU  28   8.125  -9.052   8.797
  208   2HG   GLU  28          HG1       GLU  28   9.409 -10.193   8.396
  209    H    SER  29           HN       SER  29   7.078  -6.974   5.453
  210    HA   SER  29           HA       SER  29   4.976  -7.353   7.222
  211   1HB   SER  29          HB2       SER  29   5.232  -5.307   5.911
  212   2HB   SER  29          HB1       SER  29   4.884  -6.194   4.428
  213    HG   SER  29           HG       SER  29   3.045  -5.088   5.264
  214    H    GLN  30           HN       GLN  30   5.279  -8.523   3.880
  215    HA   GLN  30           HA       GLN  30   2.823  -9.858   3.759
  216   1HB   GLN  30          HB2       GLN  30   3.841 -11.135   1.892
  217   2HB   GLN  30          HB1       GLN  30   4.083  -9.401   1.756
  218   1HG   GLN  30          HG2       GLN  30   6.351  -9.704   2.699
  219   2HG   GLN  30          HG1       GLN  30   6.094 -11.444   2.654
  220    H    ARG  31           HN       ARG  31   5.788 -10.738   5.311
  221    HA   ARG  31           HA       ARG  31   5.248 -13.532   5.494
  222   1HB   ARG  31          HB2       ARG  31   7.523 -12.652   5.693
  223   2HB   ARG  31          HB1       ARG  31   7.072 -11.780   7.149
  224   1HG   ARG  31          HG2       ARG  31   8.286 -13.748   7.762
  225   2HG   ARG  31          HG1       ARG  31   6.603 -13.939   8.256
  226   1HD   ARG  31          HD2       ARG  31   7.705 -15.039   5.678
  227   2HD   ARG  31          HD1       ARG  31   7.680 -15.956   7.183
  228    HE   ARG  31           HE       ARG  31   5.098 -15.035   6.737
  229   1HH1  ARG  31          HH11      ARG  31   7.387 -17.179   5.212
  230   2HH1  ARG  31          HH12      ARG  31   6.166 -18.199   4.528
  231   1HH2  ARG  31          HH21      ARG  31   3.490 -16.374   5.840
  232   2HH2  ARG  31          HH22      ARG  31   3.954 -17.741   4.883
  233    H    LEU  32           HN       LEU  32   4.342 -10.727   7.358
  234    HA   LEU  32           HA       LEU  32   3.214 -12.453   9.448
  235   1HB   LEU  32          HB2       LEU  32   3.787  -9.498   9.391
  236   2HB   LEU  32          HB1       LEU  32   2.875 -10.269  10.675
  237    HG   LEU  32           HG       LEU  32   4.845 -11.683  11.190
  238   1HD1  LEU  32          1HD1      LEU  32   5.972 -11.751   9.091
  239   2HD1  LEU  32          2HD1      LEU  32   7.036 -10.950  10.246
  240   3HD1  LEU  32          3HD1      LEU  32   6.142  -9.996   9.064
  241   1HD2  LEU  32          1HD2      LEU  32   4.526  -9.732  12.514
  242   2HD2  LEU  32          2HD2      LEU  32   5.195  -8.694  11.254
  243   3HD2  LEU  32          3HD2      LEU  32   6.242  -9.822  12.116
  244    H    ILE  33           HN       ILE  33   2.223  -9.419   7.825
  245    HA   ILE  33           HA       ILE  33  -0.532  -9.867   8.372
  246    HB   ILE  33           HB       ILE  33   0.763  -7.952   6.422
  247   1HG1  ILE  33          2HG1      ILE  33   0.151  -6.268   8.178
  248   2HG1  ILE  33          1HG1      ILE  33  -0.313  -7.600   9.230
  249   1HG2  ILE  33          1HG2      ILE  33  -2.100  -8.223   7.314
  250   2HG2  ILE  33          2HG2      ILE  33  -1.466  -8.268   5.670
  251   3HG2  ILE  33          3HG2      ILE  33  -1.453  -6.757   6.579
  252   1HD1  ILE  33          1HD1      ILE  33   2.438  -7.446   8.070
  253   2HD1  ILE  33          2HD1      ILE  33   1.879  -8.302   9.506
  254   3HD1  ILE  33          3HD1      ILE  33   2.001  -6.544   9.521
  255    H    GLY  34           HN       GLY  34   1.496 -11.332   6.135
  256   1HA   GLY  34          HA2       GLY  34  -0.638 -11.681   4.159
  257   2HA   GLY  34          HA1       GLY  34   1.043 -12.162   3.962
  258    H    GLN  35           HN       GLN  35  -0.668 -12.816   6.869
  259    HA   GLN  35           HA       GLN  35  -0.807 -15.664   6.174
  260   1HB   GLN  35          HB2       GLN  35  -0.521 -16.189   8.496
  261   2HB   GLN  35          HB1       GLN  35   0.743 -15.047   8.066
  262   1HG   GLN  35          HG2       GLN  35  -0.005 -14.313  10.138
  263   2HG   GLN  35          HG1       GLN  35  -0.819 -13.250   8.992
  264    H    GLN  36           HN       GLN  36  -2.564 -12.829   6.668
  265    HA   GLN  36           HA       GLN  36  -4.783 -13.616   8.124
  266   1HB   GLN  36          HB2       GLN  36  -4.146 -11.500   6.254
  267   2HB   GLN  36          HB1       GLN  36  -5.819 -12.021   6.078
  268   1HG   GLN  36          HG2       GLN  36  -6.422 -11.049   7.978
  269   2HG   GLN  36          HG1       GLN  36  -5.066 -11.756   8.855
  270    H    GLY  37           HN       GLY  37  -6.998 -14.106   7.287
  271   1HA   GLY  37          HA2       GLY  37  -6.786 -16.237   5.275
  272   2HA   GLY  37          HA1       GLY  37  -8.067 -16.075   6.472
  273    H    LEU  38           HN       LEU  38  -7.677 -13.041   5.354
  274    HA   LEU  38           HA       LEU  38 -10.016 -13.221   3.688
  275   1HB   LEU  38          HB2       LEU  38  -8.277 -10.893   4.480
  276   2HB   LEU  38          HB1       LEU  38  -9.734 -10.742   3.516
  277    HG   LEU  38           HG       LEU  38 -10.214 -10.153   5.808
  278   1HD1  LEU  38          1HD1      LEU  38 -11.928 -11.360   4.496
  279   2HD1  LEU  38          2HD1      LEU  38 -12.074 -11.614   6.235
  280   3HD1  LEU  38          3HD1      LEU  38 -11.370 -12.870   5.217
  281   1HD2  LEU  38          1HD2      LEU  38  -9.771 -11.482   7.665
  282   2HD2  LEU  38          2HD2      LEU  38  -8.317 -11.653   6.682
  283   3HD2  LEU  38          3HD2      LEU  38  -9.530 -12.933   6.690
  284    H    VAL  39           HN       VAL  39 -10.115 -12.183   1.555
  285    HA   VAL  39           HA       VAL  39  -7.983 -13.130  -0.120
  286    HB   VAL  39           HB       VAL  39  -9.388 -12.417  -1.996
  287   1HG1  VAL  39          1HG1      VAL  39 -11.115 -14.024  -1.714
  288   2HG1  VAL  39          2HG1      VAL  39 -11.063 -13.865   0.041
  289   3HG1  VAL  39          3HG1      VAL  39  -9.716 -14.613  -0.817
  290   1HG2  VAL  39          1HG2      VAL  39 -10.744 -10.937   0.140
  291   2HG2  VAL  39          2HG2      VAL  39 -11.826 -11.764  -0.980
  292   3HG2  VAL  39          3HG2      VAL  39 -10.646 -10.602  -1.588
  293    H    ASP  40           HN       ASP  40  -7.728 -11.547  -2.183
  294    HA   ASP  40           HA       ASP  40  -5.930  -9.554  -1.335
  295   1HB   ASP  40          HB2       ASP  40  -7.317  -9.616  -4.015
  296   2HB   ASP  40          HB1       ASP  40  -5.726  -8.969  -3.638
  297    H    GLY  41           HN       GLY  41  -7.947  -8.978   0.182
  298   1HA   GLY  41          HA2       GLY  41  -9.055  -6.510  -1.052
  299   2HA   GLY  41          HA1       GLY  41 -10.080  -7.578  -0.098
  300    H    LEU  42           HN       LEU  42  -7.338  -7.815   1.560
  301    HA   LEU  42           HA       LEU  42  -8.141  -5.554   3.241
  302   1HB   LEU  42          HB2       LEU  42  -6.360  -7.886   3.946
  303   2HB   LEU  42          HB1       LEU  42  -6.856  -6.620   5.035
  304    HG   LEU  42           HG       LEU  42  -8.127  -9.095   4.499
  305   1HD1  LEU  42          1HD1      LEU  42  -9.520  -7.074   6.121
  306   2HD1  LEU  42          2HD1      LEU  42  -7.854  -7.429   6.574
  307   3HD1  LEU  42          3HD1      LEU  42  -9.047  -8.726   6.515
  308   1HD2  LEU  42          1HD2      LEU  42  -9.454  -8.260   2.757
  309   2HD2  LEU  42          2HD2      LEU  42  -9.700  -6.714   3.565
  310   3HD2  LEU  42          3HD2      LEU  42 -10.479  -8.165   4.188
  311    H    PHE  43           HN       PHE  43  -7.216  -3.832   2.562
  312    HA   PHE  43           HA       PHE  43  -4.323  -3.900   2.014
  313   1HB   PHE  43          HB2       PHE  43  -4.661  -1.875   0.657
  314   2HB   PHE  43          HB1       PHE  43  -5.600  -3.239   0.076
  315    HD1  PHE  43           HD1      PHE  43  -7.192  -1.973   2.958
  316    HD2  PHE  43           HD2      PHE  43  -6.570  -1.156  -1.170
  317    HE1  PHE  43           HE1      PHE  43  -9.190  -0.550   2.947
  318    HE2  PHE  43           HE2      PHE  43  -8.572   0.264  -1.190
  319    HZ   PHE  43           HZ       PHE  43  -9.888   0.570   0.869
  320    H    LEU  44           HN       LEU  44  -3.081  -1.944   2.515
  321    HA   LEU  44           HA       LEU  44  -4.101  -0.386   4.779
  322   1HB   LEU  44          HB2       LEU  44  -2.887  -2.277   5.751
  323   2HB   LEU  44          HB1       LEU  44  -1.489  -1.908   4.759
  324    HG   LEU  44           HG       LEU  44  -1.236   0.251   5.966
  325   1HD1  LEU  44          1HD1      LEU  44  -3.226  -0.769   7.957
  326   2HD1  LEU  44          2HD1      LEU  44  -3.724   0.254   6.611
  327   3HD1  LEU  44          3HD1      LEU  44  -2.550   0.851   7.785
  328   1HD2  LEU  44          1HD2      LEU  44  -0.209  -0.672   7.868
  329   2HD2  LEU  44          2HD2      LEU  44  -0.131  -1.938   6.642
  330   3HD2  LEU  44          3HD2      LEU  44  -1.338  -2.026   7.924
  331    H    VAL  45           HN       VAL  45  -3.177   1.687   4.963
  332    HA   VAL  45           HA       VAL  45  -1.562   2.461   2.628
  333    HB   VAL  45           HB       VAL  45  -3.280   4.165   4.440
  334   1HG1  VAL  45          1HG1      VAL  45  -1.770   5.757   3.867
  335   2HG1  VAL  45          2HG1      VAL  45  -2.701   5.778   2.370
  336   3HG1  VAL  45          3HG1      VAL  45  -1.197   4.862   2.459
  337   1HG2  VAL  45          1HG2      VAL  45  -4.520   4.538   2.278
  338   2HG2  VAL  45          2HG2      VAL  45  -4.645   2.913   2.952
  339   3HG2  VAL  45          3HG2      VAL  45  -3.562   3.223   1.594
  340    H    ARG  46           HN       ARG  46   0.427   1.815   3.446
  341    HA   ARG  46           HA       ARG  46   1.450   3.581   5.554
  342   1HB   ARG  46          HB2       ARG  46   2.091   1.867   6.826
  343   2HB   ARG  46          HB1       ARG  46   1.151   0.823   5.781
  344   1HG   ARG  46          HG2       ARG  46   4.060   1.465   5.401
  345   2HG   ARG  46          HG1       ARG  46   3.430   0.028   6.191
  346   1HD   ARG  46          HD2       ARG  46   2.225  -0.530   4.081
  347   2HD   ARG  46          HD1       ARG  46   3.055   0.820   3.309
  348    HE   ARG  46           HE       ARG  46   4.110  -1.739   3.719
  349   1HH1  ARG  46          HH11      ARG  46   5.026   1.607   3.938
  350   2HH1  ARG  46          HH12      ARG  46   6.720   1.283   3.845
  351   1HH2  ARG  46          HH21      ARG  46   6.339  -2.170   3.553
  352   2HH2  ARG  46          HH22      ARG  46   7.469  -0.860   3.599
  353    H    GLU  47           HN       GLU  47   3.927   3.755   5.438
  354    HA   GLU  47           HA       GLU  47   4.779   3.494   2.650
  355   1HB   GLU  47          HB2       GLU  47   5.532   5.848   2.674
  356   2HB   GLU  47          HB1       GLU  47   3.792   5.685   2.808
  357   1HG   GLU  47          HG2       GLU  47   4.050   5.939   5.282
  358   2HG   GLU  47          HG1       GLU  47   5.745   6.330   5.000
  359    H    SER  48           HN       SER  48   7.087   5.075   2.867
  360    HA   SER  48           HA       SER  48   8.629   3.552   4.857
  361   1HB   SER  48          HB2       SER  48  10.521   3.520   3.281
  362   2HB   SER  48          HB1       SER  48   9.120   2.698   2.607
  363    HG   SER  48           HG       SER  48   9.911   5.363   2.046
  364    H    GLN  49           HN       GLN  49  10.057   4.668   6.045
  365    HA   GLN  49           HA       GLN  49  10.065   7.564   5.667
  366   1HB   GLN  49          HB2       GLN  49  10.571   7.772   7.983
  367   2HB   GLN  49          HB1       GLN  49   9.349   6.503   7.893
  368   1HG   GLN  49          HG2       GLN  49  10.977   5.810   9.459
  369   2HG   GLN  49          HG1       GLN  49  11.209   4.839   8.016
  370    H    ARG  50           HN       ARG  50  11.642   5.121   4.494
  371    HA   ARG  50           HA       ARG  50  14.353   6.177   4.840
  372   1HB   ARG  50          HB2       ARG  50  14.103   3.803   5.377
  373   2HB   ARG  50          HB1       ARG  50  13.411   3.502   3.790
  374   1HG   ARG  50          HG2       ARG  50  15.688   2.770   3.799
  375   2HG   ARG  50          HG1       ARG  50  15.554   4.194   2.767
  376   1HD   ARG  50          HD2       ARG  50  16.426   4.312   5.647
  377   2HD   ARG  50          HD1       ARG  50  17.553   4.129   4.305
  378    HE   ARG  50           HE       ARG  50  15.973   6.346   3.754
  379   1HH1  ARG  50          HH11      ARG  50  18.306   5.355   6.151
  380   2HH1  ARG  50          HH12      ARG  50  18.865   6.966   6.454
  381   1HH2  ARG  50          HH21      ARG  50  16.707   8.465   4.149
  382   2HH2  ARG  50          HH22      ARG  50  17.958   8.732   5.318
  383    H    ASN  51           HN       ASN  51  11.863   5.388   2.427
  384    HA   ASN  51           HA       ASN  51  13.606   6.099   0.241
  385   1HB   ASN  51          HB2       ASN  51  10.610   5.712   0.236
  386   2HB   ASN  51          HB1       ASN  51  11.673   5.713  -1.168
  387   1HD2  ASN  51          1HD2      ASN  51  13.523   4.248   1.034
  388   2HD2  ASN  51          2HD2      ASN  51  13.043   2.609   0.809
  389    HA   PRO  52           HA       PRO  52  13.319  10.561   0.698
  390   1HB   PRO  52          HB2       PRO  52  13.368  10.261  -2.286
  391   2HB   PRO  52          HB1       PRO  52  14.252  11.399  -1.262
  392   1HG   PRO  52          HG2       PRO  52  15.444   9.216  -2.240
  393   2HG   PRO  52          HG1       PRO  52  15.811   9.817  -0.614
  394   1HD   PRO  52          HD2       PRO  52  14.297   7.415  -1.436
  395   2HD   PRO  52          HD1       PRO  52  15.150   7.747   0.084
  396    H    GLN  53           HN       GLN  53  11.406   8.686  -1.553
  397    HA   GLN  53           HA       GLN  53   9.084  10.414  -1.042
  398   1HB   GLN  53          HB2       GLN  53   9.541   9.040  -3.683
  399   2HB   GLN  53          HB1       GLN  53   8.408  10.326  -3.305
  400   1HG   GLN  53          HG2       GLN  53  11.399  10.614  -3.397
  401   2HG   GLN  53          HG1       GLN  53  10.287  11.093  -4.673
  402    H    GLY  54           HN       GLY  54   8.839   8.751   0.654
  403   1HA   GLY  54          HA2       GLY  54   8.091   6.108  -0.353
  404   2HA   GLY  54          HA1       GLY  54   8.480   6.502   1.303
  405    H    PHE  55           HN       PHE  55   6.030   6.229  -1.046
  406    HA   PHE  55           HA       PHE  55   3.954   6.386   0.979
  407   1HB   PHE  55          HB2       PHE  55   3.871   7.836  -1.687
  408   2HB   PHE  55          HB1       PHE  55   2.451   7.544  -0.689
  409    HD1  PHE  55           HD1      PHE  55   5.890   8.966  -0.328
  410    HD2  PHE  55           HD2      PHE  55   1.763   9.250   0.667
  411    HE1  PHE  55           HE1      PHE  55   6.342  11.028   0.931
  412    HE2  PHE  55           HE2      PHE  55   2.206  11.319   1.922
  413    HZ   PHE  55           HZ       PHE  55   4.497  12.210   2.055
  414    H    VAL  56           HN       VAL  56   3.106   4.424   0.979
  415    HA   VAL  56           HA       VAL  56   2.664   3.035  -1.571
  416    HB   VAL  56           HB       VAL  56   4.189   1.470  -1.053
  417   1HG1  VAL  56          1HG1      VAL  56   4.878   3.266   0.837
  418   2HG1  VAL  56          2HG1      VAL  56   5.682   1.714   0.618
  419   3HG1  VAL  56          3HG1      VAL  56   4.438   1.891   1.854
  420   1HG2  VAL  56          1HG2      VAL  56   2.495   0.831   1.357
  421   2HG2  VAL  56          2HG2      VAL  56   3.634  -0.245   0.548
  422   3HG2  VAL  56          3HG2      VAL  56   2.169   0.269  -0.282
  423    H    LEU  57           HN       LEU  57   1.073   1.519  -1.670
  424    HA   LEU  57           HA       LEU  57  -0.911   1.537   0.499
  425   1HB   LEU  57          HB2       LEU  57  -1.573   2.658  -1.740
  426   2HB   LEU  57          HB1       LEU  57  -1.563   1.034  -2.404
  427    HG   LEU  57           HG       LEU  57  -3.375   2.141  -0.270
  428   1HD1  LEU  57          1HD1      LEU  57  -4.478   2.633  -2.172
  429   2HD1  LEU  57          2HD1      LEU  57  -4.964   0.941  -2.061
  430   3HD1  LEU  57          3HD1      LEU  57  -3.627   1.407  -3.113
  431   1HD2  LEU  57          1HD2      LEU  57  -4.359  -0.125  -0.152
  432   2HD2  LEU  57          2HD2      LEU  57  -2.713  -0.049   0.481
  433   3HD2  LEU  57          3HD2      LEU  57  -3.015  -0.728  -1.120
  434    H    SER  58           HN       SER  58  -0.903  -0.416   1.446
  435    HA   SER  58           HA       SER  58   0.216  -2.671  -0.032
  436   1HB   SER  58          HB2       SER  58  -0.451  -2.588   2.907
  437   2HB   SER  58          HB1       SER  58   0.670  -3.668   2.077
  438    HG   SER  58           HG       SER  58   1.002  -0.860   2.161
  439    H    LEU  59           HN       LEU  59  -0.752  -4.715  -0.063
  440    HA   LEU  59           HA       LEU  59  -3.665  -4.665   0.357
  441   1HB   LEU  59          HB2       LEU  59  -2.084  -6.245  -1.669
  442   2HB   LEU  59          HB1       LEU  59  -3.821  -6.318  -1.457
  443    HG   LEU  59           HG       LEU  59  -2.247  -3.915  -2.382
  444   1HD1  LEU  59          1HD1      LEU  59  -4.267  -5.545  -3.900
  445   2HD1  LEU  59          2HD1      LEU  59  -2.529  -5.828  -3.990
  446   3HD1  LEU  59          3HD1      LEU  59  -3.199  -4.285  -4.518
  447   1HD2  LEU  59          1HD2      LEU  59  -4.056  -3.030  -1.192
  448   2HD2  LEU  59          2HD2      LEU  59  -5.149  -4.304  -1.731
  449   3HD2  LEU  59          3HD2      LEU  59  -4.612  -3.067  -2.866
  450    H    CYS  60           HN       CYS  60  -4.336  -7.213   0.186
  451    HA   CYS  60           HA       CYS  60  -2.649  -8.837   1.865
  452   1HB   CYS  60          HB2       CYS  60  -4.210  -7.660   3.449
  453   2HB   CYS  60          HB1       CYS  60  -5.554  -8.397   2.578
  454    HG   CYS  60           HG       CYS  60  -4.307  -9.565   5.176
  455    H    HIS  61           HN       HIS  61  -2.449  -9.586  -0.251
  456    HA   HIS  61           HA       HIS  61  -4.528 -10.597  -1.775
  457   1HB   HIS  61          HB2       HIS  61  -2.622 -10.166  -2.873
  458   2HB   HIS  61          HB1       HIS  61  -1.595 -10.801  -1.626
  459    HD1  HIS  61           HD1      HIS  61  -1.532 -13.583  -1.644
  460    HD2  HIS  61           HD2      HIS  61  -2.838 -11.687  -5.090
  461    HE1  HIS  61           HE1      HIS  61  -1.325 -15.288  -3.475
  462    HE2  HIS  61           HE2      HIS  61  -1.965 -14.063  -5.567
  463    H    LEU  62           HN       LEU  62  -4.466 -13.165  -2.308
  464    HA   LEU  62           HA       LEU  62  -5.121 -14.271   0.323
  465   1HB   LEU  62          HB2       LEU  62  -6.496 -15.879  -0.741
  466   2HB   LEU  62          HB1       LEU  62  -6.804 -14.338  -1.507
  467    HG   LEU  62           HG       LEU  62  -6.797 -15.806  -3.290
  468   1HD1  LEU  62          1HD1      LEU  62  -5.341 -13.992  -3.840
  469   2HD1  LEU  62          2HD1      LEU  62  -4.707 -15.476  -4.551
  470   3HD1  LEU  62          3HD1      LEU  62  -3.972 -14.813  -3.093
  471   1HD2  LEU  62          1HD2      LEU  62  -5.775 -17.804  -3.420
  472   2HD2  LEU  62          2HD2      LEU  62  -5.649 -17.594  -1.673
  473   3HD2  LEU  62          3HD2      LEU  62  -4.275 -17.212  -2.710
  474    H    GLN  63           HN       GLN  63  -2.569 -13.981  -0.235
  475    HA   GLN  63           HA       GLN  63  -1.786 -16.500   0.638
  476   1HB   GLN  63          HB2       GLN  63  -0.416 -15.412  -1.825
  477   2HB   GLN  63          HB1       GLN  63   0.152 -16.781  -0.884
  478   1HG   GLN  63          HG2       GLN  63  -1.899 -18.001  -1.421
  479   2HG   GLN  63          HG1       GLN  63  -2.452 -16.633  -2.381
  480    H    LYS  64           HN       LYS  64  -1.142 -13.164  -0.105
  481    HA   LYS  64           HA       LYS  64   0.426 -12.973   2.311
  482   1HB   LYS  64          HB2       LYS  64   2.392 -12.018   1.224
  483   2HB   LYS  64          HB1       LYS  64   2.076 -13.636   0.622
  484   1HG   LYS  64          HG2       LYS  64   1.017 -12.688  -1.370
  485   2HG   LYS  64          HG1       LYS  64   1.364 -11.064  -0.775
  486   1HD   LYS  64          HD2       LYS  64   3.765 -11.584  -0.818
  487   2HD   LYS  64          HD1       LYS  64   3.395 -13.185  -1.457
  488   1HE   LYS  64          HE2       LYS  64   2.770 -10.552  -2.784
  489   2HE   LYS  64          HE1       LYS  64   4.064 -11.658  -3.237
  490   1HZ   LYS  64          HZ1       LYS  64   2.379 -12.167  -4.714
  491   2HZ   LYS  64          HZ2       LYS  64   1.153 -11.990  -3.563
  492   3HZ   LYS  64          HZ3       LYS  64   2.167 -13.344  -3.517
  493    H    VAL  65           HN       VAL  65   1.615 -10.429   1.154
  494    HA   VAL  65           HA       VAL  65  -0.690  -8.673   0.872
  495    HB   VAL  65           HB       VAL  65   0.022  -7.113   2.523
  496   1HG1  VAL  65          1HG1      VAL  65  -0.033  -9.935   3.492
  497   2HG1  VAL  65          2HG1      VAL  65  -1.264  -8.679   3.631
  498   3HG1  VAL  65          3HG1      VAL  65   0.191  -8.602   4.624
  499   1HG2  VAL  65          1HG2      VAL  65   2.235  -6.842   2.697
  500   2HG2  VAL  65          2HG2      VAL  65   2.569  -8.533   2.333
  501   3HG2  VAL  65          3HG2      VAL  65   2.119  -8.056   3.970
  502    H    LYS  66           HN       LYS  66   0.013  -6.558  -0.102
  503    HA   LYS  66           HA       LYS  66   2.644  -6.835  -1.433
  504   1HB   LYS  66          HB2       LYS  66   0.486  -5.348  -2.819
  505   2HB   LYS  66          HB1       LYS  66   1.789  -6.312  -3.487
  506   1HG   LYS  66          HG2       LYS  66  -0.619  -7.417  -2.107
  507   2HG   LYS  66          HG1       LYS  66  -0.465  -7.234  -3.851
  508   1HD   LYS  66          HD2       LYS  66   1.436  -8.855  -2.163
  509   2HD   LYS  66          HD1       LYS  66   0.028  -9.543  -2.969
  510   1HE   LYS  66          HE2       LYS  66   1.845  -9.957  -4.407
  511   2HE   LYS  66          HE1       LYS  66   0.978  -8.600  -5.122
  512   1HZ   LYS  66          HZ1       LYS  66   3.039  -7.786  -3.296
  513   2HZ   LYS  66          HZ2       LYS  66   2.737  -7.277  -4.882
  514   3HZ   LYS  66          HZ3       LYS  66   3.637  -8.681  -4.602
  515    H    HIS  67           HN       HIS  67   3.189  -4.639  -2.569
  516    HA   HIS  67           HA       HIS  67   2.385  -2.408  -0.901
  517   1HB   HIS  67          HB2       HIS  67   5.281  -3.136  -1.391
  518   2HB   HIS  67          HB1       HIS  67   4.716  -1.707  -0.527
  519    HD1  HIS  67           HD1      HIS  67   3.761  -2.066   1.862
  520    HD2  HIS  67           HD2      HIS  67   5.164  -5.529   0.043
  521    HE1  HIS  67           HE1      HIS  67   3.862  -3.794   3.688
  522    HE2  HIS  67           HE2      HIS  67   4.581  -5.912   2.531
  523    H    TYR  68           HN       TYR  68   2.397  -0.409  -1.928
  524    HA   TYR  68           HA       TYR  68   3.416  -0.313  -4.689
  525   1HB   TYR  68          HB2       TYR  68   0.721   0.695  -3.748
  526   2HB   TYR  68          HB1       TYR  68   1.396   0.973  -5.344
  527    HD1  TYR  68           HD1      TYR  68   0.383  -0.258  -6.978
  528    HD2  TYR  68           HD2      TYR  68   0.879  -2.033  -3.146
  529    HE1  TYR  68           HE1      TYR  68  -0.712  -2.302  -7.789
  530    HE2  TYR  68           HE2      TYR  68  -0.205  -4.086  -3.954
  531    HH   TYR  68           HH       TYR  68  -1.669  -4.847  -5.676
  532    H    LEU  69           HN       LEU  69   5.229   0.922  -3.551
  533    HA   LEU  69           HA       LEU  69   4.406   3.727  -3.221
  534   1HB   LEU  69          HB2       LEU  69   4.957   3.362  -1.062
  535   2HB   LEU  69          HB1       LEU  69   6.099   2.109  -1.427
  536    HG   LEU  69           HG       LEU  69   6.800   4.496  -0.440
  537   1HD1  LEU  69          1HD1      LEU  69   8.225   2.556  -2.152
  538   2HD1  LEU  69          2HD1      LEU  69   8.539   3.062  -0.495
  539   3HD1  LEU  69          3HD1      LEU  69   9.020   4.095  -1.839
  540   1HD2  LEU  69          1HD2      LEU  69   5.920   5.381  -2.833
  541   2HD2  LEU  69          2HD2      LEU  69   7.618   5.082  -3.210
  542   3HD2  LEU  69          3HD2      LEU  69   7.187   6.166  -1.901
  543    H    ILE  70           HN       ILE  70   5.122   4.727  -4.959
  544    HA   ILE  70           HA       ILE  70   8.022   4.649  -5.197
  545    HB   ILE  70           HB       ILE  70   6.321   3.919  -7.543
  546   1HG1  ILE  70          2HG1      ILE  70   8.555   2.653  -5.959
  547   2HG1  ILE  70          1HG1      ILE  70   6.897   2.094  -6.094
  548   1HG2  ILE  70          1HG2      ILE  70   8.975   5.220  -7.427
  549   2HG2  ILE  70          2HG2      ILE  70   7.764   5.236  -8.708
  550   3HG2  ILE  70          3HG2      ILE  70   8.828   3.844  -8.520
  551   1HD1  ILE  70          1HD1      ILE  70   8.361   2.266  -8.616
  552   2HD1  ILE  70          2HD1      ILE  70   7.291   1.014  -7.995
  553   3HD1  ILE  70          3HD1      ILE  70   8.963   1.086  -7.464
  554    H    LEU  71           HN       LEU  71   5.072   6.168  -5.799
  555    HA   LEU  71           HA       LEU  71   6.549   8.687  -6.114
  556   1HB   LEU  71          HB2       LEU  71   4.198   8.020  -7.854
  557   2HB   LEU  71          HB1       LEU  71   5.261   9.400  -7.991
  558    HG   LEU  71           HG       LEU  71   6.034   6.529  -8.523
  559   1HD1  LEU  71          1HD1      LEU  71   5.626   8.778 -10.482
  560   2HD1  LEU  71          2HD1      LEU  71   4.443   7.512 -10.158
  561   3HD1  LEU  71          3HD1      LEU  71   6.013   7.096 -10.847
  562   1HD2  LEU  71          1HD2      LEU  71   7.711   8.530  -7.782
  563   2HD2  LEU  71          2HD2      LEU  71   7.702   8.720  -9.535
  564   3HD2  LEU  71          3HD2      LEU  71   8.162   7.173  -8.819
  565    HA   PRO  72           HA       PRO  72   3.401   9.839  -3.134
  566   1HB   PRO  72          HB2       PRO  72   4.495  12.143  -2.363
  567   2HB   PRO  72          HB1       PRO  72   5.249  10.600  -1.946
  568   1HG   PRO  72          HG2       PRO  72   5.951  12.510  -4.143
  569   2HG   PRO  72          HG1       PRO  72   7.023  11.672  -3.011
  570   1HD   PRO  72          HD2       PRO  72   6.540  10.814  -5.567
  571   2HD   PRO  72          HD1       PRO  72   7.004   9.734  -4.238
  572    H    SER  73           HN       SER  73   2.120  11.906  -2.721
  573    HA   SER  73           HA       SER  73   0.737  12.639  -5.030
  574   1HB   SER  73          HB2       SER  73   0.848  14.129  -2.399
  575   2HB   SER  73          HB1       SER  73  -0.393  14.308  -3.639
  576    HG   SER  73           HG       SER  73   0.026  12.243  -1.818
  577    H    GLU  74           HN       GLU  74   1.230  13.984  -6.622
  578    HA   GLU  74           HA       GLU  74   3.416  15.896  -6.202
  579   1HB   GLU  74          HB2       GLU  74   3.038  14.069  -8.189
  580   2HB   GLU  74          HB1       GLU  74   2.372  15.518  -8.929
  581   1HG   GLU  74          HG2       GLU  74   4.717  15.234  -9.488
  582   2HG   GLU  74          HG1       GLU  74   4.461  16.698  -8.537
  583    H    GLU  75           HN       GLU  75   3.168  17.927  -7.711
  584    HA   GLU  75           HA       GLU  75   0.611  19.131  -6.982
  585   1HB   GLU  75          HB2       GLU  75   2.616  20.298  -6.250
  586   2HB   GLU  75          HB1       GLU  75   3.228  20.340  -7.897
  587   1HG   GLU  75          HG2       GLU  75   1.478  21.825  -8.567
  588   2HG   GLU  75          HG1       GLU  75   0.711  21.697  -6.987
  589    H    GLU  76           HN       GLU  76   1.496  17.359  -9.370
  590    HA   GLU  76           HA       GLU  76   0.109  18.953 -11.405
  591   1HB   GLU  76          HB2       GLU  76   1.388  17.765 -13.131
  592   2HB   GLU  76          HB1       GLU  76   2.459  18.652 -12.056
  593   1HG   GLU  76          HG2       GLU  76   2.935  16.562 -10.849
  594   2HG   GLU  76          HG1       GLU  76   1.913  15.695 -11.995
  595    H    GLY  77           HN       GLY  77  -0.253  16.615  -9.218
  596   1HA   GLY  77          HA2       GLY  77  -2.488  15.424 -10.552
  597   2HA   GLY  77          HA1       GLY  77  -1.139  14.305 -10.416
  598    H    ARG  78           HN       ARG  78  -2.360  12.958  -9.045
  599    HA   ARG  78           HA       ARG  78  -2.669  14.027  -6.322
  600   1HB   ARG  78          HB2       ARG  78  -4.396  11.974  -6.270
  601   2HB   ARG  78          HB1       ARG  78  -4.851  13.603  -6.732
  602   1HG   ARG  78          HG2       ARG  78  -3.967  11.587  -8.763
  603   2HG   ARG  78          HG1       ARG  78  -5.634  11.694  -8.217
  604   1HD   ARG  78          HD2       ARG  78  -4.029  13.834  -9.598
  605   2HD   ARG  78          HD1       ARG  78  -5.421  12.963 -10.232
  606    HE   ARG  78           HE       ARG  78  -6.177  14.269  -7.873
  607   1HH1  ARG  78          HH11      ARG  78  -5.235  15.018 -11.148
  608   2HH1  ARG  78          HH12      ARG  78  -6.141  16.492 -11.204
  609   1HH2  ARG  78          HH21      ARG  78  -7.371  16.208  -7.945
  610   2HH2  ARG  78          HH22      ARG  78  -7.354  17.169  -9.386
  611    H    LEU  79           HN       LEU  79  -3.315  10.689  -6.399
  612    HA   LEU  79           HA       LEU  79  -0.782  10.152  -5.105
  613   1HB   LEU  79          HB2       LEU  79  -3.048   8.270  -5.789
  614   2HB   LEU  79          HB1       LEU  79  -1.672   7.881  -4.778
  615    HG   LEU  79           HG       LEU  79  -3.805   9.922  -4.151
  616   1HD1  LEU  79          1HD1      LEU  79  -4.919   8.090  -3.515
  617   2HD1  LEU  79          2HD1      LEU  79  -3.808   8.083  -2.145
  618   3HD1  LEU  79          3HD1      LEU  79  -3.477   7.076  -3.555
  619   1HD2  LEU  79          1HD2      LEU  79  -2.030  10.830  -3.047
  620   2HD2  LEU  79          2HD2      LEU  79  -1.179   9.291  -2.919
  621   3HD2  LEU  79          3HD2      LEU  79  -2.533   9.641  -1.846
  622    H    TYR  80           HN       TYR  80   1.011   9.262  -6.051
  623    HA   TYR  80           HA       TYR  80   0.692   8.487  -8.857
  624   1HB   TYR  80          HB2       TYR  80   3.068   9.584  -7.382
  625   2HB   TYR  80          HB1       TYR  80   3.161   8.941  -9.017
  626    HD1  TYR  80           HD1      TYR  80   0.601  11.130  -7.411
  627    HD2  TYR  80           HD2      TYR  80   3.571  10.720 -10.420
  628    HE1  TYR  80           HE1      TYR  80  -0.030  13.325  -8.317
  629    HE2  TYR  80           HE2      TYR  80   2.953  12.916 -11.336
  630    HH   TYR  80           HH       TYR  80   0.657  14.361 -11.250
  631    H    PHE  81           HN       PHE  81   0.344   6.301  -8.869
  632    HA   PHE  81           HA       PHE  81   2.630   4.730  -8.294
  633   1HB   PHE  81          HB2       PHE  81   1.052   2.943  -7.180
  634   2HB   PHE  81          HB1       PHE  81   1.899   4.163  -6.224
  635    HD1  PHE  81           HD1      PHE  81  -1.103   4.723  -8.328
  636    HD2  PHE  81           HD2      PHE  81   0.458   4.343  -4.389
  637    HE1  PHE  81           HE1      PHE  81  -3.255   5.481  -7.402
  638    HE2  PHE  81           HE2      PHE  81  -1.687   5.104  -3.459
  639    HZ   PHE  81           HZ       PHE  81  -3.546   5.673  -4.967
  640    H    SER  82           HN       SER  82   2.372   2.463  -8.733
  641    HA   SER  82           HA       SER  82   0.493   1.814 -10.823
  642   1HB   SER  82          HB2       SER  82   2.279   2.893 -12.083
  643   2HB   SER  82          HB1       SER  82   3.492   1.910 -11.263
  644    HG   SER  82           HG       SER  82   2.364   1.338 -13.498
  645    H    MET  83           HN       MET  83   1.796  -0.402 -11.705
  646    HA   MET  83           HA       MET  83   2.559  -2.082  -9.488
  647   1HB   MET  83          HB2       MET  83   0.794  -3.731  -9.895
  648   2HB   MET  83          HB1       MET  83   0.104  -2.178  -9.453
  649   1HG   MET  83          HG2       MET  83   0.120  -1.943 -12.133
  650   2HG   MET  83          HG1       MET  83  -0.092  -3.685 -11.963
  651   1HE   MET  83          HE1       MET  83  -1.387  -4.353  -9.771
  652   2HE   MET  83          HE2       MET  83  -3.130  -4.231 -10.004
  653   3HE   MET  83          HE3       MET  83  -2.316  -3.159  -8.866
  654    H    ASP  84           HN       ASP  84   2.142  -4.553 -10.972
  655    HA   ASP  84           HA       ASP  84   4.490  -4.548 -12.517
  656   1HB   ASP  84          HB2       ASP  84   2.214  -6.526 -12.386
  657   2HB   ASP  84          HB1       ASP  84   3.649  -6.788 -13.368
  658    H    ASP  85           HN       ASP  85   1.069  -4.416 -13.413
  659    HA   ASP  85           HA       ASP  85   1.858  -3.250 -15.983
  660   1HB   ASP  85          HB2       ASP  85   1.480  -5.635 -16.429
  661   2HB   ASP  85          HB1       ASP  85  -0.119  -5.525 -15.700
  662    H    GLY  86           HN       GLY  86   1.069  -1.594 -14.114
  663   1HA   GLY  86          HA2       GLY  86  -1.690  -0.944 -14.891
  664   2HA   GLY  86          HA1       GLY  86  -1.277  -0.998 -13.188
  665    H    GLN  87           HN       GLN  87  -2.352   1.225 -14.060
  666    HA   GLN  87           HA       GLN  87  -0.178   3.183 -13.917
  667   1HB   GLN  87          HB2       GLN  87  -1.414   4.596 -15.583
  668   2HB   GLN  87          HB1       GLN  87  -0.724   3.128 -16.268
  669   1HG   GLN  87          HG2       GLN  87  -2.884   2.041 -16.191
  670   2HG   GLN  87          HG1       GLN  87  -3.598   3.455 -15.424
  671    H    THR  88           HN       THR  88  -1.012   3.105 -11.639
  672    HA   THR  88           HA       THR  88  -3.640   4.309 -11.389
  673    HB   THR  88           HB       THR  88  -3.546   3.597  -9.023
  674    HG1  THR  88           HG1      THR  88  -1.149   2.301  -9.800
  675   1HG2  THR  88          1HG2      THR  88  -3.639   1.905 -11.344
  676   2HG2  THR  88          2HG2      THR  88  -4.561   1.808  -9.839
  677   3HG2  THR  88          3HG2      THR  88  -2.981   1.033  -9.955
  678    H    ARG  89           HN       ARG  89  -0.768   5.591 -11.650
  679    HA   ARG  89           HA       ARG  89  -0.412   7.335  -9.529
  680   1HB   ARG  89          HB2       ARG  89   1.268   7.071 -11.251
  681   2HB   ARG  89          HB1       ARG  89   0.184   7.742 -12.458
  682   1HG   ARG  89          HG2       ARG  89   0.428   9.645 -10.374
  683   2HG   ARG  89          HG1       ARG  89   2.048   9.085 -10.791
  684   1HD   ARG  89          HD2       ARG  89  -0.012  10.144 -12.725
  685   2HD   ARG  89          HD1       ARG  89   1.387  11.033 -12.123
  686    HE   ARG  89           HE       ARG  89   2.289   8.655 -13.285
  687   1HH1  ARG  89          HH11      ARG  89   0.772  11.651 -14.232
  688   2HH1  ARG  89          HH12      ARG  89   1.459  11.641 -15.822
  689   1HH2  ARG  89          HH21      ARG  89   3.194   8.640 -15.376
  690   2HH2  ARG  89          HH22      ARG  89   2.834   9.932 -16.472
  691    H    PHE  90           HN       PHE  90  -3.016   7.456  -9.451
  692    HA   PHE  90           HA       PHE  90  -3.628  10.210 -10.156
  693   1HB   PHE  90          HB2       PHE  90  -5.947   9.493 -10.881
  694   2HB   PHE  90          HB1       PHE  90  -4.645   9.100 -11.991
  695    HD1  PHE  90           HD1      PHE  90  -6.065   7.413  -8.962
  696    HD2  PHE  90           HD2      PHE  90  -5.039   7.142 -13.083
  697    HE1  PHE  90           HE1      PHE  90  -6.760   5.057  -8.975
  698    HE2  PHE  90           HE2      PHE  90  -5.737   4.783 -13.103
  699    HZ   PHE  90           HZ       PHE  90  -6.599   3.738 -11.047
  700    H    THR  91           HN       THR  91  -6.411   9.949  -9.262
  701    HA   THR  91           HA       THR  91  -5.914  10.057  -6.422
  702    HB   THR  91           HB       THR  91  -8.436  10.441  -8.040
  703    HG1  THR  91           HG1      THR  91  -8.107  12.624  -7.454
  704   1HG2  THR  91          1HG2      THR  91  -9.645  10.369  -6.198
  705   2HG2  THR  91          2HG2      THR  91  -8.681  11.690  -5.538
  706   3HG2  THR  91          3HG2      THR  91  -8.210  10.018  -5.236
  707    H    ASP  92           HN       ASP  92  -6.313   8.507  -4.964
  708    HA   ASP  92           HA       ASP  92  -7.799   6.131  -5.876
  709   1HB   ASP  92          HB2       ASP  92  -5.413   5.652  -5.585
  710   2HB   ASP  92          HB1       ASP  92  -5.486   6.248  -3.930
  711    H    LEU  93           HN       LEU  93  -7.113   8.288  -3.174
  712    HA   LEU  93           HA       LEU  93  -8.393   7.213  -1.064
  713   1HB   LEU  93          HB2       LEU  93  -7.330   9.461  -1.160
  714   2HB   LEU  93          HB1       LEU  93  -8.768  10.073  -1.948
  715    HG   LEU  93           HG       LEU  93  -8.742   8.881   0.826
  716   1HD1  LEU  93          1HD1      LEU  93  -7.519  11.179   0.225
  717   2HD1  LEU  93          2HD1      LEU  93  -8.397  10.924   1.734
  718   3HD1  LEU  93          3HD1      LEU  93  -9.171  11.773   0.397
  719   1HD2  LEU  93          1HD2      LEU  93 -10.930   8.696   0.130
  720   2HD2  LEU  93          2HD2      LEU  93 -10.833  10.119  -0.908
  721   3HD2  LEU  93          3HD2      LEU  93 -10.928  10.310   0.843
  722    H    LEU  94           HN       LEU  94 -10.226   9.482  -3.126
  723    HA   LEU  94           HA       LEU  94 -12.741   8.805  -2.197
  724   1HB   LEU  94          HB2       LEU  94 -12.147  10.761  -3.635
  725   2HB   LEU  94          HB1       LEU  94 -12.067   9.674  -5.008
  726    HG   LEU  94           HG       LEU  94 -14.178  10.946  -4.910
  727   1HD1  LEU  94          1HD1      LEU  94 -15.071   8.183  -4.378
  728   2HD1  LEU  94          2HD1      LEU  94 -13.860   8.393  -5.641
  729   3HD1  LEU  94          3HD1      LEU  94 -15.401   9.243  -5.748
  730   1HD2  LEU  94          1HD2      LEU  94 -15.504  11.057  -3.107
  731   2HD2  LEU  94          2HD2      LEU  94 -14.069  10.534  -2.225
  732   3HD2  LEU  94          3HD2      LEU  94 -15.283   9.352  -2.715
  733    H    GLN  95           HN       GLN  95 -10.932   7.398  -4.904
  734    HA   GLN  95           HA       GLN  95 -12.914   5.723  -5.887
  735   1HB   GLN  95          HB2       GLN  95  -9.917   5.351  -5.867
  736   2HB   GLN  95          HB1       GLN  95 -11.046   4.562  -6.933
  737   1HG   GLN  95          HG2       GLN  95 -10.570   7.518  -6.837
  738   2HG   GLN  95          HG1       GLN  95  -9.853   6.415  -8.005
  739    H    LEU  96           HN       LEU  96 -10.377   5.172  -3.484
  740    HA   LEU  96           HA       LEU  96 -10.596   2.512  -2.977
  741   1HB   LEU  96          HB2       LEU  96  -8.987   3.959  -1.870
  742   2HB   LEU  96          HB1       LEU  96 -10.270   4.746  -0.974
  743    HG   LEU  96           HG       LEU  96  -9.648   1.814  -0.663
  744   1HD1  LEU  96          1HD1      LEU  96  -8.779   3.713   1.416
  745   2HD1  LEU  96          2HD1      LEU  96  -7.837   3.718  -0.074
  746   3HD1  LEU  96          3HD1      LEU  96  -8.022   2.225   0.847
  747   1HD2  LEU  96          1HD2      LEU  96 -11.435   3.784   0.657
  748   2HD2  LEU  96          2HD2      LEU  96 -10.669   2.560   1.669
  749   3HD2  LEU  96          3HD2      LEU  96 -11.690   2.073   0.317
  750    H    VAL  97           HN       VAL  97 -12.437   4.973  -1.172
  751    HA   VAL  97           HA       VAL  97 -14.060   3.265   0.253
  752    HB   VAL  97           HB       VAL  97 -14.845   5.979  -0.811
  753   1HG1  VAL  97          1HG1      VAL  97 -16.730   4.677   0.077
  754   2HG1  VAL  97          2HG1      VAL  97 -16.359   6.076   1.085
  755   3HG1  VAL  97          3HG1      VAL  97 -15.855   4.464   1.593
  756   1HG2  VAL  97          1HG2      VAL  97 -14.117   6.424   1.734
  757   2HG2  VAL  97          2HG2      VAL  97 -13.014   6.584   0.367
  758   3HG2  VAL  97          3HG2      VAL  97 -13.012   5.108   1.332
  759    H    GLU  98           HN       GLU  98 -15.373   5.134  -2.488
  760    HA   GLU  98           HA       GLU  98 -17.609   3.442  -2.783
  761   1HB   GLU  98          HB2       GLU  98 -17.610   5.779  -3.486
  762   2HB   GLU  98          HB1       GLU  98 -16.433   5.416  -4.740
  763   1HG   GLU  98          HG2       GLU  98 -18.047   3.957  -5.843
  764   2HG   GLU  98          HG1       GLU  98 -19.228   4.311  -4.582
  765    H    PHE  99           HN       PHE  99 -14.788   3.781  -4.950
  766    HA   PHE  99           HA       PHE  99 -15.587   1.735  -6.704
  767   1HB   PHE  99          HB2       PHE  99 -13.862   3.611  -7.045
  768   2HB   PHE  99          HB1       PHE  99 -12.720   2.524  -6.268
  769    HD1  PHE  99           HD1      PHE  99 -11.258   2.209  -8.083
  770    HD2  PHE  99           HD2      PHE  99 -15.421   1.455  -8.553
  771    HE1  PHE  99           HE1      PHE  99 -10.817   1.137 -10.253
  772    HE2  PHE  99           HE2      PHE  99 -14.986   0.378 -10.719
  773    HZ   PHE  99           HZ       PHE  99 -12.682   0.220 -11.573
  774    H    HIS 100           HN       HIS 100 -14.639   1.297  -3.516
  775    HA   HIS 100           HA       HIS 100 -12.905  -0.886  -3.699
  776   1HB   HIS 100          HB2       HIS 100 -13.586  -1.519  -1.466
  777   2HB   HIS 100          HB1       HIS 100 -13.426   0.222  -1.557
  778    HD1  HIS 100           HD1      HIS 100 -14.954  -0.468   0.741
  779    HD2  HIS 100           HD2      HIS 100 -16.777  -0.353  -2.984
  780    HE1  HIS 100           HE1      HIS 100 -17.409  -0.215   1.206
  781    HE2  HIS 100           HE2      HIS 100 -18.502  -0.317  -1.057
  782    H    GLN 101           HN       GLN 101 -16.098  -0.636  -4.777
  783    HA   GLN 101           HA       GLN 101 -17.221  -3.130  -4.368
  784   1HB   GLN 101          HB2       GLN 101 -17.362  -1.849  -7.082
  785   2HB   GLN 101          HB1       GLN 101 -18.604  -2.738  -6.224
  786   1HG   GLN 101          HG2       GLN 101 -17.646   0.027  -5.550
  787   2HG   GLN 101          HG1       GLN 101 -19.117  -0.369  -6.424
  788    H    LEU 102           HN       LEU 102 -15.411  -2.088  -7.236
  789    HA   LEU 102           HA       LEU 102 -14.088  -4.696  -7.384
  790   1HB   LEU 102          HB2       LEU 102 -15.762  -3.561  -9.626
  791   2HB   LEU 102          HB1       LEU 102 -14.637  -4.887  -9.815
  792    HG   LEU 102           HG       LEU 102 -16.815  -5.816  -9.682
  793   1HD1  LEU 102          1HD1      LEU 102 -16.130  -7.484  -8.406
  794   2HD1  LEU 102          2HD1      LEU 102 -16.301  -6.513  -6.944
  795   3HD1  LEU 102          3HD1      LEU 102 -14.798  -6.463  -7.866
  796   1HD2  LEU 102          1HD2      LEU 102 -17.387  -3.633  -8.031
  797   2HD2  LEU 102          2HD2      LEU 102 -17.634  -5.065  -7.034
  798   3HD2  LEU 102          3HD2      LEU 102 -18.493  -4.898  -8.565
  799    H    ASN 103           HN       ASN 103 -12.868  -2.324  -6.694
  800    HA   ASN 103           HA       ASN 103 -11.775  -0.996  -8.969
  801   1HB   ASN 103          HB2       ASN 103 -10.304   0.140  -7.417
  802   2HB   ASN 103          HB1       ASN 103 -11.933   0.102  -6.770
  803   1HD2  ASN 103          1HD2      ASN 103 -11.055  -2.961  -6.282
  804   2HD2  ASN 103          2HD2      ASN 103 -10.302  -2.830  -4.741
  805    H    ARG 104           HN       ARG 104  -9.262  -0.811  -9.080
  806    HA   ARG 104           HA       ARG 104  -8.317  -3.398  -9.841
  807   1HB   ARG 104          HB2       ARG 104  -7.087  -0.653  -9.835
  808   2HB   ARG 104          HB1       ARG 104  -6.148  -2.075 -10.257
  809   1HG   ARG 104          HG2       ARG 104  -6.929  -0.988 -12.253
  810   2HG   ARG 104          HG1       ARG 104  -7.721  -2.553 -12.080
  811   1HD   ARG 104          HD2       ARG 104  -9.019  -0.036 -11.091
  812   2HD   ARG 104          HD1       ARG 104  -9.133  -0.511 -12.783
  813    HE   ARG 104           HE       ARG 104 -10.659  -1.545 -10.672
  814   1HH1  ARG 104          HH11      ARG 104  -8.946  -2.610 -13.521
  815   2HH1  ARG 104          HH12      ARG 104  -9.914  -4.030 -13.723
  816   1HH2  ARG 104          HH21      ARG 104 -11.937  -3.407 -10.942
  817   2HH2  ARG 104          HH22      ARG 104 -11.614  -4.481 -12.262
  818    H    GLY 105           HN       GLY 105  -8.712  -4.096  -7.460
  819   1HA   GLY 105          HA2       GLY 105  -7.158  -3.433  -5.309
  820   2HA   GLY 105          HA1       GLY 105  -7.692  -5.074  -5.637
  821    H    ILE 106           HN       ILE 106  -6.202  -6.592  -6.208
  822    HA   ILE 106           HA       ILE 106  -3.417  -5.709  -6.202
  823    HB   ILE 106           HB       ILE 106  -4.101  -7.581  -4.725
  824   1HG1  ILE 106          2HG1      ILE 106  -2.102  -8.312  -6.873
  825   2HG1  ILE 106          1HG1      ILE 106  -1.765  -7.306  -5.470
  826   1HG2  ILE 106          1HG2      ILE 106  -5.458  -9.141  -5.542
  827   2HG2  ILE 106          2HG2      ILE 106  -4.092  -9.765  -6.460
  828   3HG2  ILE 106          3HG2      ILE 106  -5.190  -8.598  -7.195
  829   1HD1  ILE 106          1HD1      ILE 106  -2.902  -9.843  -4.715
  830   2HD1  ILE 106          2HD1      ILE 106  -1.400  -9.078  -4.201
  831   3HD1  ILE 106          3HD1      ILE 106  -1.439 -10.040  -5.679
  832    H    LEU 107           HN       LEU 107  -1.874  -6.562  -7.707
  833    HA   LEU 107           HA       LEU 107  -2.295  -6.019 -10.314
  834   1HB   LEU 107          HB2       LEU 107  -0.478  -8.307  -9.644
  835   2HB   LEU 107          HB1       LEU 107  -0.300  -7.089 -10.879
  836    HG   LEU 107           HG       LEU 107  -0.038  -5.433  -8.898
  837   1HD1  LEU 107          1HD1      LEU 107   1.306  -7.250  -7.219
  838   2HD1  LEU 107          2HD1      LEU 107  -0.302  -7.914  -7.493
  839   3HD1  LEU 107          3HD1      LEU 107  -0.120  -6.286  -6.847
  840   1HD2  LEU 107          1HD2      LEU 107   2.238  -5.569  -9.138
  841   2HD2  LEU 107          2HD2      LEU 107   1.680  -6.438 -10.567
  842   3HD2  LEU 107          3HD2      LEU 107   2.241  -7.333  -9.156
  843    HA   PRO 108           HA       PRO 108  -3.753 -10.251 -11.656
  844   1HB   PRO 108          HB2       PRO 108  -2.937 -12.481 -10.357
  845   2HB   PRO 108          HB1       PRO 108  -1.867 -11.521 -11.383
  846   1HG   PRO 108          HG2       PRO 108  -1.788 -11.863  -8.499
  847   2HG   PRO 108          HG1       PRO 108  -0.613 -11.059  -9.550
  848   1HD   PRO 108          HD2       PRO 108  -2.820  -9.896  -7.961
  849   2HD   PRO 108          HD1       PRO 108  -1.342  -9.128  -8.566
  850    H    CYS 109           HN       CYS 109  -3.798 -11.883  -8.532
  851    HA   CYS 109           HA       CYS 109  -6.277 -12.994  -8.721
  852   1HB   CYS 109          HB2       CYS 109  -4.853 -12.158  -6.192
  853   2HB   CYS 109          HB1       CYS 109  -6.154 -13.340  -6.282
  854    HG   CYS 109           HG       CYS 109  -4.610 -15.030  -8.027
  855    H    LEU 110           HN       LEU 110  -7.701 -12.440  -6.409
  856    HA   LEU 110           HA       LEU 110  -9.754 -10.928  -7.022
  857   1HB   LEU 110          HB2       LEU 110  -8.389 -11.090  -4.355
  858   2HB   LEU 110          HB1       LEU 110  -9.882 -10.196  -4.556
  859    HG   LEU 110           HG       LEU 110 -10.364 -12.387  -3.679
  860   1HD1  LEU 110          1HD1      LEU 110 -11.141 -12.304  -6.588
  861   2HD1  LEU 110          2HD1      LEU 110 -11.929 -11.380  -5.310
  862   3HD1  LEU 110          3HD1      LEU 110 -11.983 -13.143  -5.285
  863   1HD2  LEU 110          1HD2      LEU 110  -9.689 -14.408  -4.619
  864   2HD2  LEU 110          2HD2      LEU 110  -8.251 -13.394  -4.732
  865   3HD2  LEU 110          3HD2      LEU 110  -9.256 -13.660  -6.156
  866    H    LEU 111           HN       LEU 111 -10.515  -8.802  -6.849
  867    HA   LEU 111           HA       LEU 111  -8.437  -6.742  -6.615
  868   1HB   LEU 111          HB2       LEU 111  -9.461  -5.515  -8.482
  869   2HB   LEU 111          HB1       LEU 111  -8.802  -7.061  -8.962
  870    HG   LEU 111           HG       LEU 111 -10.910  -6.581 -10.099
  871   1HD1  LEU 111          1HD1      LEU 111 -10.175  -8.941  -8.981
  872   2HD1  LEU 111          2HD1      LEU 111 -11.528  -8.728 -10.092
  873   3HD1  LEU 111          3HD1      LEU 111 -11.811  -8.749  -8.352
  874   1HD2  LEU 111          1HD2      LEU 111 -12.948  -6.238  -9.034
  875   2HD2  LEU 111          2HD2      LEU 111 -11.819  -5.267  -8.089
  876   3HD2  LEU 111          3HD2      LEU 111 -12.351  -6.836  -7.486
  877    H    ARG 112           HN       ARG 112 -11.047  -7.854  -5.144
  878    HA   ARG 112           HA       ARG 112 -12.346  -5.262  -4.701
  879   1HB   ARG 112          HB2       ARG 112 -13.125  -8.013  -3.706
  880   2HB   ARG 112          HB1       ARG 112 -14.071  -6.543  -3.521
  881   1HG   ARG 112          HG2       ARG 112 -14.339  -6.402  -5.940
  882   2HG   ARG 112          HG1       ARG 112 -13.374  -7.866  -6.134
  883   1HD   ARG 112          HD2       ARG 112 -15.750  -8.376  -6.267
  884   2HD   ARG 112          HD1       ARG 112 -15.027  -9.126  -4.845
  885    HE   ARG 112           HE       ARG 112 -16.070  -6.642  -4.096
  886   1HH1  ARG 112          HH11      ARG 112 -17.188  -9.764  -5.179
  887   2HH1  ARG 112          HH12      ARG 112 -18.703  -9.650  -4.349
  888   1HH2  ARG 112          HH21      ARG 112 -18.061  -6.489  -3.001
  889   2HH2  ARG 112          HH22      ARG 112 -19.199  -7.790  -3.112
  890    H    HIS 113           HN       HIS 113 -12.467  -4.316  -2.614
  891    HA   HIS 113           HA       HIS 113 -10.984  -5.648  -0.477
  892   1HB   HIS 113          HB2       HIS 113  -9.518  -3.793  -0.043
  893   2HB   HIS 113          HB1       HIS 113  -9.343  -4.247  -1.736
  894    HD1  HIS 113           HD1      HIS 113 -11.464  -1.749   0.217
  895    HD2  HIS 113           HD2      HIS 113  -9.280  -2.060  -3.302
  896    HE1  HIS 113           HE1      HIS 113 -11.613   0.511  -0.866
  897    HE2  HIS 113           HE2      HIS 113 -10.220   0.324  -2.954
  898    H    CYS 114           HN       CYS 114 -11.227  -4.623   1.626
  899    HA   CYS 114           HA       CYS 114 -13.499  -2.795   1.859
  900   1HB   CYS 114          HB2       CYS 114 -14.467  -5.025   2.073
  901   2HB   CYS 114          HB1       CYS 114 -13.289  -5.441   3.316
  902    HG   CYS 114           HG       CYS 114 -14.766  -4.707   5.272
  903    H    CYS 115           HN       CYS 115 -11.773  -4.744   4.282
  904    HA   CYS 115           HA       CYS 115 -10.445  -2.328   5.272
  905   1HB   CYS 115          HB2       CYS 115 -12.101  -4.178   7.003
  906   2HB   CYS 115          HB1       CYS 115 -11.111  -2.847   7.590
  907    HG   CYS 115           HG       CYS 115 -13.085  -1.588   5.347
  908    H    THR 116           HN       THR 116  -9.196  -3.243   7.466
  909    HA   THR 116           HA       THR 116  -7.594  -5.498   6.452
  910    HB   THR 116           HB       THR 116  -6.762  -3.237   8.279
  911    HG1  THR 116           HG1      THR 116  -7.065  -2.808   5.962
  912   1HG2  THR 116          1HG2      THR 116  -4.486  -4.041   7.972
  913   2HG2  THR 116          2HG2      THR 116  -5.095  -5.433   7.076
  914   3HG2  THR 116          3HG2      THR 116  -5.491  -5.241   8.784
  915    H    ARG 117           HN       ARG 117  -6.645  -6.946   8.067
  916    HA   ARG 117           HA       ARG 117  -8.381  -7.184  10.437
  917   1HB   ARG 117          HB2       ARG 117  -8.655  -9.039   8.872
  918   2HB   ARG 117          HB1       ARG 117  -6.926  -9.346   8.906
  919   1HG   ARG 117          HG2       ARG 117  -8.145 -10.941  10.282
  920   2HG   ARG 117          HG1       ARG 117  -7.059  -9.949  11.258
  921   1HD   ARG 117          HD2       ARG 117  -9.218 -10.218  12.355
  922   2HD   ARG 117          HD1       ARG 117  -8.935  -8.533  11.917
  923    HE   ARG 117           HE       ARG 117 -10.358  -9.757   9.843
  924   1HH1  ARG 117          HH11      ARG 117 -10.815  -8.816  13.173
  925   2HH1  ARG 117          HH12      ARG 117 -12.521  -8.575  13.002
  926   1HH2  ARG 117          HH21      ARG 117 -12.603  -9.441   9.616
  927   2HH2  ARG 117          HH22      ARG 117 -13.537  -8.931  10.983
  928    H    VAL 118           HN       VAL 118  -6.856  -5.646  11.431
  929    HA   VAL 118           HA       VAL 118  -4.340  -6.920  12.271
  930    HB   VAL 118           HB       VAL 118  -3.554  -4.679  12.875
  931   1HG1  VAL 118          1HG1      VAL 118  -2.866  -4.233  10.782
  932   2HG1  VAL 118          2HG1      VAL 118  -4.509  -4.152  10.148
  933   3HG1  VAL 118          3HG1      VAL 118  -3.730  -5.717  10.381
  934   1HG2  VAL 118          1HG2      VAL 118  -5.374  -2.978  11.583
  935   2HG2  VAL 118          2HG2      VAL 118  -5.030  -3.073  13.310
  936   3HG2  VAL 118          3HG2      VAL 118  -6.341  -4.027  12.619
  937    H    ALA 119           HN       ALA 119  -3.745  -5.576  14.540
  938    HA   ALA 119           HA       ALA 119  -5.220  -6.893  16.501
  939   1HB   ALA 119          HB1       ALA 119  -3.751  -4.399  17.193
  940   2HB   ALA 119          HB2       ALA 119  -2.852  -5.776  16.558
  941   3HB   ALA 119          HB3       ALA 119  -3.800  -5.948  18.035
  942    H    LEU 120           HN       LEU 120  -5.892  -3.981  14.859
  943    HA   LEU 120           HA       LEU 120  -7.975  -3.303  16.826
  944   1HB   LEU 120          HB2       LEU 120  -6.630  -1.518  14.796
  945   2HB   LEU 120          HB1       LEU 120  -7.916  -1.025  15.881
  946    HG   LEU 120           HG       LEU 120  -5.146  -1.903  16.701
  947   1HD1  LEU 120          1HD1      LEU 120  -5.350   0.348  15.635
  948   2HD1  LEU 120          2HD1      LEU 120  -4.768   0.372  17.299
  949   3HD1  LEU 120          3HD1      LEU 120  -6.440   0.804  16.943
  950   1HD2  LEU 120          1HD2      LEU 120  -6.000  -0.970  18.943
  951   2HD2  LEU 120          2HD2      LEU 120  -6.504  -2.589  18.461
  952   3HD2  LEU 120          3HD2      LEU 120  -7.609  -1.228  18.268
  953    HA   PRO1135           HA       PRO1135  15.495 -11.142  -9.296
  954   1HB   PRO1135          HB2       PRO1135  16.895  -8.736 -10.366
  955   2HB   PRO1135          HB1       PRO1135  17.314 -10.446 -10.526
  956   1HG   PRO1135          HG2       PRO1135  16.236  -9.120 -12.567
  957   2HG   PRO1135          HG1       PRO1135  15.778 -10.800 -12.228
  958   1HD   PRO1135          HD2       PRO1135  14.271  -8.280 -11.701
  959   2HD   PRO1135          HD1       PRO1135  13.667  -9.881 -12.174
  960    H    GLN1136           HN       GLN1136  14.633  -7.769  -8.879
  961    HA   GLN1136           HA       GLN1136  15.180  -7.877  -6.078
  962   1HB   GLN1136          HB2       GLN1136  17.464  -7.517  -7.004
  963   2HB   GLN1136          HB1       GLN1136  16.896  -6.031  -7.751
  964   1HG   GLN1136          HG2       GLN1136  18.113  -5.581  -5.702
  965   2HG   GLN1136          HG1       GLN1136  16.427  -5.090  -5.556
  966    HA   PRO1137           HA       PRO1137  12.128  -4.709  -7.901
  967   1HB   PRO1137          HB2       PRO1137   9.860  -5.885  -6.914
  968   2HB   PRO1137          HB1       PRO1137  10.491  -6.160  -8.540
  969   1HG   PRO1137          HG2       PRO1137  10.746  -7.854  -6.096
  970   2HG   PRO1137          HG1       PRO1137  10.498  -8.341  -7.781
  971   1HD   PRO1137          HD2       PRO1137  12.908  -8.484  -6.547
  972   2HD   PRO1137          HD1       PRO1137  12.734  -8.184  -8.287
  973    H    GLU1138           HN       GLU1138  10.762  -6.285  -5.062
  974    HA   GLU1138           HA       GLU1138  10.787  -5.683  -2.835
  975   1HB   GLU1138          HB2       GLU1138  11.961  -3.011  -3.606
  976   2HB   GLU1138          HB1       GLU1138  11.817  -3.687  -1.996
  977   1HG   GLU1138          HG2       GLU1138  13.596  -4.694  -4.198
  978   2HG   GLU1138          HG1       GLU1138  14.091  -3.815  -2.754
  979   2HN   PTR1139          HN        PTR1139   9.941  -3.149  -5.208
  980   2HN   PTR1139          HN        PTR1139   9.941  -3.149  -5.208
  981    HA   PTR1139           HA       PTR1139   7.606  -2.612  -3.552
  982    HA   PTR1139           HA       PTR1139   7.606  -2.612  -3.552
  983   1HB   PTR1139          HB1       PTR1139   7.605  -0.430  -5.036
  984   1HB   PTR1139          HB1       PTR1139   7.605  -0.430  -5.036
  985   2HB   PTR1139          HB2       PTR1139   9.319  -0.845  -5.170
  986   2HB   PTR1139          HB2       PTR1139   9.319  -0.845  -5.170
  987    HD1  PTR1139           HD1      PTR1139   6.585  -0.150  -2.786
  988    HD1  PTR1139           HD1      PTR1139   6.585  -0.150  -2.786
  989    HD2  PTR1139           HD2      PTR1139  10.800  -0.504  -3.286
  990    HD2  PTR1139           HD2      PTR1139  10.800  -0.504  -3.286
  991    HE1  PTR1139           HE1      PTR1139   6.926   0.780  -0.551
  992    HE1  PTR1139           HE1      PTR1139   6.926   0.780  -0.551
  993    HE2  PTR1139           HE2      PTR1139  11.141   0.458  -1.010
  994    HE2  PTR1139           HE2      PTR1139  11.141   0.458  -1.010
  995    H    VAL1140           HN       VAL1140   7.421  -1.308  -6.754
  996    HA   VAL1140           HA       VAL1140   6.182  -3.519  -7.967
  997    HB   VAL1140           HB       VAL1140   4.575  -2.885  -5.970
  998   1HG1  VAL1140          1HG1      VAL1140   4.219  -0.568  -6.587
  999   2HG1  VAL1140          2HG1      VAL1140   2.712  -1.478  -6.629
 1000   3HG1  VAL1140          3HG1      VAL1140   3.536  -1.074  -8.134
 1001   1HG2  VAL1140          1HG2      VAL1140   4.228  -4.716  -7.537
 1002   2HG2  VAL1140          2HG2      VAL1140   3.569  -3.585  -8.721
 1003   3HG2  VAL1140          3HG2      VAL1140   2.713  -3.875  -7.206
 1004    H    ASN1141           HN       ASN1141   5.448   0.049  -7.864
 1005    HA   ASN1141           HA       ASN1141   4.764   0.267 -10.534
 1006   1HB   ASN1141          HB2       ASN1141   6.805   2.180  -9.385
 1007   2HB   ASN1141          HB1       ASN1141   5.592   2.486 -10.603
 1008   1HD2  ASN1141          1HD2      ASN1141   5.598   1.324  -7.196
 1009   2HD2  ASN1141          2HD2      ASN1141   4.368   2.428  -6.682
 1010    H    GLN1142           HN       GLN1142   7.650  -0.323  -8.803
 1011    HA   GLN1142           HA       GLN1142   8.751  -2.154 -10.394
 1012   1HB   GLN1142          HB2       GLN1142  10.410  -1.181 -11.700
 1013   2HB   GLN1142          HB1       GLN1142   9.079  -0.074 -11.915
 1014   1HG   GLN1142          HG2       GLN1142  11.294   0.382  -9.939
 1015   2HG   GLN1142          HG1       GLN1142  11.348   0.962 -11.596
 1016    HA   PRO1143           HA       PRO1143  11.397  -2.280  -6.897
 1017   1HB   PRO1143          HB2       PRO1143  14.045  -1.758  -8.017
 1018   2HB   PRO1143          HB1       PRO1143  13.387  -3.282  -7.431
 1019   1HG   PRO1143          HG2       PRO1143  13.904  -2.750 -10.067
 1020   2HG   PRO1143          HG1       PRO1143  12.710  -3.932  -9.512
 1021   1HD   PRO1143          HD2       PRO1143  12.304  -1.175 -10.565
 1022   2HD   PRO1143          HD1       PRO1143  11.285  -2.618 -10.744
 1023    H    ASP1144           HN       ASP1144  10.252  -0.021  -6.997
 1024    HA   ASP1144           HA       ASP1144  10.226   2.225  -6.740
 1025   1HB   ASP1144          HB2       ASP1144  11.243   2.880  -4.581
 1026   2HB   ASP1144          HB1       ASP1144  10.359   1.363  -4.473
  Start of MODEL    3
    1   1H    GLY   1          HT1       GLY   1  21.192   0.424   1.005
    2   2H    GLY   1          HT2       GLY   1  22.357   1.109   2.021
    3   3H    GLY   1          HT3       GLY   1  21.850   1.938   0.637
    4   1HA   GLY   1          HA1       GLY   1  20.620   1.764   3.247
    5   2HA   GLY   1          HA2       GLY   1  20.523   3.042   2.045
    6    H    SER   2           HN       SER   2  19.508  -0.356   2.413
    7    HA   SER   2           HA       SER   2  16.779   0.409   1.823
    8   1HB   SER   2          HB2       SER   2  17.539   0.063  -0.418
    9   2HB   SER   2          HB1       SER   2  18.330  -1.449   0.013
   10    HG   SER   2           HG       SER   2  16.440  -2.091  -0.829
   11    HA   PRO   3           HA       PRO   3  16.736  -4.261   3.191
   12   1HB   PRO   3          HB2       PRO   3  19.202  -5.232   3.974
   13   2HB   PRO   3          HB1       PRO   3  18.453  -5.539   2.403
   14   1HG   PRO   3          HG2       PRO   3  20.522  -3.512   3.154
   15   2HG   PRO   3          HG1       PRO   3  20.422  -4.529   1.703
   16   1HD   PRO   3          HD2       PRO   3  19.715  -1.955   1.631
   17   2HD   PRO   3          HD1       PRO   3  18.810  -3.178   0.718
   18    H    ALA   4           HN       ALA   4  19.023  -1.970   4.550
   19    HA   ALA   4           HA       ALA   4  17.852  -2.463   7.201
   20   1HB   ALA   4          HB1       ALA   4  20.345  -3.301   6.633
   21   2HB   ALA   4          HB2       ALA   4  19.833  -2.772   8.235
   22   3HB   ALA   4          HB3       ALA   4  20.686  -1.656   7.169
   23    H    SER   5           HN       SER   5  18.267  -0.625   8.723
   24    HA   SER   5           HA       SER   5  18.773   1.948   7.470
   25   1HB   SER   5          HB2       SER   5  16.636   2.912   8.250
   26   2HB   SER   5          HB1       SER   5  16.380   1.630   7.067
   27    HG   SER   5           HG       SER   5  16.126   0.230   8.994
   28    H    GLY   6           HN       GLY   6  19.199   3.626   8.962
   29   1HA   GLY   6          HA2       GLY   6  19.858   2.620  11.651
   30   2HA   GLY   6          HA1       GLY   6  20.655   3.967  10.851
   31    H    THR   7           HN       THR   7  18.585   5.524  10.033
   32    HA   THR   7           HA       THR   7  17.853   6.856  12.412
   33    HB   THR   7           HB       THR   7  16.487   8.295  10.940
   34    HG1  THR   7           HG1      THR   7  16.159   7.786   8.854
   35   1HG2  THR   7          1HG2      THR   7  19.302   7.730  10.457
   36   2HG2  THR   7          2HG2      THR   7  18.467   9.270  10.661
   37   3HG2  THR   7          3HG2      THR   7  18.480   8.475   9.086
   38    H    SER   8           HN       SER   8  15.924   6.997  13.508
   39    HA   SER   8           HA       SER   8  13.636   5.451  12.603
   40   1HB   SER   8          HB2       SER   8  13.463   4.192  14.722
   41   2HB   SER   8          HB1       SER   8  14.936   3.787  13.841
   42    HG   SER   8           HG       SER   8  16.124   4.773  15.329
   43    H    LEU   9           HN       LEU   9  11.954   6.754  12.839
   44    HA   LEU   9           HA       LEU   9  11.910   8.596  15.139
   45   1HB   LEU   9          HB2       LEU   9  10.697   8.956  12.397
   46   2HB   LEU   9          HB1       LEU   9  10.469  10.058  13.741
   47    HG   LEU   9           HG       LEU   9  12.911  10.504  13.750
   48   1HD1  LEU   9          1HD1      LEU   9  14.096   8.823  12.815
   49   2HD1  LEU   9          2HD1      LEU   9  13.895   9.804  11.363
   50   3HD1  LEU   9          3HD1      LEU   9  12.831   8.428  11.651
   51   1HD2  LEU   9          1HD2      LEU   9  11.450  11.002  11.161
   52   2HD2  LEU   9          2HD2      LEU   9  12.926  11.828  11.661
   53   3HD2  LEU   9          3HD2      LEU   9  11.443  12.027  12.596
   54    H    SER  10           HN       SER  10   9.434   9.409  15.330
   55    HA   SER  10           HA       SER  10   8.004   7.062  16.185
   56   1HB   SER  10          HB2       SER  10   7.973   9.090  17.558
   57   2HB   SER  10          HB1       SER  10   7.211   9.985  16.244
   58    HG   SER  10           HG       SER  10   6.129   8.109  17.988
   59    H    ALA  11           HN       ALA  11   6.010   6.332  15.446
   60    HA   ALA  11           HA       ALA  11   4.879   7.550  13.049
   61   1HB   ALA  11          HB1       ALA  11   5.869   4.705  13.144
   62   2HB   ALA  11          HB2       ALA  11   6.447   6.003  12.099
   63   3HB   ALA  11          HB3       ALA  11   4.822   5.354  11.882
   64    H    ALA  12           HN       ALA  12   3.258   8.024  14.718
   65    HA   ALA  12           HA       ALA  12   1.247   5.928  14.782
   66   1HB   ALA  12          HB1       ALA  12   0.928   5.913  17.129
   67   2HB   ALA  12          HB2       ALA  12   2.038   7.263  17.360
   68   3HB   ALA  12          HB3       ALA  12   2.657   5.690  16.861
   69    H    ILE  13           HN       ILE  13   0.981   8.019  13.212
   70    HA   ILE  13           HA       ILE  13  -0.280  10.255  14.519
   71    HB   ILE  13           HB       ILE  13   1.001  10.556  12.438
   72   1HG1  ILE  13          2HG1      ILE  13  -1.938  11.238  12.179
   73   2HG1  ILE  13          1HG1      ILE  13  -0.734  12.184  13.044
   74   1HG2  ILE  13          1HG2      ILE  13  -0.785   8.462  11.508
   75   2HG2  ILE  13          2HG2      ILE  13   0.766   8.998  10.863
   76   3HG2  ILE  13          3HG2      ILE  13  -0.716   9.836  10.404
   77   1HD1  ILE  13          1HD1      ILE  13  -1.513  12.550  10.447
   78   2HD1  ILE  13          2HD1      ILE  13   0.003  11.665  10.281
   79   3HD1  ILE  13          3HD1      ILE  13  -0.040  13.181  11.182
   80    H    HIS  14           HN       HIS  14  -1.721   8.385  15.530
   81    HA   HIS  14           HA       HIS  14  -4.235   8.399  14.000
   82   1HB   HIS  14          HB2       HIS  14  -3.276   6.091  15.701
   83   2HB   HIS  14          HB1       HIS  14  -4.740   6.147  14.726
   84    HD1  HIS  14           HD1      HIS  14  -1.034   6.653  14.018
   85    HD2  HIS  14           HD2      HIS  14  -4.379   4.756  12.450
   86    HE1  HIS  14           HE1      HIS  14  -0.228   5.482  11.950
   87    HE2  HIS  14           HE2      HIS  14  -2.249   4.260  11.066
   88    H    ARG  15           HN       ARG  15  -5.990   9.053  15.123
   89    HA   ARG  15           HA       ARG  15  -5.697   9.296  18.030
   90   1HB   ARG  15          HB2       ARG  15  -7.174  11.276  17.928
   91   2HB   ARG  15          HB1       ARG  15  -5.665  11.501  17.048
   92   1HG   ARG  15          HG2       ARG  15  -6.783  11.123  14.940
   93   2HG   ARG  15          HG1       ARG  15  -8.285  10.721  15.768
   94   1HD   ARG  15          HD2       ARG  15  -6.926  13.419  15.629
   95   2HD   ARG  15          HD1       ARG  15  -8.476  12.951  14.934
   96    HE   ARG  15           HE       ARG  15  -8.642  12.527  17.678
   97   1HH1  ARG  15          HH11      ARG  15  -8.255  15.198  15.466
   98   2HH1  ARG  15          HH12      ARG  15  -9.041  16.337  16.506
   99   1HH2  ARG  15          HH21      ARG  15  -9.674  14.023  19.049
  100   2HH2  ARG  15          HH22      ARG  15  -9.846  15.670  18.542
  101    H    THR  16           HN       THR  16  -7.183   7.640  15.759
  102    HA   THR  16           HA       THR  16  -9.376   6.906  17.531
  103    HB   THR  16           HB       THR  16 -10.985   6.846  15.657
  104    HG1  THR  16           HG1      THR  16 -10.433   7.765  13.698
  105   1HG2  THR  16          1HG2      THR  16 -10.138   9.128  16.985
  106   2HG2  THR  16          2HG2      THR  16 -11.644   8.911  16.093
  107   3HG2  THR  16          3HG2      THR  16 -10.234   9.601  15.289
  108    H    GLN  17           HN       GLN  17  -9.335   5.817  14.240
  109    HA   GLN  17           HA       GLN  17  -7.756   3.462  14.814
  110   1HB   GLN  17          HB2       GLN  17  -9.658   1.972  14.006
  111   2HB   GLN  17          HB1       GLN  17  -9.803   2.619  15.633
  112   1HG   GLN  17          HG2       GLN  17 -11.927   2.742  14.522
  113   2HG   GLN  17          HG1       GLN  17 -11.304   4.370  14.781
  114    H    LEU  18           HN       LEU  18  -7.324   5.602  13.092
  115    HA   LEU  18           HA       LEU  18  -8.177   5.367  10.472
  116   1HB   LEU  18          HB2       LEU  18  -5.393   6.152  11.320
  117   2HB   LEU  18          HB1       LEU  18  -6.225   6.630   9.854
  118    HG   LEU  18           HG       LEU  18  -6.914   7.485  12.664
  119   1HD1  LEU  18          1HD1      LEU  18  -4.892   8.476  11.449
  120   2HD1  LEU  18          2HD1      LEU  18  -6.087   9.593  12.110
  121   3HD1  LEU  18          3HD1      LEU  18  -6.072   9.237  10.382
  122   1HD2  LEU  18          1HD2      LEU  18  -8.873   7.131  11.101
  123   2HD2  LEU  18          2HD2      LEU  18  -8.206   8.439  10.124
  124   3HD2  LEU  18          3HD2      LEU  18  -8.701   8.745  11.789
  125    H    TRP  19           HN       TRP  19  -6.361   4.926   8.670
  126    HA   TRP  19           HA       TRP  19  -5.178   2.277   9.169
  127   1HB   TRP  19          HB2       TRP  19  -6.626   3.033   6.623
  128   2HB   TRP  19          HB1       TRP  19  -5.929   1.467   7.017
  129    HD1  TRP  19           HD1      TRP  19  -7.551  -0.258   7.996
  130    HE1  TRP  19           HE1      TRP  19  -9.937  -0.191   8.958
  131    HE3  TRP  19           HE3      TRP  19  -8.255   4.805   8.068
  132    HZ2  TRP  19           HZ2      TRP  19 -11.864   1.750   9.648
  133    HZ3  TRP  19           HZ3      TRP  19 -10.400   5.685   8.890
  134    HH2  TRP  19           HH2      TRP  19 -12.167   4.188   9.663
  135    H    PHE  20           HN       PHE  20  -4.018   4.980   9.080
  136    HA   PHE  20           HA       PHE  20  -2.242   4.622   6.761
  137   1HB   PHE  20          HB2       PHE  20  -3.593   6.612   6.452
  138   2HB   PHE  20          HB1       PHE  20  -3.153   7.199   8.051
  139    HD1  PHE  20           HD1      PHE  20  -1.945   9.137   7.761
  140    HD2  PHE  20           HD2      PHE  20  -1.072   5.773   5.308
  141    HE1  PHE  20           HE1      PHE  20  -0.033  10.344   6.793
  142    HE2  PHE  20           HE2      PHE  20   0.842   6.972   4.336
  143    HZ   PHE  20           HZ       PHE  20   1.364   9.262   5.078
  144    H    HIS  21           HN       HIS  21  -0.255   4.084   7.278
  145    HA   HIS  21           HA       HIS  21   1.013   5.279   9.637
  146   1HB   HIS  21          HB2       HIS  21   0.112   3.039  10.273
  147   2HB   HIS  21          HB1       HIS  21   1.115   2.314   9.022
  148    HD1  HIS  21           HD1      HIS  21   3.822   2.958   9.400
  149    HD2  HIS  21           HD2      HIS  21   1.288   3.026  12.690
  150    HE1  HIS  21           HE1      HIS  21   5.326   2.845  11.411
  151    HE2  HIS  21           HE2      HIS  21   3.766   2.782  13.386
  152    H    GLY  22           HN       GLY  22   3.400   5.265   9.515
  153   1HA   GLY  22          HA2       GLY  22   4.273   5.202   6.722
  154   2HA   GLY  22          HA1       GLY  22   5.059   6.067   8.027
  155    H    ARG  23           HN       ARG  23   6.598   5.109   9.183
  156    HA   ARG  23           HA       ARG  23   8.220   3.223   8.137
  157   1HB   ARG  23          HB2       ARG  23   8.874   4.656   9.979
  158   2HB   ARG  23          HB1       ARG  23   7.782   3.818  11.063
  159   1HG   ARG  23          HG2       ARG  23  10.097   3.140  11.409
  160   2HG   ARG  23          HG1       ARG  23   9.098   1.791  10.867
  161   1HD   ARG  23          HD2       ARG  23   9.928   2.125   8.575
  162   2HD   ARG  23          HD1       ARG  23  10.954   3.437   9.152
  163    HE   ARG  23           HE       ARG  23  11.527   1.150  10.653
  164   1HH1  ARG  23          HH11      ARG  23  11.856   2.320   7.381
  165   2HH1  ARG  23          HH12      ARG  23  13.262   1.365   7.050
  166   1HH2  ARG  23          HH21      ARG  23  13.376  -0.106  10.218
  167   2HH2  ARG  23          HH22      ARG  23  14.125  -0.012   8.659
  168    H    ILE  24           HN       ILE  24   7.390   1.344   7.383
  169    HA   ILE  24           HA       ILE  24   6.996  -0.729   9.334
  170    HB   ILE  24           HB       ILE  24   4.695   0.070   9.124
  171   1HG1  ILE  24          2HG1      ILE  24   5.177  -2.589   7.771
  172   2HG1  ILE  24          1HG1      ILE  24   5.077  -2.314   9.504
  173   1HG2  ILE  24          1HG2      ILE  24   4.463  -0.822   6.320
  174   2HG2  ILE  24          2HG2      ILE  24   5.242   0.732   6.611
  175   3HG2  ILE  24          3HG2      ILE  24   3.599   0.448   7.184
  176   1HD1  ILE  24          1HD1      ILE  24   2.738  -1.360   8.064
  177   2HD1  ILE  24          2HD1      ILE  24   2.855  -2.395   9.488
  178   3HD1  ILE  24          3HD1      ILE  24   3.020  -3.090   7.876
  179    H    SER  25           HN       SER  25   8.896  -1.496   8.459
  180    HA   SER  25           HA       SER  25   9.857  -1.813   6.010
  181   1HB   SER  25          HB2       SER  25   9.795  -4.012   8.083
  182   2HB   SER  25          HB1       SER  25  10.903  -3.939   6.712
  183    HG   SER  25           HG       SER  25  11.695  -3.092   8.784
  184    H    ARG  26           HN       ARG  26   9.006  -2.353   4.140
  185    HA   ARG  26           HA       ARG  26   6.661  -3.823   3.791
  186   1HB   ARG  26          HB2       ARG  26   6.923  -2.671   1.882
  187   2HB   ARG  26          HB1       ARG  26   8.655  -2.555   2.088
  188   1HG   ARG  26          HG2       ARG  26   7.475  -5.128   1.149
  189   2HG   ARG  26          HG1       ARG  26   7.613  -3.780   0.027
  190   1HD   ARG  26          HD2       ARG  26   9.931  -4.870   1.618
  191   2HD   ARG  26          HD1       ARG  26   9.521  -5.423   0.001
  192    HE   ARG  26           HE       ARG  26  10.360  -3.454  -0.870
  193   1HH1  ARG  26          HH11      ARG  26  10.331  -3.283   2.625
  194   2HH1  ARG  26          HH12      ARG  26  11.197  -1.787   2.678
  195   1HH2  ARG  26          HH21      ARG  26  11.503  -1.495  -0.785
  196   2HH2  ARG  26          HH22      ARG  26  11.863  -0.774   0.748
  197    H    GLU  27           HN       GLU  27  10.039  -4.880   3.587
  198    HA   GLU  27           HA       GLU  27   9.502  -7.495   2.716
  199   1HB   GLU  27          HB2       GLU  27  11.752  -8.040   3.555
  200   2HB   GLU  27          HB1       GLU  27  11.743  -6.555   2.618
  201   1HG   GLU  27          HG2       GLU  27  13.105  -6.043   4.409
  202   2HG   GLU  27          HG1       GLU  27  11.549  -5.368   4.888
  203    H    GLU  28           HN       GLU  28   9.645  -6.067   5.934
  204    HA   GLU  28           HA       GLU  28   9.225  -8.589   7.271
  205   1HB   GLU  28          HB2       GLU  28  10.437  -6.420   8.120
  206   2HB   GLU  28          HB1       GLU  28   8.814  -5.922   8.576
  207   1HG   GLU  28          HG2       GLU  28  10.277  -8.374   9.524
  208   2HG   GLU  28          HG1       GLU  28   9.934  -6.918  10.457
  209    H    SER  29           HN       SER  29   7.301  -5.973   6.046
  210    HA   SER  29           HA       SER  29   4.956  -6.312   7.529
  211   1HB   SER  29          HB2       SER  29   5.358  -5.364   4.690
  212   2HB   SER  29          HB1       SER  29   3.836  -5.225   5.570
  213    HG   SER  29           HG       SER  29   4.894  -3.317   5.859
  214    H    GLN  30           HN       GLN  30   5.924  -7.762   4.431
  215    HA   GLN  30           HA       GLN  30   3.565  -9.235   4.053
  216   1HB   GLN  30          HB2       GLN  30   4.865 -10.555   2.433
  217   2HB   GLN  30          HB1       GLN  30   5.092  -8.826   2.222
  218   1HG   GLN  30          HG2       GLN  30   7.227  -8.985   3.429
  219   2HG   GLN  30          HG1       GLN  30   7.002 -10.728   3.554
  220    H    ARG  31           HN       ARG  31   6.093  -9.683   6.286
  221    HA   ARG  31           HA       ARG  31   5.908 -12.525   6.518
  222   1HB   ARG  31          HB2       ARG  31   7.903 -11.251   7.244
  223   2HB   ARG  31          HB1       ARG  31   6.944 -10.494   8.506
  224   1HG   ARG  31          HG2       ARG  31   8.204 -12.216   9.523
  225   2HG   ARG  31          HG1       ARG  31   6.534 -12.778   9.443
  226   1HD   ARG  31          HD2       ARG  31   8.656 -13.498   7.427
  227   2HD   ARG  31          HD1       ARG  31   8.253 -14.491   8.824
  228    HE   ARG  31           HE       ARG  31   6.847 -14.377   6.375
  229   1HH1  ARG  31          HH11      ARG  31   6.338 -14.675   9.816
  230   2HH1  ARG  31          HH12      ARG  31   4.826 -15.501   9.646
  231   1HH2  ARG  31          HH21      ARG  31   4.860 -15.465   6.152
  232   2HH2  ARG  31          HH22      ARG  31   3.987 -15.951   7.567
  233    H    LEU  32           HN       LEU  32   4.573  -9.769   8.315
  234    HA   LEU  32           HA       LEU  32   3.006 -11.516  10.019
  235   1HB   LEU  32          HB2       LEU  32   3.139  -8.513   9.788
  236   2HB   LEU  32          HB1       LEU  32   2.104  -9.355  10.924
  237    HG   LEU  32           HG       LEU  32   4.099 -10.343  11.990
  238   1HD1  LEU  32          1HD1      LEU  32   5.746 -10.461  10.368
  239   2HD1  LEU  32          2HD1      LEU  32   6.291  -9.122  11.378
  240   3HD1  LEU  32          3HD1      LEU  32   5.490  -8.798   9.841
  241   1HD2  LEU  32          1HD2      LEU  32   3.357  -8.462  13.116
  242   2HD2  LEU  32          2HD2      LEU  32   3.775  -7.376  11.790
  243   3HD2  LEU  32          3HD2      LEU  32   5.048  -8.071  12.795
  244    H    ILE  33           HN       ILE  33   2.261  -8.967   7.634
  245    HA   ILE  33           HA       ILE  33  -0.529  -9.529   7.617
  246    HB   ILE  33           HB       ILE  33   1.187  -7.970   5.680
  247   1HG1  ILE  33          2HG1      ILE  33   0.038  -6.021   6.723
  248   2HG1  ILE  33          1HG1      ILE  33  -0.742  -7.122   7.853
  249   1HG2  ILE  33          1HG2      ILE  33  -1.198  -7.018   5.105
  250   2HG2  ILE  33          2HG2      ILE  33  -1.717  -8.621   5.625
  251   3HG2  ILE  33          3HG2      ILE  33  -0.570  -8.453   4.296
  252   1HD1  ILE  33          1HD1      ILE  33   2.239  -6.935   7.625
  253   2HD1  ILE  33          2HD1      ILE  33   1.272  -7.602   8.940
  254   3HD1  ILE  33          3HD1      ILE  33   1.303  -5.860   8.663
  255    H    GLY  34           HN       GLY  34   2.069 -11.229   6.315
  256   1HA   GLY  34          HA2       GLY  34   0.503 -12.235   4.053
  257   2HA   GLY  34          HA1       GLY  34   2.206 -12.555   4.350
  258    H    GLN  35           HN       GLN  35  -0.047 -12.763   6.917
  259    HA   GLN  35           HA       GLN  35   0.143 -15.688   6.881
  260   1HB   GLN  35          HB2       GLN  35  -0.049 -15.688   9.241
  261   2HB   GLN  35          HB1       GLN  35   1.081 -14.391   8.884
  262   1HG   GLN  35          HG2       GLN  35  -0.283 -13.452  10.485
  263   2HG   GLN  35          HG1       GLN  35  -0.999 -12.865   8.984
  264    H    GLN  36           HN       GLN  36  -1.856 -12.991   6.357
  265    HA   GLN  36           HA       GLN  36  -4.330 -14.113   7.221
  266   1HB   GLN  36          HB2       GLN  36  -3.493 -11.714   5.705
  267   2HB   GLN  36          HB1       GLN  36  -5.121 -12.299   5.389
  268   1HG   GLN  36          HG2       GLN  36  -5.832 -11.300   7.221
  269   2HG   GLN  36          HG1       GLN  36  -4.757 -12.305   8.188
  270    H    GLY  37           HN       GLY  37  -5.753 -15.390   6.130
  271   1HA   GLY  37          HA2       GLY  37  -4.850 -16.396   3.520
  272   2HA   GLY  37          HA1       GLY  37  -5.972 -17.213   4.605
  273    H    LEU  38           HN       LEU  38  -6.456 -13.842   4.102
  274    HA   LEU  38           HA       LEU  38  -9.003 -14.362   2.868
  275   1HB   LEU  38          HB2       LEU  38  -7.624 -11.776   3.582
  276   2HB   LEU  38          HB1       LEU  38  -9.251 -11.887   2.941
  277    HG   LEU  38           HG       LEU  38  -9.336 -11.566   5.334
  278   1HD1  LEU  38          1HD1      LEU  38 -10.759 -13.392   3.977
  279   2HD1  LEU  38          2HD1      LEU  38 -11.012 -13.031   5.685
  280   3HD1  LEU  38          3HD1      LEU  38 -10.042 -14.425   5.213
  281   1HD2  LEU  38          1HD2      LEU  38  -8.294 -12.950   6.913
  282   2HD2  LEU  38          2HD2      LEU  38  -7.055 -12.645   5.696
  283   3HD2  LEU  38          3HD2      LEU  38  -7.915 -14.184   5.711
  284    H    VAL  39           HN       VAL  39  -9.640 -12.753   1.046
  285    HA   VAL  39           HA       VAL  39  -7.984 -13.375  -1.218
  286    HB   VAL  39           HB       VAL  39  -9.753 -12.296  -2.545
  287   1HG1  VAL  39          1HG1      VAL  39 -11.243 -14.036  -2.352
  288   2HG1  VAL  39          2HG1      VAL  39 -11.196 -14.023  -0.589
  289   3HG1  VAL  39          3HG1      VAL  39  -9.848 -14.702  -1.503
  290   1HG2  VAL  39          1HG2      VAL  39 -10.440 -11.215   0.072
  291   2HG2  VAL  39          2HG2      VAL  39 -11.830 -11.906  -0.769
  292   3HG2  VAL  39          3HG2      VAL  39 -10.874 -10.641  -1.540
  293    H    ASP  40           HN       ASP  40  -7.905 -11.538  -2.963
  294    HA   ASP  40           HA       ASP  40  -6.049  -9.609  -2.018
  295   1HB   ASP  40          HB2       ASP  40  -7.607  -9.529  -4.608
  296   2HB   ASP  40          HB1       ASP  40  -6.091  -8.719  -4.265
  297    H    GLY  41           HN       GLY  41  -8.027  -9.304  -0.344
  298   1HA   GLY  41          HA2       GLY  41  -9.253  -6.727  -1.184
  299   2HA   GLY  41          HA1       GLY  41 -10.204  -7.947  -0.342
  300    H    LEU  42           HN       LEU  42  -7.343  -8.309   1.063
  301    HA   LEU  42           HA       LEU  42  -8.071  -6.440   3.182
  302   1HB   LEU  42          HB2       LEU  42  -6.324  -8.895   3.165
  303   2HB   LEU  42          HB1       LEU  42  -6.442  -7.820   4.541
  304    HG   LEU  42           HG       LEU  42  -7.847  -9.894   4.685
  305   1HD1  LEU  42          1HD1      LEU  42  -8.304  -7.554   5.762
  306   2HD1  LEU  42          2HD1      LEU  42  -9.508  -8.838   5.862
  307   3HD1  LEU  42          3HD1      LEU  42  -9.688  -7.552   4.669
  308   1HD2  LEU  42          1HD2      LEU  42  -9.839 -10.091   3.388
  309   2HD2  LEU  42          2HD2      LEU  42  -8.485  -9.905   2.275
  310   3HD2  LEU  42          3HD2      LEU  42  -9.549  -8.539   2.605
  311    H    PHE  43           HN       PHE  43  -7.283  -4.571   2.517
  312    HA   PHE  43           HA       PHE  43  -4.369  -4.424   2.113
  313   1HB   PHE  43          HB2       PHE  43  -4.660  -2.630   0.544
  314   2HB   PHE  43          HB1       PHE  43  -5.692  -3.965   0.048
  315    HD1  PHE  43           HD1      PHE  43  -7.566  -2.895   2.613
  316    HD2  PHE  43           HD2      PHE  43  -6.148  -1.405  -1.112
  317    HE1  PHE  43           HE1      PHE  43  -9.448  -1.327   2.532
  318    HE2  PHE  43           HE2      PHE  43  -8.038   0.165  -1.200
  319    HZ   PHE  43           HZ       PHE  43  -9.689   0.207   0.625
  320    H    LEU  44           HN       LEU  44  -3.336  -2.400   2.668
  321    HA   LEU  44           HA       LEU  44  -4.740  -0.711   4.602
  322   1HB   LEU  44          HB2       LEU  44  -3.569  -2.449   5.915
  323   2HB   LEU  44          HB1       LEU  44  -2.060  -2.004   5.144
  324    HG   LEU  44           HG       LEU  44  -2.255   0.272   6.173
  325   1HD1  LEU  44          1HD1      LEU  44  -4.867  -0.316   6.527
  326   2HD1  LEU  44          2HD1      LEU  44  -3.997   0.919   7.436
  327   3HD1  LEU  44          3HD1      LEU  44  -4.233  -0.685   8.130
  328   1HD2  LEU  44          1HD2      LEU  44  -2.417  -1.764   8.358
  329   2HD2  LEU  44          2HD2      LEU  44  -1.328  -0.387   8.183
  330   3HD2  LEU  44          3HD2      LEU  44  -1.099  -1.825   7.188
  331    H    VAL  45           HN       VAL  45  -3.952   1.430   4.647
  332    HA   VAL  45           HA       VAL  45  -2.072   2.022   2.465
  333    HB   VAL  45           HB       VAL  45  -3.937   3.897   3.936
  334   1HG1  VAL  45          1HG1      VAL  45  -1.848   4.953   3.079
  335   2HG1  VAL  45          2HG1      VAL  45  -3.317   5.561   2.315
  336   3HG1  VAL  45          3HG1      VAL  45  -2.290   4.410   1.459
  337   1HG2  VAL  45          1HG2      VAL  45  -5.125   3.945   1.740
  338   2HG2  VAL  45          2HG2      VAL  45  -5.203   2.390   2.569
  339   3HG2  VAL  45          3HG2      VAL  45  -4.095   2.613   1.213
  340    H    ARG  46           HN       ARG  46  -0.153   1.605   3.426
  341    HA   ARG  46           HA       ARG  46   0.606   3.446   5.588
  342   1HB   ARG  46          HB2       ARG  46   2.047   1.750   6.541
  343   2HB   ARG  46          HB1       ARG  46   0.422   1.097   6.408
  344   1HG   ARG  46          HG2       ARG  46   1.966  -0.601   5.761
  345   2HG   ARG  46          HG1       ARG  46   1.125  -0.051   4.310
  346   1HD   ARG  46          HD2       ARG  46   2.978   1.110   3.528
  347   2HD   ARG  46          HD1       ARG  46   3.737   1.161   5.112
  348    HE   ARG  46           HE       ARG  46   3.447  -1.440   3.831
  349   1HH1  ARG  46          HH11      ARG  46   5.491   1.224   4.780
  350   2HH1  ARG  46          HH12      ARG  46   6.960   0.401   4.392
  351   1HH2  ARG  46          HH21      ARG  46   5.408  -2.501   3.292
  352   2HH2  ARG  46          HH22      ARG  46   6.909  -1.679   3.557
  353    H    GLU  47           HN       GLU  47   3.171   3.624   5.625
  354    HA   GLU  47           HA       GLU  47   4.121   3.406   2.883
  355   1HB   GLU  47          HB2       GLU  47   4.843   5.740   2.842
  356   2HB   GLU  47          HB1       GLU  47   3.106   5.593   2.959
  357   1HG   GLU  47          HG2       GLU  47   3.239   6.053   5.357
  358   2HG   GLU  47          HG1       GLU  47   4.986   6.239   5.215
  359    H    SER  48           HN       SER  48   6.380   5.155   3.412
  360    HA   SER  48           HA       SER  48   7.794   3.636   5.458
  361   1HB   SER  48          HB2       SER  48   9.715   3.310   3.963
  362   2HB   SER  48          HB1       SER  48   8.279   2.530   3.305
  363    HG   SER  48           HG       SER  48   8.885   3.621   1.591
  364    H    GLN  49           HN       GLN  49   9.192   4.814   6.595
  365    HA   GLN  49           HA       GLN  49   9.387   7.646   5.886
  366   1HB   GLN  49          HB2       GLN  49   9.901   8.059   8.196
  367   2HB   GLN  49          HB1       GLN  49   8.526   6.954   8.160
  368   1HG   GLN  49          HG2       GLN  49   9.966   6.196   9.858
  369   2HG   GLN  49          HG1       GLN  49  10.155   5.081   8.507
  370    H    ARG  50           HN       ARG  50  10.879   5.114   4.936
  371    HA   ARG  50           HA       ARG  50  13.627   6.046   5.360
  372   1HB   ARG  50          HB2       ARG  50  13.242   3.729   6.047
  373   2HB   ARG  50          HB1       ARG  50  12.599   3.348   4.457
  374   1HG   ARG  50          HG2       ARG  50  14.837   2.517   4.615
  375   2HG   ARG  50          HG1       ARG  50  14.811   3.868   3.480
  376   1HD   ARG  50          HD2       ARG  50  15.576   4.155   6.379
  377   2HD   ARG  50          HD1       ARG  50  16.744   3.824   5.102
  378    HE   ARG  50           HE       ARG  50  15.292   6.064   4.331
  379   1HH1  ARG  50          HH11      ARG  50  17.489   5.146   6.881
  380   2HH1  ARG  50          HH12      ARG  50  18.114   6.746   7.090
  381   1HH2  ARG  50          HH21      ARG  50  16.113   8.171   4.604
  382   2HH2  ARG  50          HH22      ARG  50  17.332   8.464   5.798
  383    H    ASN  51           HN       ASN  51  11.190   5.203   2.926
  384    HA   ASN  51           HA       ASN  51  13.022   5.690   0.750
  385   1HB   ASN  51          HB2       ASN  51  10.016   5.380   0.709
  386   2HB   ASN  51          HB1       ASN  51  11.093   5.297  -0.683
  387   1HD2  ASN  51          1HD2      ASN  51  12.878   3.909   1.630
  388   2HD2  ASN  51          2HD2      ASN  51  12.377   2.268   1.467
  389    HA   PRO  52           HA       PRO  52  12.904  10.187   0.857
  390   1HB   PRO  52          HB2       PRO  52  12.913   9.639  -2.093
  391   2HB   PRO  52          HB1       PRO  52  13.841  10.831  -1.175
  392   1HG   PRO  52          HG2       PRO  52  14.946   8.524  -1.977
  393   2HG   PRO  52          HG1       PRO  52  15.368   9.269  -0.425
  394   1HD   PRO  52          HD2       PRO  52  13.800   6.831  -0.971
  395   2HD   PRO  52          HD1       PRO  52  14.648   7.319   0.508
  396    H    GLN  53           HN       GLN  53  10.943   8.203  -1.251
  397    HA   GLN  53           HA       GLN  53   8.665  10.024  -0.876
  398   1HB   GLN  53          HB2       GLN  53   9.307   8.410  -3.357
  399   2HB   GLN  53          HB1       GLN  53   7.879   9.404  -3.120
  400   1HG   GLN  53          HG2       GLN  53   9.285  11.395  -2.978
  401   2HG   GLN  53          HG1       GLN  53  10.717  10.398  -3.218
  402    H    GLY  54           HN       GLY  54   8.292   8.624   0.995
  403   1HA   GLY  54          HA2       GLY  54   7.589   5.866   0.351
  404   2HA   GLY  54          HA1       GLY  54   7.840   6.519   1.955
  405    H    PHE  55           HN       PHE  55   5.641   6.035  -0.611
  406    HA   PHE  55           HA       PHE  55   3.340   6.325   1.145
  407   1HB   PHE  55          HB2       PHE  55   3.519   7.568  -1.625
  408   2HB   PHE  55          HB1       PHE  55   2.046   7.442  -0.670
  409    HD1  PHE  55           HD1      PHE  55   5.532   8.742  -0.329
  410    HD2  PHE  55           HD2      PHE  55   1.398   9.285   0.522
  411    HE1  PHE  55           HE1      PHE  55   6.039  10.900   0.736
  412    HE2  PHE  55           HE2      PHE  55   1.897  11.447   1.585
  413    HZ   PHE  55           HZ       PHE  55   4.221  12.256   1.693
  414    H    VAL  56           HN       VAL  56   2.636   4.291   1.192
  415    HA   VAL  56           HA       VAL  56   2.391   2.812  -1.334
  416    HB   VAL  56           HB       VAL  56   3.777   1.184  -0.690
  417   1HG1  VAL  56          1HG1      VAL  56   5.463   1.894   0.561
  418   2HG1  VAL  56          2HG1      VAL  56   4.481   1.839   2.020
  419   3HG1  VAL  56          3HG1      VAL  56   4.489   3.287   1.016
  420   1HG2  VAL  56          1HG2      VAL  56   3.411  -0.082   1.464
  421   2HG2  VAL  56          2HG2      VAL  56   2.042  -0.035   0.354
  422   3HG2  VAL  56          3HG2      VAL  56   2.060   1.003   1.779
  423    H    LEU  57           HN       LEU  57   1.024   1.001  -1.303
  424    HA   LEU  57           HA       LEU  57  -1.167   1.092   0.642
  425   1HB   LEU  57          HB2       LEU  57  -1.691   1.968  -1.756
  426   2HB   LEU  57          HB1       LEU  57  -1.554   0.287  -2.237
  427    HG   LEU  57           HG       LEU  57  -3.569   1.502  -0.359
  428   1HD1  LEU  57          1HD1      LEU  57  -3.577   0.494  -3.130
  429   2HD1  LEU  57          2HD1      LEU  57  -4.548   1.758  -2.373
  430   3HD1  LEU  57          3HD1      LEU  57  -4.965   0.061  -2.133
  431   1HD2  LEU  57          1HD2      LEU  57  -2.846  -1.372  -0.811
  432   2HD2  LEU  57          2HD2      LEU  57  -4.448  -0.887  -0.265
  433   3HD2  LEU  57          3HD2      LEU  57  -3.030  -0.509   0.714
  434    H    SER  58           HN       SER  58  -1.342  -0.860   1.641
  435    HA   SER  58           HA       SER  58   0.294  -3.034   0.579
  436   1HB   SER  58          HB2       SER  58  -1.039  -2.847   3.286
  437   2HB   SER  58          HB1       SER  58   0.246  -3.955   2.803
  438    HG   SER  58           HG       SER  58   0.534  -1.138   2.765
  439    H    LEU  59           HN       LEU  59  -0.496  -4.829  -0.232
  440    HA   LEU  59           HA       LEU  59  -3.401  -5.245  -0.144
  441   1HB   LEU  59          HB2       LEU  59  -1.278  -6.048  -2.115
  442   2HB   LEU  59          HB1       LEU  59  -2.868  -6.785  -2.125
  443    HG   LEU  59           HG       LEU  59  -2.422  -4.838  -3.744
  444   1HD1  LEU  59          1HD1      LEU  59  -4.719  -5.719  -2.416
  445   2HD1  LEU  59          2HD1      LEU  59  -4.631  -4.809  -3.925
  446   3HD1  LEU  59          3HD1      LEU  59  -4.801  -3.957  -2.389
  447   1HD2  LEU  59          1HD2      LEU  59  -2.987  -3.201  -1.284
  448   2HD2  LEU  59          2HD2      LEU  59  -2.622  -2.623  -2.911
  449   3HD2  LEU  59          3HD2      LEU  59  -1.369  -3.416  -1.956
  450    H    CYS  60           HN       CYS  60  -4.145  -7.504  -0.135
  451    HA   CYS  60           HA       CYS  60  -2.347  -9.422   1.082
  452   1HB   CYS  60          HB2       CYS  60  -3.586  -8.216   2.945
  453   2HB   CYS  60          HB1       CYS  60  -5.071  -8.854   2.254
  454    HG   CYS  60           HG       CYS  60  -4.884 -11.299   3.144
  455    H    HIS  61           HN       HIS  61  -2.431 -10.253  -0.900
  456    HA   HIS  61           HA       HIS  61  -4.932 -11.041  -2.048
  457   1HB   HIS  61          HB2       HIS  61  -3.602 -10.235  -3.648
  458   2HB   HIS  61          HB1       HIS  61  -2.129 -10.666  -2.832
  459    HD1  HIS  61           HD1      HIS  61  -0.974 -11.591  -4.855
  460    HD2  HIS  61           HD2      HIS  61  -4.690 -13.343  -4.272
  461    HE1  HIS  61           HE1      HIS  61  -1.106 -13.459  -6.526
  462    HE2  HIS  61           HE2      HIS  61  -3.395 -14.455  -6.202
  463    H    LEU  62           HN       LEU  62  -5.105 -13.390  -2.835
  464    HA   LEU  62           HA       LEU  62  -4.371 -15.042  -0.543
  465   1HB   LEU  62          HB2       LEU  62  -6.008 -16.680  -1.376
  466   2HB   LEU  62          HB1       LEU  62  -6.704 -15.108  -1.064
  467    HG   LEU  62           HG       LEU  62  -7.566 -16.288  -3.105
  468   1HD1  LEU  62          1HD1      LEU  62  -6.868 -13.559  -2.777
  469   2HD1  LEU  62          2HD1      LEU  62  -8.195 -14.262  -3.696
  470   3HD1  LEU  62          3HD1      LEU  62  -6.633 -13.992  -4.473
  471   1HD2  LEU  62          1HD2      LEU  62  -6.254 -16.344  -5.109
  472   2HD2  LEU  62          2HD2      LEU  62  -5.399 -17.218  -3.841
  473   3HD2  LEU  62          3HD2      LEU  62  -4.889 -15.589  -4.288
  474    H    GLN  63           HN       GLN  63  -2.398 -14.403  -2.092
  475    HA   GLN  63           HA       GLN  63  -1.362 -16.973  -2.407
  476   1HB   GLN  63          HB2       GLN  63  -1.321 -15.127  -4.794
  477   2HB   GLN  63          HB1       GLN  63  -0.309 -16.551  -4.647
  478   1HG   GLN  63          HG2       GLN  63  -2.296 -17.961  -4.554
  479   2HG   GLN  63          HG1       GLN  63  -3.317 -16.532  -4.694
  480    H    LYS  64           HN       LYS  64  -1.066 -13.511  -2.409
  481    HA   LYS  64           HA       LYS  64   1.376 -13.770  -0.902
  482   1HB   LYS  64          HB2       LYS  64   2.623 -12.163  -2.360
  483   2HB   LYS  64          HB1       LYS  64   2.339 -13.738  -3.088
  484   1HG   LYS  64          HG2       LYS  64   0.481 -12.823  -4.370
  485   2HG   LYS  64          HG1       LYS  64   0.745 -11.243  -3.630
  486   1HD   LYS  64          HD2       LYS  64   2.958 -11.125  -4.624
  487   2HD   LYS  64          HD1       LYS  64   2.751 -12.735  -5.318
  488   1HE   LYS  64          HE2       LYS  64   2.352 -10.999  -6.985
  489   2HE   LYS  64          HE1       LYS  64   0.884 -11.921  -6.662
  490   1HZ   LYS  64          HZ1       LYS  64   1.224  -9.171  -6.516
  491   2HZ   LYS  64          HZ2       LYS  64   1.016  -9.703  -4.924
  492   3HZ   LYS  64          HZ3       LYS  64  -0.151 -10.063  -6.096
  493    H    VAL  65           HN       VAL  65   2.267 -11.369  -0.586
  494    HA   VAL  65           HA       VAL  65   0.090  -9.458  -0.224
  495    HB   VAL  65           HB       VAL  65   0.756  -8.931   2.061
  496   1HG1  VAL  65          1HG1      VAL  65  -0.315 -10.716   3.120
  497   2HG1  VAL  65          2HG1      VAL  65   0.335 -11.897   1.980
  498   3HG1  VAL  65          3HG1      VAL  65  -0.924 -10.773   1.466
  499   1HG2  VAL  65          1HG2      VAL  65   2.276 -10.594   3.241
  500   2HG2  VAL  65          2HG2      VAL  65   3.045  -9.455   2.136
  501   3HG2  VAL  65          3HG2      VAL  65   2.769 -11.122   1.632
  502    H    LYS  66           HN       LYS  66   0.755  -7.425  -0.830
  503    HA   LYS  66           HA       LYS  66   3.646  -6.895  -0.811
  504   1HB   LYS  66          HB2       LYS  66   3.534  -6.019  -3.122
  505   2HB   LYS  66          HB1       LYS  66   3.224  -7.744  -3.014
  506   1HG   LYS  66          HG2       LYS  66   0.783  -7.223  -3.088
  507   2HG   LYS  66          HG1       LYS  66   1.215  -5.547  -3.426
  508   1HD   LYS  66          HD2       LYS  66   1.933  -7.954  -5.100
  509   2HD   LYS  66          HD1       LYS  66   0.718  -6.737  -5.490
  510   1HE   LYS  66          HE2       LYS  66   2.613  -6.150  -6.751
  511   2HE   LYS  66          HE1       LYS  66   2.595  -5.041  -5.383
  512   1HZ   LYS  66          HZ1       LYS  66   4.684  -6.632  -6.173
  513   2HZ   LYS  66          HZ2       LYS  66   4.083  -7.394  -4.789
  514   3HZ   LYS  66          HZ3       LYS  66   4.566  -5.774  -4.721
  515    H    HIS  67           HN       HIS  67   3.814  -4.530  -2.058
  516    HA   HIS  67           HA       HIS  67   1.945  -2.698  -0.726
  517   1HB   HIS  67          HB2       HIS  67   4.964  -2.526  -0.598
  518   2HB   HIS  67          HB1       HIS  67   3.842  -1.343   0.064
  519    HD1  HIS  67           HD1      HIS  67   2.262  -2.276   2.045
  520    HD2  HIS  67           HD2      HIS  67   5.565  -4.590   1.071
  521    HE1  HIS  67           HE1      HIS  67   2.550  -3.873   3.963
  522    HE2  HIS  67           HE2      HIS  67   4.400  -5.411   3.223
  523    H    TYR  68           HN       TYR  68   1.540  -0.811  -1.822
  524    HA   TYR  68           HA       TYR  68   2.736  -0.556  -4.498
  525   1HB   TYR  68          HB2       TYR  68   0.058   0.231  -3.386
  526   2HB   TYR  68          HB1       TYR  68   0.653   0.893  -4.901
  527    HD1  TYR  68           HD1      TYR  68  -1.472  -0.092  -5.832
  528    HD2  TYR  68           HD2      TYR  68   1.661  -2.513  -4.282
  529    HE1  TYR  68           HE1      TYR  68  -2.365  -2.026  -7.057
  530    HE2  TYR  68           HE2      TYR  68   0.773  -4.452  -5.499
  531    HH   TYR  68           HH       TYR  68  -0.618  -4.916  -7.449
  532    H    LEU  69           HN       LEU  69   4.612   0.667  -3.660
  533    HA   LEU  69           HA       LEU  69   3.901   3.499  -3.315
  534   1HB   LEU  69          HB2       LEU  69   4.281   3.092  -1.109
  535   2HB   LEU  69          HB1       LEU  69   5.496   1.894  -1.404
  536    HG   LEU  69           HG       LEU  69   6.075   4.282  -0.394
  537   1HD1  LEU  69          1HD1      LEU  69   7.593   2.430  -2.105
  538   2HD1  LEU  69          2HD1      LEU  69   7.902   2.974  -0.458
  539   3HD1  LEU  69          3HD1      LEU  69   8.316   4.009  -1.824
  540   1HD2  LEU  69          1HD2      LEU  69   6.295   6.017  -1.811
  541   2HD2  LEU  69          2HD2      LEU  69   5.213   5.118  -2.861
  542   3HD2  LEU  69          3HD2      LEU  69   6.955   5.011  -3.091
  543    H    ILE  70           HN       ILE  70   4.875   4.525  -4.924
  544    HA   ILE  70           HA       ILE  70   7.745   4.231  -4.866
  545    HB   ILE  70           HB       ILE  70   6.366   3.562  -7.424
  546   1HG1  ILE  70          2HG1      ILE  70   8.161   2.201  -5.449
  547   2HG1  ILE  70          1HG1      ILE  70   6.609   1.660  -6.056
  548   1HG2  ILE  70          1HG2      ILE  70   8.593   5.157  -7.306
  549   2HG2  ILE  70          2HG2      ILE  70   8.168   4.108  -8.656
  550   3HG2  ILE  70          3HG2      ILE  70   9.286   3.542  -7.417
  551   1HD1  ILE  70          1HD1      ILE  70   8.417   0.314  -6.895
  552   2HD1  ILE  70          2HD1      ILE  70   9.172   1.747  -7.577
  553   3HD1  ILE  70          3HD1      ILE  70   7.629   1.194  -8.198
  554    H    LEU  71           HN       LEU  71   5.042   5.782  -6.285
  555    HA   LEU  71           HA       LEU  71   6.554   8.295  -6.061
  556   1HB   LEU  71          HB2       LEU  71   4.902   8.054  -8.494
  557   2HB   LEU  71          HB1       LEU  71   6.426   8.874  -8.257
  558    HG   LEU  71           HG       LEU  71   7.446   6.495  -8.183
  559   1HD1  LEU  71          1HD1      LEU  71   4.949   5.613  -8.170
  560   2HD1  LEU  71          2HD1      LEU  71   6.264   4.710  -8.921
  561   3HD1  LEU  71          3HD1      LEU  71   5.184   5.686  -9.915
  562   1HD2  LEU  71          1HD2      LEU  71   7.943   7.966 -10.004
  563   2HD2  LEU  71          2HD2      LEU  71   6.359   7.685 -10.728
  564   3HD2  LEU  71          3HD2      LEU  71   7.547   6.376 -10.668
  565    HA   PRO  72           HA       PRO  72   2.487   9.174  -4.327
  566   1HB   PRO  72          HB2       PRO  72   3.257  11.115  -2.660
  567   2HB   PRO  72          HB1       PRO  72   3.654   9.423  -2.344
  568   1HG   PRO  72          HG2       PRO  72   5.369  11.587  -3.493
  569   2HG   PRO  72          HG1       PRO  72   5.782  10.353  -2.289
  570   1HD   PRO  72          HD2       PRO  72   6.388  10.176  -4.971
  571   2HD   PRO  72          HD1       PRO  72   6.228   8.782  -3.886
  572    H    SER  73           HN       SER  73   1.811  11.728  -3.578
  573    HA   SER  73           HA       SER  73   0.792  12.888  -5.836
  574   1HB   SER  73          HB2       SER  73   0.453  14.923  -4.481
  575   2HB   SER  73          HB1       SER  73   0.027  13.462  -3.589
  576    HG   SER  73           HG       SER  73   1.311  14.956  -2.371
  577    H    GLU  74           HN       GLU  74   1.716  13.746  -7.549
  578    HA   GLU  74           HA       GLU  74   4.200  15.292  -7.182
  579   1HB   GLU  74          HB2       GLU  74   3.414  13.419  -9.408
  580   2HB   GLU  74          HB1       GLU  74   4.713  14.594  -9.577
  581   1HG   GLU  74          HG2       GLU  74   6.002  13.562  -7.896
  582   2HG   GLU  74          HG1       GLU  74   4.647  12.574  -7.360
  583    H    GLU  75           HN       GLU  75   4.519  16.561  -9.497
  584    HA   GLU  75           HA       GLU  75   2.167  18.301  -9.574
  585   1HB   GLU  75          HB2       GLU  75   4.962  18.742 -10.643
  586   2HB   GLU  75          HB1       GLU  75   3.666  19.929 -10.663
  587   1HG   GLU  75          HG2       GLU  75   4.893  18.727  -8.191
  588   2HG   GLU  75          HG1       GLU  75   5.265  20.318  -8.853
  589    H    GLU  76           HN       GLU  76   2.186  15.771 -10.862
  590    HA   GLU  76           HA       GLU  76   1.504  16.636 -13.557
  591   1HB   GLU  76          HB2       GLU  76   3.742  15.533 -13.640
  592   2HB   GLU  76          HB1       GLU  76   3.021  14.087 -12.952
  593   1HG   GLU  76          HG2       GLU  76   3.273  13.840 -15.334
  594   2HG   GLU  76          HG1       GLU  76   1.563  13.893 -14.914
  595    H    GLY  77           HN       GLY  77   0.587  15.365 -10.678
  596   1HA   GLY  77          HA2       GLY  77  -1.976  14.639 -11.432
  597   2HA   GLY  77          HA1       GLY  77  -1.033  13.154 -11.425
  598    H    ARG  78           HN       ARG  78  -1.700  12.106  -9.640
  599    HA   ARG  78           HA       ARG  78  -1.515  13.568  -7.087
  600   1HB   ARG  78          HB2       ARG  78  -3.342  11.225  -7.536
  601   2HB   ARG  78          HB1       ARG  78  -3.381  12.389  -6.224
  602   1HG   ARG  78          HG2       ARG  78  -4.141  12.852  -9.096
  603   2HG   ARG  78          HG1       ARG  78  -5.214  12.812  -7.696
  604   1HD   ARG  78          HD2       ARG  78  -4.618  14.890  -7.007
  605   2HD   ARG  78          HD1       ARG  78  -2.972  14.742  -7.619
  606    HE   ARG  78           HE       ARG  78  -3.657  15.673  -9.568
  607   1HH1  ARG  78          HH11      ARG  78  -6.473  14.536  -7.855
  608   2HH1  ARG  78          HH12      ARG  78  -7.593  15.194  -9.000
  609   1HH2  ARG  78          HH21      ARG  78  -5.128  16.543 -11.081
  610   2HH2  ARG  78          HH22      ARG  78  -6.829  16.332 -10.833
  611    H    LEU  79           HN       LEU  79  -2.228  10.622  -6.061
  612    HA   LEU  79           HA       LEU  79   0.456   9.924  -5.439
  613   1HB   LEU  79          HB2       LEU  79  -2.047   8.244  -5.222
  614   2HB   LEU  79          HB1       LEU  79  -0.514   7.913  -4.438
  615    HG   LEU  79           HG       LEU  79  -2.313  10.269  -3.871
  616   1HD1  LEU  79          1HD1      LEU  79  -1.633   8.293  -1.792
  617   2HD1  LEU  79          2HD1      LEU  79  -2.722   7.739  -3.063
  618   3HD1  LEU  79          3HD1      LEU  79  -3.142   9.153  -2.097
  619   1HD2  LEU  79          1HD2      LEU  79  -0.705  10.549  -1.928
  620   2HD2  LEU  79          2HD2      LEU  79  -0.109  11.019  -3.520
  621   3HD2  LEU  79          3HD2      LEU  79   0.387   9.482  -2.811
  622    H    TYR  80           HN       TYR  80   1.733   9.439  -7.156
  623    HA   TYR  80           HA       TYR  80   0.833   8.115  -9.459
  624   1HB   TYR  80          HB2       TYR  80   3.403   9.120  -8.491
  625   2HB   TYR  80          HB1       TYR  80   3.500   7.798  -9.654
  626    HD1  TYR  80           HD1      TYR  80   1.070  10.614  -9.400
  627    HD2  TYR  80           HD2      TYR  80   4.155   8.754 -11.662
  628    HE1  TYR  80           HE1      TYR  80   0.666  12.193 -11.240
  629    HE2  TYR  80           HE2      TYR  80   3.761  10.330 -13.507
  630    HH   TYR  80           HH       TYR  80   1.017  12.355 -13.633
  631    H    PHE  81           HN       PHE  81   0.336   6.174  -9.791
  632    HA   PHE  81           HA       PHE  81   1.714   3.982  -8.495
  633   1HB   PHE  81          HB2       PHE  81  -1.215   4.342  -8.972
  634   2HB   PHE  81          HB1       PHE  81  -0.520   2.737  -8.808
  635    HD1  PHE  81           HD1      PHE  81   0.120   5.918  -6.949
  636    HD2  PHE  81           HD2      PHE  81  -1.183   1.872  -6.792
  637    HE1  PHE  81           HE1      PHE  81  -0.056   6.073  -4.504
  638    HE2  PHE  81           HE2      PHE  81  -1.365   2.025  -4.343
  639    HZ   PHE  81           HZ       PHE  81  -0.803   4.127  -3.197
  640    H    SER  82           HN       SER  82   2.545   2.465  -9.808
  641    HA   SER  82           HA       SER  82   1.470   2.128 -12.484
  642   1HB   SER  82          HB2       SER  82   3.739   2.345 -13.507
  643   2HB   SER  82          HB1       SER  82   3.069   3.862 -12.909
  644    HG   SER  82           HG       SER  82   5.060   3.868 -12.085
  645    H    MET  83           HN       MET  83   1.826   0.579  -9.975
  646    HA   MET  83           HA       MET  83   3.606  -1.322  -9.675
  647   1HB   MET  83          HB2       MET  83   0.667  -1.958  -9.931
  648   2HB   MET  83          HB1       MET  83   1.859  -2.944  -9.103
  649   1HG   MET  83          HG2       MET  83   0.825  -1.846  -7.374
  650   2HG   MET  83          HG1       MET  83   2.247  -0.849  -7.654
  651   1HE   MET  83          HE1       MET  83  -2.030  -0.399  -8.175
  652   2HE   MET  83          HE2       MET  83  -1.067  -1.538  -9.115
  653   3HE   MET  83          HE3       MET  83  -1.556   0.001  -9.825
  654    H    ASP  84           HN       ASP  84   3.606  -3.670 -10.277
  655    HA   ASP  84           HA       ASP  84   4.618  -4.265 -12.636
  656   1HB   ASP  84          HB2       ASP  84   4.356  -5.928 -10.888
  657   2HB   ASP  84          HB1       ASP  84   2.625  -6.008 -11.189
  658    H    ASP  85           HN       ASP  85   1.097  -4.290 -12.120
  659    HA   ASP  85           HA       ASP  85   0.752  -3.773 -14.980
  660   1HB   ASP  85          HB2       ASP  85   0.504  -6.264 -14.448
  661   2HB   ASP  85          HB1       ASP  85  -0.950  -5.822 -13.561
  662    H    GLY  86           HN       GLY  86   0.538  -2.196 -12.499
  663   1HA   GLY  86          HA2       GLY  86  -2.308  -1.443 -12.739
  664   2HA   GLY  86          HA1       GLY  86  -1.453  -1.406 -11.205
  665    H    GLN  87           HN       GLN  87  -2.814   0.705 -12.818
  666    HA   GLN  87           HA       GLN  87  -0.646   2.669 -12.698
  667   1HB   GLN  87          HB2       GLN  87  -1.520   3.714 -14.800
  668   2HB   GLN  87          HB1       GLN  87  -0.771   2.141 -15.043
  669   1HG   GLN  87          HG2       GLN  87  -2.966   1.094 -15.125
  670   2HG   GLN  87          HG1       GLN  87  -3.733   2.652 -14.847
  671    H    THR  88           HN       THR  88  -1.830   3.051 -10.639
  672    HA   THR  88           HA       THR  88  -4.368   4.423 -11.088
  673    HB   THR  88           HB       THR  88  -4.765   4.095  -8.662
  674    HG1  THR  88           HG1      THR  88  -2.486   2.424  -8.769
  675   1HG2  THR  88          1HG2      THR  88  -5.862   2.323  -9.411
  676   2HG2  THR  88          2HG2      THR  88  -4.416   1.374  -9.069
  677   3HG2  THR  88          3HG2      THR  88  -4.670   2.045 -10.683
  678    H    ARG  89           HN       ARG  89  -1.506   5.497 -11.196
  679    HA   ARG  89           HA       ARG  89  -0.800   7.296  -9.337
  680   1HB   ARG  89          HB2       ARG  89   0.038   8.766 -11.115
  681   2HB   ARG  89          HB1       ARG  89   0.380   7.076 -11.455
  682   1HG   ARG  89          HG2       ARG  89  -1.322   6.974 -13.099
  683   2HG   ARG  89          HG1       ARG  89  -1.972   8.542 -12.620
  684   1HD   ARG  89          HD2       ARG  89   0.071   9.639 -13.365
  685   2HD   ARG  89          HD1       ARG  89   0.765   8.076 -13.802
  686    HE   ARG  89           HE       ARG  89  -0.981   9.643 -15.379
  687   1HH1  ARG  89          HH11      ARG  89  -0.267   6.326 -14.556
  688   2HH1  ARG  89          HH12      ARG  89  -0.927   5.690 -16.024
  689   1HH2  ARG  89          HH21      ARG  89  -1.844   8.807 -17.312
  690   2HH2  ARG  89          HH22      ARG  89  -1.820   7.098 -17.589
  691    H    PHE  90           HN       PHE  90  -3.240   7.515  -8.545
  692    HA   PHE  90           HA       PHE  90  -3.961  10.284  -9.117
  693   1HB   PHE  90          HB2       PHE  90  -6.399   9.661  -9.138
  694   2HB   PHE  90          HB1       PHE  90  -5.495   9.136 -10.552
  695    HD1  PHE  90           HD1      PHE  90  -6.245   7.746  -7.151
  696    HD2  PHE  90           HD2      PHE  90  -6.112   7.103 -11.357
  697    HE1  PHE  90           HE1      PHE  90  -7.049   5.446  -6.823
  698    HE2  PHE  90           HE2      PHE  90  -6.920   4.803 -11.034
  699    HZ   PHE  90           HZ       PHE  90  -7.391   3.973  -8.765
  700    H    THR  91           HN       THR  91  -6.031  10.685  -7.480
  701    HA   THR  91           HA       THR  91  -4.848  10.317  -4.876
  702    HB   THR  91           HB       THR  91  -7.455  11.609  -5.712
  703    HG1  THR  91           HG1      THR  91  -6.302  13.315  -6.053
  704   1HG2  THR  91          1HG2      THR  91  -6.549  12.724  -3.315
  705   2HG2  THR  91          2HG2      THR  91  -6.493  10.975  -3.094
  706   3HG2  THR  91          3HG2      THR  91  -8.000  11.756  -3.577
  707    H    ASP  92           HN       ASP  92  -4.937   8.027  -4.749
  708    HA   ASP  92           HA       ASP  92  -7.112   6.382  -5.074
  709   1HB   ASP  92          HB2       ASP  92  -4.923   6.130  -3.004
  710   2HB   ASP  92          HB1       ASP  92  -5.990   4.829  -3.524
  711    H    LEU  93           HN       LEU  93  -6.339   8.430  -2.329
  712    HA   LEU  93           HA       LEU  93  -7.804   7.475  -0.289
  713   1HB   LEU  93          HB2       LEU  93  -6.542   9.619  -0.323
  714   2HB   LEU  93          HB1       LEU  93  -7.888  10.364  -1.158
  715    HG   LEU  93           HG       LEU  93  -8.085   9.148   1.599
  716   1HD1  LEU  93          1HD1      LEU  93  -6.624  11.332   1.063
  717   2HD1  LEU  93          2HD1      LEU  93  -7.548  11.124   2.550
  718   3HD1  LEU  93          3HD1      LEU  93  -8.217  12.071   1.221
  719   1HD2  LEU  93          1HD2      LEU  93 -10.247   9.192   0.753
  720   2HD2  LEU  93          2HD2      LEU  93  -9.966  10.674  -0.161
  721   3HD2  LEU  93          3HD2      LEU  93 -10.123  10.736   1.594
  722    H    LEU  94           HN       LEU  94  -9.400  10.015  -2.195
  723    HA   LEU  94           HA       LEU  94 -11.982   9.463  -1.463
  724   1HB   LEU  94          HB2       LEU  94 -11.201  11.437  -2.749
  725   2HB   LEU  94          HB1       LEU  94 -11.074  10.427  -4.174
  726    HG   LEU  94           HG       LEU  94 -13.106  11.825  -4.150
  727   1HD1  LEU  94          1HD1      LEU  94 -14.322  10.272  -5.231
  728   2HD1  LEU  94          2HD1      LEU  94 -14.229   9.117  -3.903
  729   3HD1  LEU  94          3HD1      LEU  94 -12.872   9.293  -5.015
  730   1HD2  LEU  94          1HD2      LEU  94 -14.560  11.905  -2.449
  731   2HD2  LEU  94          2HD2      LEU  94 -13.245  11.211  -1.500
  732   3HD2  LEU  94          3HD2      LEU  94 -14.491  10.163  -2.182
  733    H    GLN  95           HN       GLN  95 -10.139   8.012  -4.108
  734    HA   GLN  95           HA       GLN  95 -12.175   6.602  -5.339
  735   1HB   GLN  95          HB2       GLN  95  -9.257   5.877  -5.070
  736   2HB   GLN  95          HB1       GLN  95 -10.363   5.297  -6.286
  737   1HG   GLN  95          HG2       GLN  95  -9.534   8.155  -5.943
  738   2HG   GLN  95          HG1       GLN  95  -8.872   7.040  -7.131
  739    H    LEU  96           HN       LEU  96  -9.833   5.481  -2.899
  740    HA   LEU  96           HA       LEU  96 -10.617   2.877  -2.604
  741   1HB   LEU  96          HB2       LEU  96  -8.712   4.009  -1.454
  742   2HB   LEU  96          HB1       LEU  96  -9.858   4.728  -0.342
  743    HG   LEU  96           HG       LEU  96  -9.452   1.751  -0.644
  744   1HD1  LEU  96          1HD1      LEU  96  -8.544   3.136   1.791
  745   2HD1  LEU  96          2HD1      LEU  96  -7.579   3.419   0.342
  746   3HD1  LEU  96          3HD1      LEU  96  -7.835   1.774   0.923
  747   1HD2  LEU  96          1HD2      LEU  96 -10.465   2.180   1.834
  748   2HD2  LEU  96          2HD2      LEU  96 -11.435   1.769   0.420
  749   3HD2  LEU  96          3HD2      LEU  96 -11.271   3.452   0.917
  750    H    VAL  97           HN       VAL  97 -12.172   5.750  -1.312
  751    HA   VAL  97           HA       VAL  97 -13.951   4.501   0.459
  752    HB   VAL  97           HB       VAL  97 -14.416   7.044  -1.104
  753   1HG1  VAL  97          1HG1      VAL  97 -16.280   7.369   0.082
  754   2HG1  VAL  97          2HG1      VAL  97 -15.506   6.875   1.587
  755   3HG1  VAL  97          3HG1      VAL  97 -16.181   5.660   0.502
  756   1HG2  VAL  97          1HG2      VAL  97 -12.299   6.641   0.479
  757   2HG2  VAL  97          2HG2      VAL  97 -13.482   7.112   1.701
  758   3HG2  VAL  97          3HG2      VAL  97 -13.123   8.196   0.357
  759    H    GLU  98           HN       GLU  98 -14.905   5.947  -2.660
  760    HA   GLU  98           HA       GLU  98 -17.317   4.462  -2.803
  761   1HB   GLU  98          HB2       GLU  98 -17.067   6.625  -3.896
  762   2HB   GLU  98          HB1       GLU  98 -15.823   5.971  -4.953
  763   1HG   GLU  98          HG2       GLU  98 -17.458   4.462  -5.952
  764   2HG   GLU  98          HG1       GLU  98 -18.707   5.109  -4.889
  765    H    PHE  99           HN       PHE  99 -14.251   4.116  -4.588
  766    HA   PHE  99           HA       PHE  99 -15.100   1.926  -6.129
  767   1HB   PHE  99          HB2       PHE  99 -12.359   2.920  -5.380
  768   2HB   PHE  99          HB1       PHE  99 -12.597   1.517  -6.409
  769    HD1  PHE  99           HD1      PHE  99 -11.688   2.294  -8.410
  770    HD2  PHE  99           HD2      PHE  99 -14.661   4.603  -6.423
  771    HE1  PHE  99           HE1      PHE  99 -11.884   3.742 -10.388
  772    HE2  PHE  99           HE2      PHE  99 -14.860   6.052  -8.395
  773    HZ   PHE  99           HZ       PHE  99 -13.472   5.623 -10.382
  774    H    HIS 100           HN       HIS 100 -14.465   2.022  -2.800
  775    HA   HIS 100           HA       HIS 100 -13.151  -0.268  -2.131
  776   1HB   HIS 100          HB2       HIS 100 -14.368  -0.320  -0.089
  777   2HB   HIS 100          HB1       HIS 100 -14.296   1.372  -0.558
  778    HD1  HIS 100           HD1      HIS 100 -16.625   1.884  -2.237
  779    HD2  HIS 100           HD2      HIS 100 -16.814  -0.836   0.895
  780    HE1  HIS 100           HE1      HIS 100 -19.066   1.681  -1.672
  781    HE2  HIS 100           HE2      HIS 100 -19.164  -0.039   0.166
  782    H    GLN 101           HN       GLN 101 -16.389   0.025  -3.398
  783    HA   GLN 101           HA       GLN 101 -17.164  -2.682  -3.085
  784   1HB   GLN 101          HB2       GLN 101 -18.955  -2.051  -4.743
  785   2HB   GLN 101          HB1       GLN 101 -18.874  -1.042  -3.305
  786   1HG   GLN 101          HG2       GLN 101 -17.438   0.529  -4.736
  787   2HG   GLN 101          HG1       GLN 101 -18.045  -0.388  -6.107
  788    H    LEU 102           HN       LEU 102 -16.112  -0.864  -5.980
  789    HA   LEU 102           HA       LEU 102 -15.059  -3.382  -7.060
  790   1HB   LEU 102          HB2       LEU 102 -16.817  -1.410  -8.516
  791   2HB   LEU 102          HB1       LEU 102 -15.822  -2.587  -9.347
  792    HG   LEU 102           HG       LEU 102 -18.094  -3.387  -9.231
  793   1HD1  LEU 102          1HD1      LEU 102 -17.740  -5.535  -8.101
  794   2HD1  LEU 102          2HD1      LEU 102 -16.292  -4.884  -7.337
  795   3HD1  LEU 102          3HD1      LEU 102 -16.358  -5.064  -9.089
  796   1HD2  LEU 102          1HD2      LEU 102 -18.194  -3.783  -6.338
  797   2HD2  LEU 102          2HD2      LEU 102 -19.441  -3.227  -7.454
  798   3HD2  LEU 102          3HD2      LEU 102 -18.245  -2.092  -6.831
  799    H    ASN 103           HN       ASN 103 -13.148  -2.275  -6.089
  800    HA   ASN 103           HA       ASN 103 -12.058  -0.090  -7.711
  801   1HB   ASN 103          HB2       ASN 103 -10.341   0.032  -5.928
  802   2HB   ASN 103          HB1       ASN 103 -11.972   0.194  -5.288
  803   1HD2  ASN 103          1HD2      ASN 103 -12.625  -1.152  -3.754
  804   2HD2  ASN 103          2HD2      ASN 103 -11.754  -2.540  -3.208
  805    H    ARG 104           HN       ARG 104  -9.490  -0.319  -7.768
  806    HA   ARG 104           HA       ARG 104  -8.963  -2.830  -9.184
  807   1HB   ARG 104          HB2       ARG 104  -7.570  -0.151  -9.215
  808   2HB   ARG 104          HB1       ARG 104  -6.903  -1.581  -9.988
  809   1HG   ARG 104          HG2       ARG 104  -8.050  -0.150 -11.587
  810   2HG   ARG 104          HG1       ARG 104  -8.839  -1.720 -11.450
  811   1HD   ARG 104          HD2       ARG 104 -10.557  -0.773 -10.037
  812   2HD   ARG 104          HD1       ARG 104  -9.736   0.788 -10.034
  813    HE   ARG 104           HE       ARG 104 -10.255   0.086 -12.685
  814   1HH1  ARG 104          HH11      ARG 104 -12.025   0.916  -9.795
  815   2HH1  ARG 104          HH12      ARG 104 -13.358   1.604 -10.659
  816   1HH2  ARG 104          HH21      ARG 104 -12.008   0.990 -13.824
  817   2HH2  ARG 104          HH22      ARG 104 -13.349   1.646 -12.946
  818    H    GLY 105           HN       GLY 105  -8.912  -3.808  -6.980
  819   1HA   GLY 105          HA2       GLY 105  -7.216  -3.337  -4.925
  820   2HA   GLY 105          HA1       GLY 105  -7.621  -4.957  -5.457
  821    H    ILE 106           HN       ILE 106  -5.991  -6.231  -6.001
  822    HA   ILE 106           HA       ILE 106  -3.365  -4.994  -6.542
  823    HB   ILE 106           HB       ILE 106  -3.551  -6.352  -4.458
  824   1HG1  ILE 106          2HG1      ILE 106  -1.725  -7.628  -6.496
  825   2HG1  ILE 106          1HG1      ILE 106  -1.374  -6.122  -5.653
  826   1HG2  ILE 106          1HG2      ILE 106  -4.188  -8.517  -4.394
  827   2HG2  ILE 106          2HG2      ILE 106  -3.593  -8.857  -6.019
  828   3HG2  ILE 106          3HG2      ILE 106  -5.120  -8.003  -5.799
  829   1HD1  ILE 106          1HD1      ILE 106  -1.963  -8.629  -4.141
  830   2HD1  ILE 106          2HD1      ILE 106  -1.073  -7.197  -3.627
  831   3HD1  ILE 106          3HD1      ILE 106  -0.355  -8.311  -4.787
  832    H    LEU 107           HN       LEU 107  -1.867  -6.473  -7.828
  833    HA   LEU 107           HA       LEU 107  -2.431  -6.723 -10.402
  834   1HB   LEU 107          HB2       LEU 107  -0.789  -8.475  -8.637
  835   2HB   LEU 107          HB1       LEU 107  -0.979  -8.918 -10.322
  836    HG   LEU 107           HG       LEU 107   0.064  -6.225  -9.430
  837   1HD1  LEU 107          1HD1      LEU 107   1.382  -8.560  -9.007
  838   2HD1  LEU 107          2HD1      LEU 107   2.158  -7.004  -9.302
  839   3HD1  LEU 107          3HD1      LEU 107   1.926  -8.141 -10.631
  840   1HD2  LEU 107          1HD2      LEU 107  -0.913  -6.286 -11.662
  841   2HD2  LEU 107          2HD2      LEU 107   0.118  -7.654 -12.082
  842   3HD2  LEU 107          3HD2      LEU 107   0.834  -6.084 -11.737
  843    HA   PRO 108           HA       PRO 108  -5.395  -9.437 -12.121
  844   1HB   PRO 108          HB2       PRO 108  -3.075 -11.278 -12.595
  845   2HB   PRO 108          HB1       PRO 108  -4.436 -10.900 -13.658
  846   1HG   PRO 108          HG2       PRO 108  -2.050  -9.678 -13.914
  847   2HG   PRO 108          HG1       PRO 108  -3.578  -8.849 -14.257
  848   1HD   PRO 108          HD2       PRO 108  -1.683  -8.394 -12.084
  849   2HD   PRO 108          HD1       PRO 108  -3.045  -7.388 -12.606
  850    H    CYS 109           HN       CYS 109  -6.282  -9.832  -9.962
  851    HA   CYS 109           HA       CYS 109  -6.389 -12.672  -9.448
  852   1HB   CYS 109          HB2       CYS 109  -5.744 -10.817  -7.141
  853   2HB   CYS 109          HB1       CYS 109  -5.977 -12.548  -7.067
  854    HG   CYS 109           HG       CYS 109  -3.197 -11.327  -6.981
  855    H    LEU 110           HN       LEU 110  -7.312 -10.008  -7.342
  856    HA   LEU 110           HA       LEU 110 -10.126 -10.377  -8.114
  857   1HB   LEU 110          HB2       LEU 110  -9.017  -9.947  -5.334
  858   2HB   LEU 110          HB1       LEU 110 -10.714  -9.825  -5.738
  859    HG   LEU 110           HG       LEU 110 -10.169 -11.973  -4.684
  860   1HD1  LEU 110          1HD1      LEU 110 -10.854 -12.432  -7.575
  861   2HD1  LEU 110          2HD1      LEU 110 -11.978 -11.698  -6.431
  862   3HD1  LEU 110          3HD1      LEU 110 -11.395 -13.341  -6.165
  863   1HD2  LEU 110          1HD2      LEU 110  -8.543 -13.376  -5.373
  864   2HD2  LEU 110          2HD2      LEU 110  -7.843 -11.899  -6.030
  865   3HD2  LEU 110          3HD2      LEU 110  -8.767 -12.979  -7.074
  866    H    LEU 111           HN       LEU 111 -11.197  -8.221  -6.677
  867    HA   LEU 111           HA       LEU 111  -9.515  -5.937  -7.289
  868   1HB   LEU 111          HB2       LEU 111 -11.012  -4.896  -8.828
  869   2HB   LEU 111          HB1       LEU 111 -10.611  -6.494  -9.411
  870    HG   LEU 111           HG       LEU 111 -12.899  -6.185  -9.867
  871   1HD1  LEU 111          1HD1      LEU 111 -12.999  -7.728  -7.301
  872   2HD1  LEU 111          2HD1      LEU 111 -12.178  -8.349  -8.731
  873   3HD1  LEU 111          3HD1      LEU 111 -13.904  -7.992  -8.790
  874   1HD2  LEU 111          1HD2      LEU 111 -13.555  -5.553  -7.022
  875   2HD2  LEU 111          2HD2      LEU 111 -14.488  -5.236  -8.481
  876   3HD2  LEU 111          3HD2      LEU 111 -13.049  -4.281  -8.130
  877    H    ARG 112           HN       ARG 112 -12.008  -7.300  -5.421
  878    HA   ARG 112           HA       ARG 112 -12.889  -4.687  -4.435
  879   1HB   ARG 112          HB2       ARG 112 -13.903  -7.415  -3.626
  880   2HB   ARG 112          HB1       ARG 112 -14.652  -5.862  -3.291
  881   1HG   ARG 112          HG2       ARG 112 -15.042  -5.551  -5.694
  882   2HG   ARG 112          HG1       ARG 112 -14.338  -7.138  -5.997
  883   1HD   ARG 112          HD2       ARG 112 -16.774  -7.250  -5.964
  884   2HD   ARG 112          HD1       ARG 112 -16.075  -8.180  -4.639
  885    HE   ARG 112           HE       ARG 112 -16.645  -5.604  -3.708
  886   1HH1  ARG 112          HH11      ARG 112 -18.327  -8.456  -4.810
  887   2HH1  ARG 112          HH12      ARG 112 -19.735  -8.148  -3.851
  888   1HH2  ARG 112          HH21      ARG 112 -18.496  -5.198  -2.445
  889   2HH2  ARG 112          HH22      ARG 112 -19.832  -6.299  -2.508
  890    H    HIS 113           HN       HIS 113 -12.747  -4.111  -2.219
  891    HA   HIS 113           HA       HIS 113 -11.247  -5.844  -0.436
  892   1HB   HIS 113          HB2       HIS 113  -9.578  -4.091   0.117
  893   2HB   HIS 113          HB1       HIS 113  -9.426  -4.697  -1.531
  894    HD1  HIS 113           HD1      HIS 113 -11.569  -1.877  -0.097
  895    HD2  HIS 113           HD2      HIS 113  -8.694  -2.573  -3.014
  896    HE1  HIS 113           HE1      HIS 113 -11.293   0.310  -1.302
  897    HE2  HIS 113           HE2      HIS 113  -9.481  -0.110  -3.001
  898    H    CYS 114           HN       CYS 114 -10.988  -4.799   1.769
  899    HA   CYS 114           HA       CYS 114 -13.097  -2.860   2.353
  900   1HB   CYS 114          HB2       CYS 114 -14.151  -5.030   2.681
  901   2HB   CYS 114          HB1       CYS 114 -12.829  -5.545   3.725
  902    HG   CYS 114           HG       CYS 114 -15.406  -3.456   4.404
  903    H    CYS 115           HN       CYS 115 -11.224  -4.919   4.554
  904    HA   CYS 115           HA       CYS 115  -9.579  -2.620   5.315
  905   1HB   CYS 115          HB2       CYS 115 -11.154  -4.295   7.284
  906   2HB   CYS 115          HB1       CYS 115  -9.999  -3.036   7.707
  907    HG   CYS 115           HG       CYS 115 -13.049  -2.582   7.660
  908    H    THR 116           HN       THR 116  -8.204  -3.680   7.421
  909    HA   THR 116           HA       THR 116  -6.914  -6.044   6.222
  910    HB   THR 116           HB       THR 116  -5.707  -3.880   7.959
  911    HG1  THR 116           HG1      THR 116  -5.628  -2.960   6.069
  912   1HG2  THR 116          1HG2      THR 116  -4.508  -6.362   6.784
  913   2HG2  THR 116          2HG2      THR 116  -4.445  -5.787   8.451
  914   3HG2  THR 116          3HG2      THR 116  -3.538  -4.947   7.193
  915    H    ARG 117           HN       ARG 117  -5.831  -7.519   7.787
  916    HA   ARG 117           HA       ARG 117  -7.336  -7.646  10.321
  917   1HB   ARG 117          HB2       ARG 117  -8.022  -9.411   8.737
  918   2HB   ARG 117          HB1       ARG 117  -6.357  -9.955   8.631
  919   1HG   ARG 117          HG2       ARG 117  -7.495 -11.424  10.098
  920   2HG   ARG 117          HG1       ARG 117  -6.425 -10.422  11.077
  921   1HD   ARG 117          HD2       ARG 117  -8.438 -10.494  12.274
  922   2HD   ARG 117          HD1       ARG 117  -8.456  -8.929  11.468
  923    HE   ARG 117           HE       ARG 117 -10.212 -11.174  10.978
  924   1HH1  ARG 117          HH11      ARG 117  -9.064  -8.082   9.829
  925   2HH1  ARG 117          HH12      ARG 117 -10.362  -7.882   8.704
  926   1HH2  ARG 117          HH21      ARG 117 -11.918 -10.902   9.507
  927   2HH2  ARG 117          HH22      ARG 117 -11.981  -9.478   8.522
  928    H    VAL 118           HN       VAL 118  -5.476  -6.330  11.086
  929    HA   VAL 118           HA       VAL 118  -3.365  -8.120  12.031
  930    HB   VAL 118           HB       VAL 118  -1.731  -6.158  11.744
  931   1HG1  VAL 118          1HG1      VAL 118  -2.494  -7.237   9.082
  932   2HG1  VAL 118          2HG1      VAL 118  -2.079  -8.385  10.355
  933   3HG1  VAL 118          3HG1      VAL 118  -0.913  -7.158   9.859
  934   1HG2  VAL 118          1HG2      VAL 118  -2.641  -4.279  10.943
  935   2HG2  VAL 118          2HG2      VAL 118  -4.088  -5.114  10.383
  936   3HG2  VAL 118          3HG2      VAL 118  -2.641  -5.087   9.377
  937    H    ALA 119           HN       ALA 119  -4.069  -4.625  12.319
  938    HA   ALA 119           HA       ALA 119  -3.437  -4.615  15.089
  939   1HB   ALA 119          HB1       ALA 119  -4.624  -2.268  14.841
  940   2HB   ALA 119          HB2       ALA 119  -4.395  -2.615  13.127
  941   3HB   ALA 119          HB3       ALA 119  -3.004  -2.563  14.210
  942    H    LEU 120           HN       LEU 120  -6.409  -3.217  13.919
  943    HA   LEU 120           HA       LEU 120  -7.850  -4.598  16.067
  944   1HB   LEU 120          HB2       LEU 120  -8.622  -2.147  14.482
  945   2HB   LEU 120          HB1       LEU 120  -9.556  -2.846  15.790
  946    HG   LEU 120           HG       LEU 120  -6.814  -1.610  16.043
  947   1HD1  LEU 120          1HD1      LEU 120  -9.126  -0.275  15.747
  948   2HD1  LEU 120          2HD1      LEU 120  -7.786   0.302  16.737
  949   3HD1  LEU 120          3HD1      LEU 120  -9.144  -0.533  17.492
  950   1HD2  LEU 120          1HD2      LEU 120  -6.728  -3.082  17.767
  951   2HD2  LEU 120          2HD2      LEU 120  -8.482  -3.230  17.876
  952   3HD2  LEU 120          3HD2      LEU 120  -7.672  -1.820  18.557
  953    HA   PRO1135           HA       PRO1135  15.745  -9.174 -13.305
  954   1HB   PRO1135          HB2       PRO1135  13.826  -6.895 -13.287
  955   2HB   PRO1135          HB1       PRO1135  14.920  -7.434 -14.565
  956   1HG   PRO1135          HG2       PRO1135  12.308  -7.923 -14.721
  957   2HG   PRO1135          HG1       PRO1135  13.495  -9.127 -15.256
  958   1HD   PRO1135          HD2       PRO1135  11.849  -9.060 -12.766
  959   2HD   PRO1135          HD1       PRO1135  12.352 -10.450 -13.752
  960    H    GLN1136           HN       GLN1136  13.570  -7.143 -11.334
  961    HA   GLN1136           HA       GLN1136  15.243  -7.055  -9.070
  962   1HB   GLN1136          HB2       GLN1136  16.712  -5.799 -10.621
  963   2HB   GLN1136          HB1       GLN1136  15.425  -4.627 -10.865
  964   1HG   GLN1136          HG2       GLN1136  17.090  -3.805  -9.299
  965   2HG   GLN1136          HG1       GLN1136  15.524  -4.003  -8.516
  966    HA   PRO1137           HA       PRO1137  10.977  -5.151  -8.776
  967   1HB   PRO1137          HB2       PRO1137   9.578  -7.198  -7.785
  968   2HB   PRO1137          HB1       PRO1137   9.904  -7.070  -9.518
  969   1HG   PRO1137          HG2       PRO1137  11.251  -8.767  -7.456
  970   2HG   PRO1137          HG1       PRO1137  10.782  -9.181  -9.114
  971   1HD   PRO1137          HD2       PRO1137  13.331  -8.450  -8.336
  972   2HD   PRO1137          HD1       PRO1137  12.705  -8.319  -9.990
  973    H    GLU1138           HN       GLU1138  11.214  -3.812  -7.067
  974    HA   GLU1138           HA       GLU1138  11.731  -5.012  -4.434
  975   1HB   GLU1138          HB2       GLU1138  12.264  -2.531  -3.847
  976   2HB   GLU1138          HB1       GLU1138  13.452  -3.508  -4.689
  977   1HG   GLU1138          HG2       GLU1138  12.673  -2.515  -6.825
  978   2HG   GLU1138          HG1       GLU1138  11.599  -1.468  -5.900
  979   2HN   PTR1139          HN        PTR1139   9.830  -2.384  -5.966
  980   2HN   PTR1139          HN        PTR1139   9.830  -2.384  -5.966
  981    HA   PTR1139           HA       PTR1139   7.960  -2.698  -3.748
  982    HA   PTR1139           HA       PTR1139   7.960  -2.698  -3.748
  983   1HB   PTR1139          HB1       PTR1139   7.245  -0.317  -4.918
  984   1HB   PTR1139          HB1       PTR1139   7.245  -0.317  -4.918
  985   2HB   PTR1139          HB2       PTR1139   8.997  -0.328  -5.052
  986   2HB   PTR1139          HB2       PTR1139   8.997  -0.328  -5.052
  987    HD1  PTR1139           HD1      PTR1139   6.159  -0.125  -2.758
  988    HD1  PTR1139           HD1      PTR1139   6.159  -0.125  -2.758
  989    HD2  PTR1139           HD2      PTR1139  10.402  -0.319  -3.034
  990    HD2  PTR1139           HD2      PTR1139  10.402  -0.319  -3.034
  991    HE1  PTR1139           HE1      PTR1139   6.347   0.610  -0.430
  992    HE1  PTR1139           HE1      PTR1139   6.347   0.610  -0.430
  993    HE2  PTR1139           HE2      PTR1139  10.584   0.439  -0.669
  994    HE2  PTR1139           HE2      PTR1139  10.584   0.439  -0.669
  995    H    VAL1140           HN       VAL1140   7.531  -1.216  -6.929
  996    HA   VAL1140           HA       VAL1140   5.924  -3.285  -7.959
  997    HB   VAL1140           HB       VAL1140   3.710  -1.866  -7.877
  998   1HG1  VAL1140          1HG1      VAL1140   3.906  -3.172  -5.301
  999   2HG1  VAL1140          2HG1      VAL1140   4.544  -4.154  -6.617
 1000   3HG1  VAL1140          3HG1      VAL1140   2.886  -3.552  -6.690
 1001   1HG2  VAL1140          1HG2      VAL1140   3.570  -0.190  -6.463
 1002   2HG2  VAL1140          2HG2      VAL1140   5.304  -0.359  -6.173
 1003   3HG2  VAL1140          3HG2      VAL1140   4.156  -1.197  -5.136
 1004    H    ASN1141           HN       ASN1141   5.456   0.289  -7.923
 1005    HA   ASN1141           HA       ASN1141   5.020   0.579 -10.617
 1006   1HB   ASN1141          HB2       ASN1141   6.901   2.340  -9.001
 1007   2HB   ASN1141          HB1       ASN1141   6.136   2.767 -10.514
 1008   1HD2  ASN1141          1HD2      ASN1141   5.377   1.840  -7.184
 1009   2HD2  ASN1141          2HD2      ASN1141   3.966   2.813  -7.043
 1010    H    GLN1142           HN       GLN1142   7.803  -0.183  -8.703
 1011    HA   GLN1142           HA       GLN1142   9.109  -1.953  -9.391
 1012   1HB   GLN1142          HB2       GLN1142   9.547  -2.501 -11.442
 1013   2HB   GLN1142          HB1       GLN1142   8.406  -1.273 -11.917
 1014   1HG   GLN1142          HG2       GLN1142  11.404  -0.980 -11.790
 1015   2HG   GLN1142          HG1       GLN1142  10.437  -1.140 -13.249
 1016    HA   PRO1143           HA       PRO1143  12.621   0.973  -9.030
 1017   1HB   PRO1143          HB2       PRO1143  12.376   3.636  -9.458
 1018   2HB   PRO1143          HB1       PRO1143  12.521   2.486 -10.793
 1019   1HG   PRO1143          HG2       PRO1143  10.201   4.052  -9.963
 1020   2HG   PRO1143          HG1       PRO1143  10.447   3.134 -11.455
 1021   1HD   PRO1143          HD2       PRO1143   9.058   2.354  -8.998
 1022   2HD   PRO1143          HD1       PRO1143   8.958   1.621 -10.588
 1023    H    ASP1144           HN       ASP1144  10.579   0.489  -7.137
 1024    HA   ASP1144           HA       ASP1144   9.791   1.058  -5.105
 1025   1HB   ASP1144          HB2       ASP1144  11.890   0.118  -4.482
 1026   2HB   ASP1144          HB1       ASP1144  12.774   1.549  -4.986
  Start of MODEL    4
    1   1H    GLY   1          HT1       GLY   1  22.989   5.932  -3.725
    2   2H    GLY   1          HT2       GLY   1  24.614   5.999  -3.262
    3   3H    GLY   1          HT3       GLY   1  23.628   7.361  -3.083
    4   1HA   GLY   1          HA1       GLY   1  23.362   4.795  -1.611
    5   2HA   GLY   1          HA2       GLY   1  23.975   6.303  -0.949
    6    H    SER   2           HN       SER   2  21.455   4.411  -0.700
    7    HA   SER   2           HA       SER   2  19.683   6.596  -0.017
    8   1HB   SER   2          HB2       SER   2  18.979   6.267  -2.278
    9   2HB   SER   2          HB1       SER   2  18.919   4.520  -2.076
   10    HG   SER   2           HG       SER   2  17.108   6.466  -1.303
   11    HA   PRO   3           HA       PRO   3  17.771   2.523   1.830
   12   1HB   PRO   3          HB2       PRO   3  19.329   0.272   1.466
   13   2HB   PRO   3          HB1       PRO   3  17.907   0.676   0.500
   14   1HG   PRO   3          HG2       PRO   3  20.801   1.125  -0.107
   15   2HG   PRO   3          HG1       PRO   3  19.503   0.574  -1.182
   16   1HD   PRO   3          HD2       PRO   3  20.372   3.097  -1.257
   17   2HD   PRO   3          HD1       PRO   3  18.649   2.716  -1.455
   18    H    ALA   4           HN       ALA   4  18.310   3.344   3.796
   19    HA   ALA   4           HA       ALA   4  20.746   2.288   5.030
   20   1HB   ALA   4          HB1       ALA   4  20.813   4.810   4.154
   21   2HB   ALA   4          HB2       ALA   4  21.641   4.287   5.620
   22   3HB   ALA   4          HB3       ALA   4  20.072   5.084   5.732
   23    H    SER   5           HN       SER   5  20.040   1.115   6.684
   24    HA   SER   5           HA       SER   5  17.652   1.994   8.146
   25   1HB   SER   5          HB2       SER   5  19.047  -0.693   8.123
   26   2HB   SER   5          HB1       SER   5  17.580  -0.314   9.025
   27    HG   SER   5           HG       SER   5  17.941  -0.425   6.222
   28    H    GLY   6           HN       GLY   6  17.649   1.659  10.515
   29   1HA   GLY   6          HA2       GLY   6  20.162   1.494  11.898
   30   2HA   GLY   6          HA1       GLY   6  19.530   3.133  11.840
   31    H    THR   7           HN       THR   7  17.483   3.568  12.838
   32    HA   THR   7           HA       THR   7  16.760   1.582  14.892
   33    HB   THR   7           HB       THR   7  16.735   4.598  15.124
   34    HG1  THR   7           HG1      THR   7  18.425   2.595  16.179
   35   1HG2  THR   7          1HG2      THR   7  15.002   3.923  16.522
   36   2HG2  THR   7          2HG2      THR   7  16.402   4.033  17.588
   37   3HG2  THR   7          3HG2      THR   7  15.849   2.458  17.019
   38    H    SER   8           HN       SER   8  14.518   1.769  15.692
   39    HA   SER   8           HA       SER   8  12.704   2.029  13.462
   40   1HB   SER   8          HB2       SER   8  11.017   1.131  15.027
   41   2HB   SER   8          HB1       SER   8  12.470   0.134  14.992
   42    HG   SER   8           HG       SER   8  11.952   2.141  16.929
   43    H    LEU   9           HN       LEU   9  10.647   3.198  13.659
   44    HA   LEU   9           HA       LEU   9  10.889   5.635  15.298
   45   1HB   LEU   9          HB2       LEU   9  11.408   6.033  12.894
   46   2HB   LEU   9          HB1       LEU   9   9.798   5.473  12.486
   47    HG   LEU   9           HG       LEU   9  10.016   7.940  12.472
   48   1HD1  LEU   9          1HD1      LEU   9   7.890   8.223  13.152
   49   2HD1  LEU   9          2HD1      LEU   9   8.181   7.489  14.729
   50   3HD1  LEU   9          3HD1      LEU   9   7.928   6.467  13.315
   51   1HD2  LEU   9          1HD2      LEU   9  10.082   7.970  15.443
   52   2HD2  LEU   9          2HD2      LEU   9  10.619   9.187  14.285
   53   3HD2  LEU   9          3HD2      LEU   9  11.600   7.750  14.573
   54    H    SER  10           HN       SER  10   9.135   6.171  16.462
   55    HA   SER  10           HA       SER  10   6.697   4.575  16.043
   56   1HB   SER  10          HB2       SER  10   7.757   4.193  18.216
   57   2HB   SER  10          HB1       SER  10   7.704   5.922  18.561
   58    HG   SER  10           HG       SER  10   5.636   4.042  18.528
   59    H    ALA  11           HN       ALA  11   4.770   5.554  15.730
   60    HA   ALA  11           HA       ALA  11   4.498   8.417  16.204
   61   1HB   ALA  11          HB1       ALA  11   5.211   8.631  14.012
   62   2HB   ALA  11          HB2       ALA  11   3.458   8.576  13.835
   63   3HB   ALA  11          HB3       ALA  11   4.425   7.139  13.501
   64    H    ALA  12           HN       ALA  12   2.465   9.008  16.759
   65    HA   ALA  12           HA       ALA  12   0.407   6.901  16.692
   66   1HB   ALA  12          HB1       ALA  12   0.181   9.231  18.529
   67   2HB   ALA  12          HB2       ALA  12   1.348   7.966  18.910
   68   3HB   ALA  12          HB3       ALA  12  -0.361   7.566  18.741
   69    H    ILE  13           HN       ILE  13   0.246   7.859  14.391
   70    HA   ILE  13           HA       ILE  13  -1.117  10.385  14.167
   71    HB   ILE  13           HB       ILE  13   0.379   9.652  12.385
   72   1HG1  ILE  13          2HG1      ILE  13  -2.516   9.763  11.505
   73   2HG1  ILE  13          1HG1      ILE  13  -1.475  11.151  11.806
   74   1HG2  ILE  13          1HG2      ILE  13   0.150   7.284  12.483
   75   2HG2  ILE  13          2HG2      ILE  13  -0.359   7.799  10.875
   76   3HG2  ILE  13          3HG2      ILE  13  -1.566   7.374  12.088
   77   1HD1  ILE  13          1HD1      ILE  13  -1.351  11.009   9.536
   78   2HD1  ILE  13          2HD1      ILE  13  -1.495   9.251   9.525
   79   3HD1  ILE  13          3HD1      ILE  13   0.029  10.008   9.988
   80    H    HIS  14           HN       HIS  14  -2.042   7.106  14.648
   81    HA   HIS  14           HA       HIS  14  -4.661   7.298  13.516
   82   1HB   HIS  14          HB2       HIS  14  -3.482   5.325  15.480
   83   2HB   HIS  14          HB1       HIS  14  -5.071   5.165  14.741
   84    HD1  HIS  14           HD1      HIS  14  -1.509   5.655  13.460
   85    HD2  HIS  14           HD2      HIS  14  -4.983   3.550  12.599
   86    HE1  HIS  14           HE1      HIS  14  -0.958   4.247  11.452
   87    HE2  HIS  14           HE2      HIS  14  -3.089   3.011  10.922
   88    H    ARG  15           HN       ARG  15  -6.300   8.407  14.331
   89    HA   ARG  15           HA       ARG  15  -6.404   8.814  17.225
   90   1HB   ARG  15          HB2       ARG  15  -7.685  10.879  16.781
   91   2HB   ARG  15          HB1       ARG  15  -6.066  10.917  16.087
   92   1HG   ARG  15          HG2       ARG  15  -6.965  10.388  13.891
   93   2HG   ARG  15          HG1       ARG  15  -8.586  10.246  14.565
   94   1HD   ARG  15          HD2       ARG  15  -6.906  12.746  14.304
   95   2HD   ARG  15          HD1       ARG  15  -8.426  12.370  13.498
   96    HE   ARG  15           HE       ARG  15  -8.878  12.307  16.252
   97   1HH1  ARG  15          HH11      ARG  15  -8.069  14.606  13.755
   98   2HH1  ARG  15          HH12      ARG  15  -8.828  15.938  14.560
   99   1HH2  ARG  15          HH21      ARG  15  -9.878  14.057  17.314
  100   2HH2  ARG  15          HH22      ARG  15  -9.854  15.627  16.581
  101    H    THR  16           HN       THR  16  -7.908   7.474  14.620
  102    HA   THR  16           HA       THR  16 -10.197   6.692  16.249
  103    HB   THR  16           HB       THR  16 -11.763   7.086  14.371
  104    HG1  THR  16           HG1      THR  16 -11.037   8.364  12.631
  105   1HG2  THR  16          1HG2      THR  16 -10.706   9.774  14.499
  106   2HG2  THR  16          2HG2      THR  16 -10.779   9.005  16.085
  107   3HG2  THR  16          3HG2      THR  16 -12.233   9.124  15.094
  108    H    GLN  17           HN       GLN  17 -10.955   5.794  13.182
  109    HA   GLN  17           HA       GLN  17  -9.662   3.187  13.526
  110   1HB   GLN  17          HB2       GLN  17 -11.396   2.386  11.909
  111   2HB   GLN  17          HB1       GLN  17 -12.051   3.015  13.413
  112   1HG   GLN  17          HG2       GLN  17 -13.403   3.760  11.580
  113   2HG   GLN  17          HG1       GLN  17 -12.556   5.140  12.272
  114    H    LEU  18           HN       LEU  18  -8.443   5.642  12.397
  115    HA   LEU  18           HA       LEU  18  -8.223   5.564   9.620
  116   1HB   LEU  18          HB2       LEU  18  -7.457   7.424  11.011
  117   2HB   LEU  18          HB1       LEU  18  -6.186   6.418  11.674
  118    HG   LEU  18           HG       LEU  18  -5.179   6.255   9.413
  119   1HD1  LEU  18          1HD1      LEU  18  -6.366   6.801   7.624
  120   2HD1  LEU  18          2HD1      LEU  18  -6.376   8.481   8.161
  121   3HD1  LEU  18          3HD1      LEU  18  -7.678   7.395   8.642
  122   1HD2  LEU  18          1HD2      LEU  18  -3.929   7.928  10.155
  123   2HD2  LEU  18          2HD2      LEU  18  -5.255   8.498  11.170
  124   3HD2  LEU  18          3HD2      LEU  18  -5.100   9.079   9.511
  125    H    TRP  19           HN       TRP  19  -6.346   4.928   8.331
  126    HA   TRP  19           HA       TRP  19  -4.814   2.680   9.394
  127   1HB   TRP  19          HB2       TRP  19  -5.321   1.664   6.959
  128   2HB   TRP  19          HB1       TRP  19  -6.287   1.284   8.379
  129    HD1  TRP  19           HD1      TRP  19  -8.698   1.127   7.601
  130    HE1  TRP  19           HE1      TRP  19 -10.277   2.541   6.146
  131    HE3  TRP  19           HE3      TRP  19  -5.384   4.696   6.012
  132    HZ2  TRP  19           HZ2      TRP  19 -10.143   4.855   4.543
  133    HZ3  TRP  19           HZ3      TRP  19  -6.197   6.470   4.521
  134    HH2  TRP  19           HH2      TRP  19  -8.527   6.547   3.801
  135    H    PHE  20           HN       PHE  20  -3.645   5.034   9.125
  136    HA   PHE  20           HA       PHE  20  -2.013   4.726   6.699
  137   1HB   PHE  20          HB2       PHE  20  -3.470   6.638   6.345
  138   2HB   PHE  20          HB1       PHE  20  -3.005   7.320   7.900
  139    HD1  PHE  20           HD1      PHE  20  -1.845   9.265   7.541
  140    HD2  PHE  20           HD2      PHE  20  -1.008   5.893   5.086
  141    HE1  PHE  20           HE1      PHE  20  -0.028  10.515   6.450
  142    HE2  PHE  20           HE2      PHE  20   0.812   7.135   3.992
  143    HZ   PHE  20           HZ       PHE  20   1.304   9.450   4.674
  144    H    HIS  21           HN       HIS  21   0.017   4.271   7.221
  145    HA   HIS  21           HA       HIS  21   1.258   5.669   9.472
  146   1HB   HIS  21          HB2       HIS  21   0.436   3.464  10.285
  147   2HB   HIS  21          HB1       HIS  21   1.457   2.674   9.090
  148    HD1  HIS  21           HD1      HIS  21   2.238   5.464  11.564
  149    HD2  HIS  21           HD2      HIS  21   3.524   1.656  10.525
  150    HE1  HIS  21           HE1      HIS  21   4.226   5.002  13.032
  151    HE2  HIS  21           HE2      HIS  21   4.949   2.665  12.429
  152    H    GLY  22           HN       GLY  22   3.727   5.255   9.472
  153   1HA   GLY  22          HA2       GLY  22   4.632   5.434   6.686
  154   2HA   GLY  22          HA1       GLY  22   5.448   6.124   8.073
  155    H    ARG  23           HN       ARG  23   7.169   5.130   8.741
  156    HA   ARG  23           HA       ARG  23   8.458   3.100   7.561
  157   1HB   ARG  23          HB2       ARG  23   9.368   4.546   9.363
  158   2HB   ARG  23          HB1       ARG  23   8.519   3.566  10.542
  159   1HG   ARG  23          HG2       ARG  23   9.840   1.660  10.040
  160   2HG   ARG  23          HG1       ARG  23  10.552   2.450   8.632
  161   1HD   ARG  23          HD2       ARG  23  11.651   4.069  10.075
  162   2HD   ARG  23          HD1       ARG  23  10.899   3.340  11.495
  163    HE   ARG  23           HE       ARG  23  12.579   1.806  11.491
  164   1HH1  ARG  23          HH11      ARG  23  12.301   3.097   8.260
  165   2HH1  ARG  23          HH12      ARG  23  13.612   2.154   7.638
  166   1HH2  ARG  23          HH21      ARG  23  14.308   0.574  10.675
  167   2HH2  ARG  23          HH22      ARG  23  14.754   0.726   9.008
  168    H    ILE  24           HN       ILE  24   7.396   1.319   6.946
  169    HA   ILE  24           HA       ILE  24   6.722  -0.587   9.063
  170    HB   ILE  24           HB       ILE  24   4.969   0.214   6.763
  171   1HG1  ILE  24          2HG1      ILE  24   4.531  -0.250   9.710
  172   2HG1  ILE  24          1HG1      ILE  24   4.576   1.301   8.879
  173   1HG2  ILE  24          1HG2      ILE  24   3.565  -1.789   7.264
  174   2HG2  ILE  24          2HG2      ILE  24   4.913  -2.428   8.209
  175   3HG2  ILE  24          3HG2      ILE  24   5.100  -2.154   6.476
  176   1HD1  ILE  24          1HD1      ILE  24   2.340  -0.244   9.452
  177   2HD1  ILE  24          2HD1      ILE  24   2.589  -0.421   7.716
  178   3HD1  ILE  24          3HD1      ILE  24   2.416   1.184   8.423
  179    H    SER  25           HN       SER  25   8.557  -1.752   8.757
  180    HA   SER  25           HA       SER  25  10.056  -2.380   6.650
  181   1HB   SER  25          HB2       SER  25   9.100  -4.351   8.733
  182   2HB   SER  25          HB1       SER  25  10.484  -4.610   7.673
  183    HG   SER  25           HG       SER  25  11.518  -2.882   8.635
  184    H    ARG  26           HN       ARG  26   9.104  -2.497   4.635
  185    HA   ARG  26           HA       ARG  26   6.846  -3.882   3.893
  186   1HB   ARG  26          HB2       ARG  26   7.567  -2.515   2.200
  187   2HB   ARG  26          HB1       ARG  26   9.255  -2.917   2.443
  188   1HG   ARG  26          HG2       ARG  26   7.604  -5.116   1.413
  189   2HG   ARG  26          HG1       ARG  26   7.738  -3.722   0.345
  190   1HD   ARG  26          HD2       ARG  26  10.115  -5.117   1.569
  191   2HD   ARG  26          HD1       ARG  26   9.445  -5.543   0.000
  192    HE   ARG  26           HE       ARG  26  10.317  -3.588  -0.897
  193   1HH1  ARG  26          HH11      ARG  26  10.933  -3.727   2.547
  194   2HH1  ARG  26          HH12      ARG  26  11.952  -2.330   2.542
  195   1HH2  ARG  26          HH21      ARG  26  11.669  -1.766  -0.889
  196   2HH2  ARG  26          HH22      ARG  26  12.371  -1.221   0.598
  197    H    GLU  27           HN       GLU  27  10.174  -5.144   3.533
  198    HA   GLU  27           HA       GLU  27   9.474  -7.689   2.704
  199   1HB   GLU  27          HB2       GLU  27  11.683  -8.415   3.399
  200   2HB   GLU  27          HB1       GLU  27  11.774  -6.833   2.638
  201   1HG   GLU  27          HG2       GLU  27  11.713  -7.238   5.616
  202   2HG   GLU  27          HG1       GLU  27  13.199  -7.148   4.673
  203    H    GLU  28           HN       GLU  28   9.729  -6.442   6.004
  204    HA   GLU  28           HA       GLU  28   9.270  -9.029   7.184
  205   1HB   GLU  28          HB2       GLU  28  10.635  -7.357   8.332
  206   2HB   GLU  28          HB1       GLU  28   9.254  -6.275   8.422
  207   1HG   GLU  28          HG2       GLU  28   8.086  -7.872   9.846
  208   2HG   GLU  28          HG1       GLU  28   9.465  -8.966   9.751
  209    H    SER  29           HN       SER  29   7.329  -6.223   6.378
  210    HA   SER  29           HA       SER  29   5.057  -6.796   7.900
  211   1HB   SER  29          HB2       SER  29   5.331  -4.646   6.806
  212   2HB   SER  29          HB1       SER  29   5.280  -5.411   5.220
  213    HG   SER  29           HG       SER  29   3.220  -4.842   6.994
  214    H    GLN  30           HN       GLN  30   6.170  -8.089   4.851
  215    HA   GLN  30           HA       GLN  30   3.801  -9.281   3.972
  216   1HB   GLN  30          HB2       GLN  30   6.646 -10.230   3.592
  217   2HB   GLN  30          HB1       GLN  30   5.259 -10.794   2.670
  218   1HG   GLN  30          HG2       GLN  30   4.921  -8.550   1.789
  219   2HG   GLN  30          HG1       GLN  30   6.301  -7.973   2.720
  220    H    ARG  31           HN       ARG  31   6.035 -10.181   6.468
  221    HA   ARG  31           HA       ARG  31   5.135 -12.893   6.705
  222   1HB   ARG  31          HB2       ARG  31   7.393 -12.253   7.397
  223   2HB   ARG  31          HB1       ARG  31   6.730 -11.164   8.605
  224   1HG   ARG  31          HG2       ARG  31   7.481 -13.163   9.683
  225   2HG   ARG  31          HG1       ARG  31   5.719 -13.111   9.749
  226   1HD   ARG  31          HD2       ARG  31   7.251 -14.630   7.648
  227   2HD   ARG  31          HD1       ARG  31   6.739 -15.347   9.173
  228    HE   ARG  31           HE       ARG  31   4.491 -14.211   8.000
  229   1HH1  ARG  31          HH11      ARG  31   6.767 -16.764   7.316
  230   2HH1  ARG  31          HH12      ARG  31   5.621 -17.722   6.440
  231   1HH2  ARG  31          HH21      ARG  31   2.982 -15.467   6.849
  232   2HH2  ARG  31          HH22      ARG  31   3.472 -16.985   6.174
  233    H    LEU  32           HN       LEU  32   4.476  -9.838   8.363
  234    HA   LEU  32           HA       LEU  32   2.774 -10.995  10.342
  235   1HB   LEU  32          HB2       LEU  32   3.087  -8.153   9.384
  236   2HB   LEU  32          HB1       LEU  32   2.041  -8.618  10.711
  237    HG   LEU  32           HG       LEU  32   4.022  -9.481  11.931
  238   1HD1  LEU  32          1HD1      LEU  32   5.539 -10.026  10.204
  239   2HD1  LEU  32          2HD1      LEU  32   6.257  -8.676  11.083
  240   3HD1  LEU  32          3HD1      LEU  32   5.470  -8.397   9.531
  241   1HD2  LEU  32          1HD2      LEU  32   4.579  -7.430  12.785
  242   2HD2  LEU  32          2HD2      LEU  32   3.094  -7.026  11.925
  243   3HD2  LEU  32          3HD2      LEU  32   4.659  -6.666  11.198
  244    H    ILE  33           HN       ILE  33   2.024  -8.931   7.527
  245    HA   ILE  33           HA       ILE  33  -0.779  -9.456   7.687
  246    HB   ILE  33           HB       ILE  33   0.887  -8.211   5.494
  247   1HG1  ILE  33          2HG1      ILE  33  -0.226  -6.119   6.278
  248   2HG1  ILE  33          1HG1      ILE  33  -0.952  -7.037   7.592
  249   1HG2  ILE  33          1HG2      ILE  33  -1.978  -8.929   5.584
  250   2HG2  ILE  33          2HG2      ILE  33  -0.890  -8.768   4.206
  251   3HG2  ILE  33          3HG2      ILE  33  -1.584  -7.329   4.955
  252   1HD1  ILE  33          1HD1      ILE  33   2.016  -6.918   7.208
  253   2HD1  ILE  33          2HD1      ILE  33   1.102  -7.351   8.653
  254   3HD1  ILE  33          3HD1      ILE  33   1.136  -5.677   8.099
  255    H    GLY  34           HN       GLY  34   1.778 -11.344   6.614
  256   1HA   GLY  34          HA2       GLY  34   0.191 -12.668   4.537
  257   2HA   GLY  34          HA1       GLY  34   1.894 -12.948   4.871
  258    H    GLN  35           HN       GLN  35  -0.283 -12.751   7.490
  259    HA   GLN  35           HA       GLN  35  -0.131 -15.652   7.874
  260   1HB   GLN  35          HB2       GLN  35  -0.327 -15.294  10.216
  261   2HB   GLN  35          HB1       GLN  35   0.847 -14.113   9.658
  262   1HG   GLN  35          HG2       GLN  35  -0.473 -12.896  11.107
  263   2HG   GLN  35          HG1       GLN  35  -1.155 -12.501   9.530
  264    H    GLN  36           HN       GLN  36  -2.111 -13.067   6.944
  265    HA   GLN  36           HA       GLN  36  -4.585 -14.002   8.003
  266   1HB   GLN  36          HB2       GLN  36  -3.715 -11.856   6.192
  267   2HB   GLN  36          HB1       GLN  36  -5.316 -12.498   5.846
  268   1HG   GLN  36          HG2       GLN  36  -6.200 -11.437   7.572
  269   2HG   GLN  36          HG1       GLN  36  -4.978 -12.071   8.670
  270    H    GLY  37           HN       GLY  37  -6.435 -14.452   6.314
  271   1HA   GLY  37          HA2       GLY  37  -5.444 -16.202   4.166
  272   2HA   GLY  37          HA1       GLY  37  -6.552 -16.865   5.363
  273    H    LEU  38           HN       LEU  38  -7.076 -13.580   4.614
  274    HA   LEU  38           HA       LEU  38  -9.610 -14.212   3.409
  275   1HB   LEU  38          HB2       LEU  38  -8.278 -11.570   3.992
  276   2HB   LEU  38          HB1       LEU  38  -9.907 -11.741   3.369
  277    HG   LEU  38           HG       LEU  38  -9.999 -11.313   5.737
  278   1HD1  LEU  38          1HD1      LEU  38 -11.392 -13.217   4.498
  279   2HD1  LEU  38          2HD1      LEU  38 -11.604 -12.837   6.208
  280   3HD1  LEU  38          3HD1      LEU  38 -10.603 -14.207   5.726
  281   1HD2  LEU  38          1HD2      LEU  38  -8.537 -13.867   6.293
  282   2HD2  LEU  38          2HD2      LEU  38  -8.875 -12.518   7.378
  283   3HD2  LEU  38          3HD2      LEU  38  -7.668 -12.343   6.103
  284    H    VAL  39           HN       VAL  39 -10.149 -12.387   1.577
  285    HA   VAL  39           HA       VAL  39  -8.678 -13.274  -0.724
  286    HB   VAL  39           HB       VAL  39 -10.300 -11.980  -2.022
  287   1HG1  VAL  39          1HG1      VAL  39 -11.901 -13.558  -1.816
  288   2HG1  VAL  39          2HG1      VAL  39 -12.060 -13.322  -0.075
  289   3HG1  VAL  39          3HG1      VAL  39 -10.736 -14.295  -0.716
  290   1HG2  VAL  39          1HG2      VAL  39 -12.249 -11.202  -0.260
  291   2HG2  VAL  39          2HG2      VAL  39 -11.074 -10.129  -1.020
  292   3HG2  VAL  39          3HG2      VAL  39 -10.770 -10.765   0.597
  293    H    ASP  40           HN       ASP  40  -8.443 -11.479  -2.500
  294    HA   ASP  40           HA       ASP  40  -6.278  -9.833  -1.649
  295   1HB   ASP  40          HB2       ASP  40  -7.793  -9.427  -4.217
  296   2HB   ASP  40          HB1       ASP  40  -6.078  -9.194  -3.909
  297    H    GLY  41           HN       GLY  41  -8.084  -9.209   0.050
  298   1HA   GLY  41          HA2       GLY  41  -8.997  -6.516  -0.806
  299   2HA   GLY  41          HA1       GLY  41 -10.122  -7.603   0.002
  300    H    LEU  42           HN       LEU  42  -7.261  -8.263   1.410
  301    HA   LEU  42           HA       LEU  42  -7.875  -6.393   3.573
  302   1HB   LEU  42          HB2       LEU  42  -6.284  -8.954   3.493
  303   2HB   LEU  42          HB1       LEU  42  -6.288  -7.888   4.883
  304    HG   LEU  42           HG       LEU  42  -7.833  -9.851   5.059
  305   1HD1  LEU  42          1HD1      LEU  42  -9.686  -7.585   5.128
  306   2HD1  LEU  42          2HD1      LEU  42  -8.154  -7.303   5.954
  307   3HD1  LEU  42          3HD1      LEU  42  -9.165  -8.670   6.417
  308   1HD2  LEU  42          1HD2      LEU  42  -9.900  -9.852   3.818
  309   2HD2  LEU  42          2HD2      LEU  42  -8.541  -9.872   2.694
  310   3HD2  LEU  42          3HD2      LEU  42  -9.434  -8.377   2.975
  311    H    PHE  43           HN       PHE  43  -6.966  -4.555   2.998
  312    HA   PHE  43           HA       PHE  43  -4.046  -4.597   2.660
  313   1HB   PHE  43          HB2       PHE  43  -4.176  -2.828   0.994
  314   2HB   PHE  43          HB1       PHE  43  -5.077  -4.247   0.477
  315    HD1  PHE  43           HD1      PHE  43  -7.106  -2.766   2.874
  316    HD2  PHE  43           HD2      PHE  43  -5.695  -2.144  -1.092
  317    HE1  PHE  43           HE1      PHE  43  -9.031  -1.315   2.422
  318    HE2  PHE  43           HE2      PHE  43  -7.627  -0.697  -1.552
  319    HZ   PHE  43           HZ       PHE  43  -9.294  -0.278   0.207
  320    H    LEU  44           HN       LEU  44  -2.993  -2.480   2.999
  321    HA   LEU  44           HA       LEU  44  -4.379  -0.691   4.860
  322   1HB   LEU  44          HB2       LEU  44  -3.165  -2.359   6.226
  323   2HB   LEU  44          HB1       LEU  44  -1.679  -1.943   5.398
  324    HG   LEU  44           HG       LEU  44  -1.860   0.376   6.333
  325   1HD1  LEU  44          1HD1      LEU  44  -3.829  -0.596   8.328
  326   2HD1  LEU  44          2HD1      LEU  44  -4.438  -0.111   6.747
  327   3HD1  LEU  44          3HD1      LEU  44  -3.528   1.035   7.729
  328   1HD2  LEU  44          1HD2      LEU  44  -1.517  -2.085   7.958
  329   2HD2  LEU  44          2HD2      LEU  44  -1.588  -0.542   8.809
  330   3HD2  LEU  44          3HD2      LEU  44  -0.362  -0.809   7.569
  331    H    VAL  45           HN       VAL  45  -3.594   1.452   4.786
  332    HA   VAL  45           HA       VAL  45  -1.769   1.955   2.536
  333    HB   VAL  45           HB       VAL  45  -3.624   3.869   3.972
  334   1HG1  VAL  45          1HG1      VAL  45  -1.578   4.950   3.095
  335   2HG1  VAL  45          2HG1      VAL  45  -3.040   5.481   2.265
  336   3HG1  VAL  45          3HG1      VAL  45  -1.961   4.319   1.493
  337   1HG2  VAL  45          1HG2      VAL  45  -4.829   3.850   1.787
  338   2HG2  VAL  45          2HG2      VAL  45  -4.882   2.313   2.651
  339   3HG2  VAL  45          3HG2      VAL  45  -3.788   2.517   1.283
  340    H    ARG  46           HN       ARG  46   0.144   1.517   3.527
  341    HA   ARG  46           HA       ARG  46   0.975   3.442   5.593
  342   1HB   ARG  46          HB2       ARG  46   2.376   1.778   6.592
  343   2HB   ARG  46          HB1       ARG  46   0.777   1.071   6.420
  344   1HG   ARG  46          HG2       ARG  46   2.321  -0.601   5.796
  345   2HG   ARG  46          HG1       ARG  46   1.610  -0.001   4.294
  346   1HD   ARG  46          HD2       ARG  46   3.524   1.246   3.763
  347   2HD   ARG  46          HD1       ARG  46   4.166   1.111   5.393
  348    HE   ARG  46           HE       ARG  46   3.902  -1.370   3.935
  349   1HH1  ARG  46          HH11      ARG  46   5.939   1.297   4.898
  350   2HH1  ARG  46          HH12      ARG  46   7.409   0.491   4.473
  351   1HH2  ARG  46          HH21      ARG  46   5.855  -2.415   3.357
  352   2HH2  ARG  46          HH22      ARG  46   7.358  -1.601   3.634
  353    H    GLU  47           HN       GLU  47   3.510   3.683   5.534
  354    HA   GLU  47           HA       GLU  47   4.387   3.334   2.779
  355   1HB   GLU  47          HB2       GLU  47   5.044   5.660   2.555
  356   2HB   GLU  47          HB1       GLU  47   3.321   5.514   2.830
  357   1HG   GLU  47          HG2       GLU  47   3.660   6.092   5.185
  358   2HG   GLU  47          HG1       GLU  47   5.386   6.287   4.878
  359    H    SER  48           HN       SER  48   6.607   4.908   2.828
  360    HA   SER  48           HA       SER  48   8.306   3.550   4.799
  361   1HB   SER  48          HB2       SER  48   8.702   2.606   2.605
  362   2HB   SER  48          HB1       SER  48   8.790   4.195   1.869
  363    HG   SER  48           HG       SER  48  10.700   4.487   3.260
  364    H    GLN  49           HN       GLN  49   9.501   4.909   6.055
  365    HA   GLN  49           HA       GLN  49   9.305   7.765   5.435
  366   1HB   GLN  49          HB2       GLN  49   9.851   8.177   7.743
  367   2HB   GLN  49          HB1       GLN  49   8.611   6.929   7.695
  368   1HG   GLN  49          HG2       GLN  49  10.163   6.275   9.336
  369   2HG   GLN  49          HG1       GLN  49  10.451   5.240   7.940
  370    H    ARG  50           HN       ARG  50  11.178   5.530   4.440
  371    HA   ARG  50           HA       ARG  50  13.761   6.811   4.911
  372   1HB   ARG  50          HB2       ARG  50  13.864   4.450   5.246
  373   2HB   ARG  50          HB1       ARG  50  12.938   4.131   3.787
  374   1HG   ARG  50          HG2       ARG  50  15.159   3.561   3.290
  375   2HG   ARG  50          HG1       ARG  50  14.857   5.106   2.492
  376   1HD   ARG  50          HD2       ARG  50  16.187   4.827   5.186
  377   2HD   ARG  50          HD1       ARG  50  17.070   4.935   3.664
  378    HE   ARG  50           HE       ARG  50  15.362   7.121   3.775
  379   1HH1  ARG  50          HH11      ARG  50  18.094   5.875   5.550
  380   2HH1  ARG  50          HH12      ARG  50  18.651   7.440   6.034
  381   1HH2  ARG  50          HH21      ARG  50  16.092   9.181   4.409
  382   2HH2  ARG  50          HH22      ARG  50  17.516   9.318   5.386
  383    H    ASN  51           HN       ASN  51  12.551   5.059   2.061
  384    HA   ASN  51           HA       ASN  51  13.730   6.461   0.054
  385   1HB   ASN  51          HB2       ASN  51  11.676   5.930  -1.300
  386   2HB   ASN  51          HB1       ASN  51  12.329   4.564  -0.394
  387   1HD2  ASN  51          1HD2      ASN  51  11.083   6.426   1.943
  388   2HD2  ASN  51          2HD2      ASN  51   9.489   5.809   2.019
  389    HA   PRO  52           HA       PRO  52  12.639  10.821   0.601
  390   1HB   PRO  52          HB2       PRO  52  12.875  10.568  -2.380
  391   2HB   PRO  52          HB1       PRO  52  13.481  11.842  -1.313
  392   1HG   PRO  52          HG2       PRO  52  15.101   9.922  -2.231
  393   2HG   PRO  52          HG1       PRO  52  15.274  10.573  -0.592
  394   1HD   PRO  52          HD2       PRO  52  14.289   7.932  -1.468
  395   2HD   PRO  52          HD1       PRO  52  14.967   8.423   0.096
  396    H    GLN  53           HN       GLN  53  11.121   8.657  -1.717
  397    HA   GLN  53           HA       GLN  53   8.599  10.166  -1.453
  398   1HB   GLN  53          HB2       GLN  53   9.568   8.521  -3.799
  399   2HB   GLN  53          HB1       GLN  53   7.999   9.306  -3.683
  400   1HG   GLN  53          HG2       GLN  53   9.065  11.483  -3.625
  401   2HG   GLN  53          HG1       GLN  53  10.652  10.724  -3.668
  402    H    GLY  54           HN       GLY  54   8.447   8.760   0.522
  403   1HA   GLY  54          HA2       GLY  54   7.845   5.961  -0.094
  404   2HA   GLY  54          HA1       GLY  54   8.161   6.619   1.491
  405    H    PHE  55           HN       PHE  55   5.794   6.008  -0.917
  406    HA   PHE  55           HA       PHE  55   3.635   6.226   1.027
  407   1HB   PHE  55          HB2       PHE  55   3.487   7.371  -1.788
  408   2HB   PHE  55          HB1       PHE  55   2.146   7.266  -0.654
  409    HD1  PHE  55           HD1      PHE  55   5.623   8.628  -0.772
  410    HD2  PHE  55           HD2      PHE  55   1.593   9.171   0.481
  411    HE1  PHE  55           HE1      PHE  55   6.203  10.848   0.117
  412    HE2  PHE  55           HE2      PHE  55   2.166  11.393   1.370
  413    HZ   PHE  55           HZ       PHE  55   4.473  12.235   1.188
  414    H    VAL  56           HN       VAL  56   2.939   4.188   1.152
  415    HA   VAL  56           HA       VAL  56   2.637   2.637  -1.323
  416    HB   VAL  56           HB       VAL  56   4.114   1.085  -0.697
  417   1HG1  VAL  56          1HG1      VAL  56   4.754   1.813   2.037
  418   2HG1  VAL  56          2HG1      VAL  56   4.822   3.195   0.944
  419   3HG1  VAL  56          3HG1      VAL  56   5.781   1.760   0.610
  420   1HG2  VAL  56          1HG2      VAL  56   2.418  -0.191   0.355
  421   2HG2  VAL  56          2HG2      VAL  56   2.440   0.827   1.796
  422   3HG2  VAL  56          3HG2      VAL  56   3.810  -0.218   1.434
  423    H    LEU  57           HN       LEU  57   1.317   0.773  -1.171
  424    HA   LEU  57           HA       LEU  57  -0.818   0.908   0.831
  425   1HB   LEU  57          HB2       LEU  57  -1.438   1.714  -1.551
  426   2HB   LEU  57          HB1       LEU  57  -1.254   0.036  -2.024
  427    HG   LEU  57           HG       LEU  57  -3.265   1.186  -0.100
  428   1HD1  LEU  57          1HD1      LEU  57  -3.390  -0.041  -2.826
  429   2HD1  LEU  57          2HD1      LEU  57  -4.080   1.478  -2.252
  430   3HD1  LEU  57          3HD1      LEU  57  -4.791  -0.059  -1.755
  431   1HD2  LEU  57          1HD2      LEU  57  -2.508  -1.673  -0.625
  432   2HD2  LEU  57          2HD2      LEU  57  -4.084  -1.206   0.014
  433   3HD2  LEU  57          3HD2      LEU  57  -2.616  -0.832   0.923
  434    H    SER  58           HN       SER  58  -0.895  -0.986   1.929
  435    HA   SER  58           HA       SER  58   0.629  -3.243   0.857
  436   1HB   SER  58          HB2       SER  58  -0.514  -2.942   3.640
  437   2HB   SER  58          HB1       SER  58   0.756  -4.047   3.111
  438    HG   SER  58           HG       SER  58   1.011  -1.237   2.924
  439    H    LEU  59           HN       LEU  59  -0.411  -4.835  -0.114
  440    HA   LEU  59           HA       LEU  59  -3.271  -5.166   0.398
  441   1HB   LEU  59          HB2       LEU  59  -1.554  -6.206  -1.854
  442   2HB   LEU  59          HB1       LEU  59  -3.289  -6.429  -1.715
  443    HG   LEU  59           HG       LEU  59  -1.893  -3.766  -2.000
  444   1HD1  LEU  59          1HD1      LEU  59  -3.749  -4.781  -4.058
  445   2HD1  LEU  59          2HD1      LEU  59  -2.161  -5.543  -3.978
  446   3HD1  LEU  59          3HD1      LEU  59  -2.294  -3.803  -4.223
  447   1HD2  LEU  59          1HD2      LEU  59  -4.691  -4.568  -1.450
  448   2HD2  LEU  59          2HD2      LEU  59  -4.432  -3.235  -2.574
  449   3HD2  LEU  59          3HD2      LEU  59  -3.796  -3.140  -0.933
  450    H    CYS  60           HN       CYS  60  -4.074  -7.459   0.096
  451    HA   CYS  60           HA       CYS  60  -2.350  -9.508   1.176
  452   1HB   CYS  60          HB2       CYS  60  -3.560  -8.457   3.133
  453   2HB   CYS  60          HB1       CYS  60  -5.070  -8.953   2.375
  454    HG   CYS  60           HG       CYS  60  -2.901 -11.464   2.734
  455    H    HIS  61           HN       HIS  61  -2.467  -9.968  -0.969
  456    HA   HIS  61           HA       HIS  61  -4.878 -10.554  -2.305
  457   1HB   HIS  61          HB2       HIS  61  -3.189  -9.767  -3.585
  458   2HB   HIS  61          HB1       HIS  61  -1.962 -10.711  -2.808
  459    HD1  HIS  61           HD1      HIS  61  -2.657 -13.514  -3.506
  460    HD2  HIS  61           HD2      HIS  61  -3.339 -10.397  -6.136
  461    HE1  HIS  61           HE1      HIS  61  -2.795 -14.577  -5.775
  462    HE2  HIS  61           HE2      HIS  61  -2.998 -12.640  -7.363
  463    H    LEU  62           HN       LEU  62  -5.081 -12.863  -3.372
  464    HA   LEU  62           HA       LEU  62  -5.024 -14.670  -1.063
  465   1HB   LEU  62          HB2       LEU  62  -6.596 -16.074  -2.355
  466   2HB   LEU  62          HB1       LEU  62  -7.173 -14.442  -2.081
  467    HG   LEU  62           HG       LEU  62  -6.406 -13.883  -4.419
  468   1HD1  LEU  62          1HD1      LEU  62  -5.899 -16.830  -4.427
  469   2HD1  LEU  62          2HD1      LEU  62  -4.868 -15.516  -4.996
  470   3HD1  LEU  62          3HD1      LEU  62  -6.307 -15.965  -5.910
  471   1HD2  LEU  62          1HD2      LEU  62  -8.766 -14.562  -3.639
  472   2HD2  LEU  62          2HD2      LEU  62  -8.433 -16.085  -4.466
  473   3HD2  LEU  62          3HD2      LEU  62  -8.412 -14.569  -5.367
  474    H    GLN  63           HN       GLN  63  -2.710 -14.225  -2.068
  475    HA   GLN  63           HA       GLN  63  -1.894 -16.870  -2.332
  476   1HB   GLN  63          HB2       GLN  63  -1.229 -14.946  -4.556
  477   2HB   GLN  63          HB1       GLN  63  -0.276 -16.386  -4.241
  478   1HG   GLN  63          HG2       GLN  63  -2.229 -17.783  -4.637
  479   2HG   GLN  63          HG1       GLN  63  -3.202 -16.347  -4.933
  480    H    LYS  64           HN       LYS  64  -1.204 -13.448  -2.138
  481    HA   LYS  64           HA       LYS  64   0.763 -14.039  -0.106
  482   1HB   LYS  64          HB2       LYS  64   2.588 -12.798  -1.159
  483   2HB   LYS  64          HB1       LYS  64   2.100 -14.166  -2.149
  484   1HG   LYS  64          HG2       LYS  64   0.834 -12.678  -3.605
  485   2HG   LYS  64          HG1       LYS  64   1.299 -11.299  -2.607
  486   1HD   LYS  64          HD2       LYS  64   2.704 -11.446  -4.594
  487   2HD   LYS  64          HD1       LYS  64   3.655 -11.719  -3.132
  488   1HE   LYS  64          HE2       LYS  64   4.262 -13.301  -4.886
  489   2HE   LYS  64          HE1       LYS  64   3.547 -14.129  -3.504
  490   1HZ   LYS  64          HZ1       LYS  64   2.686 -14.979  -5.596
  491   2HZ   LYS  64          HZ2       LYS  64   2.132 -13.440  -6.023
  492   3HZ   LYS  64          HZ3       LYS  64   1.453 -14.244  -4.700
  493    H    VAL  65           HN       VAL  65   1.982 -11.591   0.064
  494    HA   VAL  65           HA       VAL  65  -0.090  -9.547   0.251
  495    HB   VAL  65           HB       VAL  65   0.663  -8.908   2.519
  496   1HG1  VAL  65          1HG1      VAL  65  -0.210 -11.135   3.624
  497   2HG1  VAL  65          2HG1      VAL  65  -0.592 -11.541   1.954
  498   3HG1  VAL  65          3HG1      VAL  65  -1.283 -10.096   2.693
  499   1HG2  VAL  65          1HG2      VAL  65   2.174 -11.520   2.479
  500   2HG2  VAL  65          2HG2      VAL  65   2.032 -10.411   3.842
  501   3HG2  VAL  65          3HG2      VAL  65   2.909  -9.920   2.395
  502    H    LYS  66           HN       LYS  66   0.706  -7.629  -0.519
  503    HA   LYS  66           HA       LYS  66   3.600  -7.207  -0.374
  504   1HB   LYS  66          HB2       LYS  66   3.724  -6.529  -2.731
  505   2HB   LYS  66          HB1       LYS  66   3.276  -8.215  -2.542
  506   1HG   LYS  66          HG2       LYS  66   1.268  -6.036  -3.023
  507   2HG   LYS  66          HG1       LYS  66   2.056  -6.928  -4.323
  508   1HD   LYS  66          HD2       LYS  66   1.200  -9.038  -3.235
  509   2HD   LYS  66          HD1       LYS  66   0.231  -8.007  -2.184
  510   1HE   LYS  66          HE2       LYS  66  -1.086  -8.783  -4.071
  511   2HE   LYS  66          HE1       LYS  66  -0.865  -7.036  -4.136
  512   1HZ   LYS  66          HZ1       LYS  66   0.807  -8.961  -5.652
  513   2HZ   LYS  66          HZ2       LYS  66   0.779  -7.278  -5.817
  514   3HZ   LYS  66          HZ3       LYS  66  -0.559  -8.195  -6.294
  515    H    HIS  67           HN       HIS  67   4.022  -4.967  -1.646
  516    HA   HIS  67           HA       HIS  67   2.151  -2.988  -0.519
  517   1HB   HIS  67          HB2       HIS  67   5.171  -2.813  -0.561
  518   2HB   HIS  67          HB1       HIS  67   4.069  -1.625   0.123
  519    HD1  HIS  67           HD1      HIS  67   2.769  -2.375   2.319
  520    HD2  HIS  67           HD2      HIS  67   5.806  -4.915   1.075
  521    HE1  HIS  67           HE1      HIS  67   3.214  -3.895   4.272
  522    HE2  HIS  67           HE2      HIS  67   4.925  -5.537   3.419
  523    H    TYR  68           HN       TYR  68   2.388  -0.804  -1.530
  524    HA   TYR  68           HA       TYR  68   3.477  -0.860  -4.231
  525   1HB   TYR  68          HB2       TYR  68   0.652  -0.042  -3.573
  526   2HB   TYR  68          HB1       TYR  68   1.423   0.169  -5.138
  527    HD1  TYR  68           HD1      TYR  68   1.118  -1.461  -6.747
  528    HD2  TYR  68           HD2      TYR  68   0.638  -2.521  -2.666
  529    HE1  TYR  68           HE1      TYR  68   0.348  -3.684  -7.429
  530    HE2  TYR  68           HE2      TYR  68  -0.130  -4.756  -3.328
  531    HH   TYR  68           HH       TYR  68  -1.292  -5.559  -6.071
  532    H    LEU  69           HN       LEU  69   5.106   0.583  -3.560
  533    HA   LEU  69           HA       LEU  69   4.176   3.348  -3.224
  534   1HB   LEU  69          HB2       LEU  69   4.689   3.117  -1.039
  535   2HB   LEU  69          HB1       LEU  69   5.817   1.829  -1.310
  536    HG   LEU  69           HG       LEU  69   6.633   4.144  -0.390
  537   1HD1  LEU  69          1HD1      LEU  69   8.405   2.793  -0.652
  538   2HD1  LEU  69          2HD1      LEU  69   8.699   3.777  -2.086
  539   3HD1  LEU  69          3HD1      LEU  69   7.874   2.231  -2.235
  540   1HD2  LEU  69          1HD2      LEU  69   5.588   5.084  -2.735
  541   2HD2  LEU  69          2HD2      LEU  69   7.291   4.888  -3.147
  542   3HD2  LEU  69          3HD2      LEU  69   6.828   5.890  -1.783
  543    H    ILE  70           HN       ILE  70   5.020   4.351  -4.966
  544    HA   ILE  70           HA       ILE  70   7.922   4.240  -4.984
  545    HB   ILE  70           HB       ILE  70   6.498   3.476  -7.497
  546   1HG1  ILE  70          2HG1      ILE  70   8.334   2.036  -5.588
  547   2HG1  ILE  70          1HG1      ILE  70   6.630   1.713  -5.819
  548   1HG2  ILE  70          1HG2      ILE  70   8.391   3.801  -8.681
  549   2HG2  ILE  70          2HG2      ILE  70   9.426   3.327  -7.336
  550   3HG2  ILE  70          3HG2      ILE  70   8.764   4.955  -7.404
  551   1HD1  ILE  70          1HD1      ILE  70   8.794   0.503  -7.059
  552   2HD1  ILE  70          2HD1      ILE  70   7.983   1.459  -8.290
  553   3HD1  ILE  70          3HD1      ILE  70   7.084   0.264  -7.368
  554    H    LEU  71           HN       LEU  71   5.058   5.586  -6.255
  555    HA   LEU  71           HA       LEU  71   6.556   8.115  -6.589
  556   1HB   LEU  71          HB2       LEU  71   4.163   7.420  -8.233
  557   2HB   LEU  71          HB1       LEU  71   5.422   8.584  -8.582
  558    HG   LEU  71           HG       LEU  71   5.731   5.575  -8.682
  559   1HD1  LEU  71          1HD1      LEU  71   4.416   6.062 -10.517
  560   2HD1  LEU  71          2HD1      LEU  71   6.048   6.165 -11.177
  561   3HD1  LEU  71          3HD1      LEU  71   5.168   7.637 -10.769
  562   1HD2  LEU  71          1HD2      LEU  71   7.652   7.616  -9.761
  563   2HD2  LEU  71          2HD2      LEU  71   7.903   5.884  -9.520
  564   3HD2  LEU  71          3HD2      LEU  71   7.792   6.967  -8.128
  565    HA   PRO  72           HA       PRO  72   3.332   9.557  -3.847
  566   1HB   PRO  72          HB2       PRO  72   4.429  11.909  -3.230
  567   2HB   PRO  72          HB1       PRO  72   5.169  10.396  -2.699
  568   1HG   PRO  72          HG2       PRO  72   5.963  12.219  -4.919
  569   2HG   PRO  72          HG1       PRO  72   6.982  11.279  -3.816
  570   1HD   PRO  72          HD2       PRO  72   6.263  10.560  -6.433
  571   2HD   PRO  72          HD1       PRO  72   6.977   9.491  -5.214
  572    H    SER  73           HN       SER  73   2.754  12.311  -3.651
  573    HA   SER  73           HA       SER  73   1.076  12.629  -5.980
  574   1HB   SER  73          HB2       SER  73   0.104  14.527  -4.734
  575   2HB   SER  73          HB1       SER  73   0.133  13.054  -3.765
  576    HG   SER  73           HG       SER  73   1.311  14.082  -2.378
  577    H    GLU  74           HN       GLU  74   1.851  13.565  -7.755
  578    HA   GLU  74           HA       GLU  74   3.920  15.626  -7.495
  579   1HB   GLU  74          HB2       GLU  74   2.994  14.024  -9.882
  580   2HB   GLU  74          HB1       GLU  74   4.185  15.313  -9.971
  581   1HG   GLU  74          HG2       GLU  74   5.290  13.181  -9.919
  582   2HG   GLU  74          HG1       GLU  74   5.630  14.062  -8.432
  583    H    GLU  75           HN       GLU  75   3.692  17.209  -9.581
  584    HA   GLU  75           HA       GLU  75   1.146  18.545  -9.134
  585   1HB   GLU  75          HB2       GLU  75   3.285  19.763  -8.805
  586   2HB   GLU  75          HB1       GLU  75   3.672  19.500 -10.498
  587   1HG   GLU  75          HG2       GLU  75   1.118  20.822  -9.837
  588   2HG   GLU  75          HG1       GLU  75   2.608  21.735  -9.631
  589    H    GLU  76           HN       GLU  76   2.037  16.213 -11.012
  590    HA   GLU  76           HA       GLU  76   0.860  17.260 -13.482
  591   1HB   GLU  76          HB2       GLU  76   3.030  16.162 -13.786
  592   2HB   GLU  76          HB1       GLU  76   2.438  14.724 -12.969
  593   1HG   GLU  76          HG2       GLU  76   2.465  14.376 -15.353
  594   2HG   GLU  76          HG1       GLU  76   0.803  14.390 -14.764
  595    H    GLY  77           HN       GLY  77   0.203  15.541 -10.644
  596   1HA   GLY  77          HA2       GLY  77  -2.464  14.972 -11.422
  597   2HA   GLY  77          HA1       GLY  77  -1.507  13.499 -11.447
  598    H    ARG  78           HN       ARG  78  -1.604  12.358  -9.664
  599    HA   ARG  78           HA       ARG  78  -1.655  13.700  -7.063
  600   1HB   ARG  78          HB2       ARG  78  -3.600  11.551  -7.926
  601   2HB   ARG  78          HB1       ARG  78  -3.459  12.181  -6.292
  602   1HG   ARG  78          HG2       ARG  78  -4.208  13.817  -8.704
  603   2HG   ARG  78          HG1       ARG  78  -5.353  13.132  -7.549
  604   1HD   ARG  78          HD2       ARG  78  -3.177  15.131  -6.938
  605   2HD   ARG  78          HD1       ARG  78  -4.906  15.469  -7.039
  606    HE   ARG  78           HE       ARG  78  -4.501  13.439  -5.155
  607   1HH1  ARG  78          HH11      ARG  78  -3.851  16.843  -5.573
  608   2HH1  ARG  78          HH12      ARG  78  -3.890  17.188  -3.877
  609   1HH2  ARG  78          HH21      ARG  78  -4.553  13.891  -2.921
  610   2HH2  ARG  78          HH22      ARG  78  -4.288  15.512  -2.371
  611    H    LEU  79           HN       LEU  79  -2.310  10.765  -6.069
  612    HA   LEU  79           HA       LEU  79   0.379  10.046  -5.576
  613   1HB   LEU  79          HB2       LEU  79  -2.176   8.459  -5.321
  614   2HB   LEU  79          HB1       LEU  79  -0.613   7.862  -4.805
  615    HG   LEU  79           HG       LEU  79  -1.843   8.681  -2.895
  616   1HD1  LEU  79          1HD1      LEU  79   0.144  10.851  -3.309
  617   2HD1  LEU  79          2HD1      LEU  79   0.704   9.179  -3.337
  618   3HD1  LEU  79          3HD1      LEU  79  -0.121   9.809  -1.911
  619   1HD2  LEU  79          1HD2      LEU  79  -2.744  10.825  -2.689
  620   2HD2  LEU  79          2HD2      LEU  79  -3.182  10.333  -4.325
  621   3HD2  LEU  79          3HD2      LEU  79  -1.834  11.441  -4.069
  622    H    TYR  80           HN       TYR  80   1.789   9.163  -6.988
  623    HA   TYR  80           HA       TYR  80   0.738   8.071  -9.440
  624   1HB   TYR  80          HB2       TYR  80   3.368   9.099  -8.585
  625   2HB   TYR  80          HB1       TYR  80   3.353   7.909  -9.884
  626    HD1  TYR  80           HD1      TYR  80   0.695  10.405  -9.297
  627    HD2  TYR  80           HD2      TYR  80   4.076   9.336 -11.644
  628    HE1  TYR  80           HE1      TYR  80   0.131  12.179 -10.903
  629    HE2  TYR  80           HE2      TYR  80   3.521  11.105 -13.259
  630    HH   TYR  80           HH       TYR  80   1.146  12.341 -13.891
  631    H    PHE  81           HN       PHE  81   0.334   6.121  -9.811
  632    HA   PHE  81           HA       PHE  81   1.812   3.946  -8.583
  633   1HB   PHE  81          HB2       PHE  81  -1.144   4.248  -8.979
  634   2HB   PHE  81          HB1       PHE  81  -0.409   2.661  -8.813
  635    HD1  PHE  81           HD1      PHE  81   0.139   5.898  -7.017
  636    HD2  PHE  81           HD2      PHE  81  -0.947   1.794  -6.758
  637    HE1  PHE  81           HE1      PHE  81   0.016   6.087  -4.570
  638    HE2  PHE  81           HE2      PHE  81  -1.077   1.980  -4.310
  639    HZ   PHE  81           HZ       PHE  81  -0.596   4.129  -3.214
  640    H    SER  82           HN       SER  82   2.748   2.588  -9.986
  641    HA   SER  82           HA       SER  82   1.538   2.300 -12.632
  642   1HB   SER  82          HB2       SER  82   3.739   2.515 -13.723
  643   2HB   SER  82          HB1       SER  82   3.230   4.008 -12.938
  644    HG   SER  82           HG       SER  82   5.316   3.703 -12.337
  645    H    MET  83           HN       MET  83   2.294   0.662 -10.019
  646    HA   MET  83           HA       MET  83   3.993  -1.333 -10.257
  647   1HB   MET  83          HB2       MET  83   2.324  -2.915  -9.339
  648   2HB   MET  83          HB1       MET  83   2.341  -1.372  -8.512
  649   1HG   MET  83          HG2       MET  83   0.354  -2.118 -10.631
  650   2HG   MET  83          HG1       MET  83   0.085  -2.333  -8.906
  651   1HE   MET  83          HE1       MET  83   1.662   0.070  -7.845
  652   2HE   MET  83          HE2       MET  83   0.039   0.118  -7.162
  653   3HE   MET  83          HE3       MET  83   0.720   1.553  -7.922
  654    H    ASP  84           HN       ASP  84   4.155  -3.396 -11.176
  655    HA   ASP  84           HA       ASP  84   4.287  -3.731 -13.770
  656   1HB   ASP  84          HB2       ASP  84   4.905  -5.472 -12.172
  657   2HB   ASP  84          HB1       ASP  84   3.207  -5.870 -11.933
  658    H    ASP  85           HN       ASP  85   1.263  -4.815 -12.169
  659    HA   ASP  85           HA       ASP  85  -0.060  -4.502 -14.782
  660   1HB   ASP  85          HB2       ASP  85  -0.866  -6.203 -12.417
  661   2HB   ASP  85          HB1       ASP  85  -1.745  -6.094 -13.939
  662    H    GLY  86           HN       GLY  86   0.384  -2.383 -12.683
  663   1HA   GLY  86          HA2       GLY  86  -2.431  -1.545 -12.566
  664   2HA   GLY  86          HA1       GLY  86  -1.479  -1.517 -11.093
  665    H    GLN  87           HN       GLN  87  -2.798   0.543 -12.943
  666    HA   GLN  87           HA       GLN  87  -0.598   2.468 -12.809
  667   1HB   GLN  87          HB2       GLN  87  -1.328   3.411 -15.021
  668   2HB   GLN  87          HB1       GLN  87  -0.554   1.839 -15.127
  669   1HG   GLN  87          HG2       GLN  87  -3.537   2.176 -15.053
  670   2HG   GLN  87          HG1       GLN  87  -2.613   2.209 -16.551
  671    H    THR  88           HN       THR  88  -1.912   2.994 -10.862
  672    HA   THR  88           HA       THR  88  -4.352   4.442 -11.585
  673    HB   THR  88           HB       THR  88  -5.024   4.154  -9.216
  674    HG1  THR  88           HG1      THR  88  -2.774   2.439  -9.095
  675   1HG2  THR  88          1HG2      THR  88  -6.121   2.417 -10.033
  676   2HG2  THR  88          2HG2      THR  88  -4.746   1.409  -9.580
  677   3HG2  THR  88          3HG2      THR  88  -4.842   2.092 -11.205
  678    H    ARG  89           HN       ARG  89  -1.483   5.420 -11.448
  679    HA   ARG  89           HA       ARG  89  -0.845   7.140  -9.501
  680   1HB   ARG  89          HB2       ARG  89   0.165   8.623 -11.171
  681   2HB   ARG  89          HB1       ARG  89   0.456   6.934 -11.553
  682   1HG   ARG  89          HG2       ARG  89  -1.012   6.960 -13.355
  683   2HG   ARG  89          HG1       ARG  89  -1.828   8.419 -12.792
  684   1HD   ARG  89          HD2       ARG  89   0.172   9.736 -13.266
  685   2HD   ARG  89          HD1       ARG  89   1.016   8.277 -13.792
  686    HE   ARG  89           HE       ARG  89   0.028   8.535 -15.824
  687   1HH1  ARG  89          HH11      ARG  89  -1.927  10.203 -13.461
  688   2HH1  ARG  89          HH12      ARG  89  -3.069  10.777 -14.628
  689   1HH2  ARG  89          HH21      ARG  89  -1.470   9.295 -17.359
  690   2HH2  ARG  89          HH22      ARG  89  -2.809  10.264 -16.840
  691    H    PHE  90           HN       PHE  90  -3.275   7.474  -8.798
  692    HA   PHE  90           HA       PHE  90  -3.867  10.260  -9.406
  693   1HB   PHE  90          HB2       PHE  90  -6.302   9.783  -9.577
  694   2HB   PHE  90          HB1       PHE  90  -5.370   9.083 -10.893
  695    HD1  PHE  90           HD1      PHE  90  -5.882   6.949 -11.523
  696    HD2  PHE  90           HD2      PHE  90  -6.609   8.129  -7.503
  697    HE1  PHE  90           HE1      PHE  90  -6.890   4.752 -11.065
  698    HE2  PHE  90           HE2      PHE  90  -7.612   5.940  -7.036
  699    HZ   PHE  90           HZ       PHE  90  -7.755   4.243  -8.815
  700    H    THR  91           HN       THR  91  -6.103  10.610  -7.847
  701    HA   THR  91           HA       THR  91  -4.952  10.437  -5.219
  702    HB   THR  91           HB       THR  91  -6.222  12.419  -5.858
  703    HG1  THR  91           HG1      THR  91  -7.679  10.971  -3.909
  704   1HG2  THR  91          1HG2      THR  91  -8.276  12.468  -6.727
  705   2HG2  THR  91          2HG2      THR  91  -8.862  11.183  -5.671
  706   3HG2  THR  91          3HG2      THR  91  -7.965  10.780  -7.135
  707    H    ASP  92           HN       ASP  92  -4.825   8.202  -4.843
  708    HA   ASP  92           HA       ASP  92  -6.763   6.286  -5.153
  709   1HB   ASP  92          HB2       ASP  92  -5.623   5.033  -3.362
  710   2HB   ASP  92          HB1       ASP  92  -4.479   5.754  -4.490
  711    H    LEU  93           HN       LEU  93  -6.553   8.746  -2.689
  712    HA   LEU  93           HA       LEU  93  -8.097   7.811  -0.658
  713   1HB   LEU  93          HB2       LEU  93  -7.054  10.068  -0.800
  714   2HB   LEU  93          HB1       LEU  93  -8.354  10.569  -1.861
  715    HG   LEU  93           HG       LEU  93  -8.759   9.646   0.985
  716   1HD1  LEU  93          1HD1      LEU  93  -7.603  11.638   1.250
  717   2HD1  LEU  93          2HD1      LEU  93  -9.288  12.158   1.255
  718   3HD1  LEU  93          3HD1      LEU  93  -8.309  12.356  -0.198
  719   1HD2  LEU  93          1HD2      LEU  93 -10.802   9.337  -0.049
  720   2HD2  LEU  93          2HD2      LEU  93 -10.563  10.687  -1.158
  721   3HD2  LEU  93          3HD2      LEU  93 -10.935  10.994   0.538
  722    H    LEU  94           HN       LEU  94  -9.617   9.879  -3.125
  723    HA   LEU  94           HA       LEU  94 -12.234   9.320  -2.637
  724   1HB   LEU  94          HB2       LEU  94 -11.363  10.977  -4.268
  725   2HB   LEU  94          HB1       LEU  94 -11.013   9.666  -5.376
  726    HG   LEU  94           HG       LEU  94 -13.084  10.891  -5.935
  727   1HD1  LEU  94          1HD1      LEU  94 -14.089   9.043  -6.738
  728   2HD1  LEU  94          2HD1      LEU  94 -14.116   8.241  -5.168
  729   3HD1  LEU  94          3HD1      LEU  94 -12.637   8.250  -6.128
  730   1HD2  LEU  94          1HD2      LEU  94 -13.553  10.962  -3.275
  731   2HD2  LEU  94          2HD2      LEU  94 -14.608   9.634  -3.759
  732   3HD2  LEU  94          3HD2      LEU  94 -14.788  11.222  -4.506
  733    H    GLN  95           HN       GLN  95 -10.018   7.412  -4.631
  734    HA   GLN  95           HA       GLN  95 -11.831   5.599  -5.706
  735   1HB   GLN  95          HB2       GLN  95  -9.462   5.745  -6.386
  736   2HB   GLN  95          HB1       GLN  95  -8.986   5.053  -4.843
  737   1HG   GLN  95          HG2       GLN  95 -10.268   3.016  -5.411
  738   2HG   GLN  95          HG1       GLN  95 -10.601   3.708  -6.994
  739    H    LEU  96           HN       LEU  96  -9.781   5.099  -2.833
  740    HA   LEU  96           HA       LEU  96 -10.643   2.704  -1.943
  741   1HB   LEU  96          HB2       LEU  96  -8.949   4.166  -0.851
  742   2HB   LEU  96          HB1       LEU  96 -10.255   5.107  -0.158
  743    HG   LEU  96           HG       LEU  96  -9.795   2.175   0.404
  744   1HD1  LEU  96          1HD1      LEU  96  -9.308   4.315   2.411
  745   2HD1  LEU  96          2HD1      LEU  96  -8.071   3.997   1.195
  746   3HD1  LEU  96          3HD1      LEU  96  -8.597   2.707   2.276
  747   1HD2  LEU  96          1HD2      LEU  96 -11.824   4.171   1.236
  748   2HD2  LEU  96          2HD2      LEU  96 -11.244   3.041   2.459
  749   3HD2  LEU  96          3HD2      LEU  96 -11.981   2.433   0.977
  750    H    VAL  97           HN       VAL  97 -12.285   5.782  -1.269
  751    HA   VAL  97           HA       VAL  97 -14.344   4.796   0.304
  752    HB   VAL  97           HB       VAL  97 -14.479   7.122  -1.619
  753   1HG1  VAL  97          1HG1      VAL  97 -16.553   7.497  -0.915
  754   2HG1  VAL  97          2HG1      VAL  97 -16.035   7.434   0.770
  755   3HG1  VAL  97          3HG1      VAL  97 -16.508   5.954  -0.062
  756   1HG2  VAL  97          1HG2      VAL  97 -12.705   7.651  -0.238
  757   2HG2  VAL  97          2HG2      VAL  97 -13.398   6.811   1.150
  758   3HG2  VAL  97          3HG2      VAL  97 -14.067   8.358   0.630
  759    H    GLU  98           HN       GLU  98 -15.125   5.978  -2.948
  760    HA   GLU  98           HA       GLU  98 -17.392   4.295  -3.163
  761   1HB   GLU  98          HB2       GLU  98 -17.289   6.453  -4.270
  762   2HB   GLU  98          HB1       GLU  98 -15.945   5.908  -5.263
  763   1HG   GLU  98          HG2       GLU  98 -17.389   4.255  -6.324
  764   2HG   GLU  98          HG1       GLU  98 -18.738   4.786  -5.320
  765    H    PHE  99           HN       PHE  99 -14.230   4.146  -4.809
  766    HA   PHE  99           HA       PHE  99 -14.910   1.903  -6.359
  767   1HB   PHE  99          HB2       PHE  99 -12.223   3.011  -5.571
  768   2HB   PHE  99          HB1       PHE  99 -12.416   1.642  -6.651
  769    HD1  PHE  99           HD1      PHE  99 -11.901   2.255  -8.780
  770    HD2  PHE  99           HD2      PHE  99 -14.201   4.926  -6.394
  771    HE1  PHE  99           HE1      PHE  99 -12.135   3.769 -10.703
  772    HE2  PHE  99           HE2      PHE  99 -14.439   6.440  -8.311
  773    HZ   PHE  99           HZ       PHE  99 -13.407   5.865 -10.470
  774    H    HIS 100           HN       HIS 100 -14.432   2.019  -3.013
  775    HA   HIS 100           HA       HIS 100 -12.976  -0.200  -2.339
  776   1HB   HIS 100          HB2       HIS 100 -14.265  -0.377  -0.335
  777   2HB   HIS 100          HB1       HIS 100 -14.231   1.328  -0.748
  778    HD1  HIS 100           HD1      HIS 100 -16.511   1.828  -2.491
  779    HD2  HIS 100           HD2      HIS 100 -16.728  -1.003   0.540
  780    HE1  HIS 100           HE1      HIS 100 -18.963   1.531  -2.025
  781    HE2  HIS 100           HE2      HIS 100 -19.066  -0.119  -0.124
  782    H    GLN 101           HN       GLN 101 -16.200  -0.062  -3.662
  783    HA   GLN 101           HA       GLN 101 -16.920  -2.756  -3.363
  784   1HB   GLN 101          HB2       GLN 101 -18.550  -2.240  -5.218
  785   2HB   GLN 101          HB1       GLN 101 -18.623  -1.169  -3.826
  786   1HG   GLN 101          HG2       GLN 101 -17.089   0.373  -5.176
  787   2HG   GLN 101          HG1       GLN 101 -17.529  -0.618  -6.559
  788    H    LEU 102           HN       LEU 102 -15.619  -1.084  -6.253
  789    HA   LEU 102           HA       LEU 102 -14.396  -3.621  -7.047
  790   1HB   LEU 102          HB2       LEU 102 -16.181  -1.946  -8.805
  791   2HB   LEU 102          HB1       LEU 102 -15.094  -3.170  -9.427
  792    HG   LEU 102           HG       LEU 102 -17.267  -4.126  -9.336
  793   1HD1  LEU 102          1HD1      LEU 102 -16.381  -5.409  -6.876
  794   2HD1  LEU 102          2HD1      LEU 102 -15.103  -5.236  -8.078
  795   3HD1  LEU 102          3HD1      LEU 102 -16.596  -6.076  -8.495
  796   1HD2  LEU 102          1HD2      LEU 102 -17.708  -2.418  -7.209
  797   2HD2  LEU 102          2HD2      LEU 102 -17.756  -4.023  -6.481
  798   3HD2  LEU 102          3HD2      LEU 102 -18.825  -3.634  -7.827
  799    H    ASN 103           HN       ASN 103 -12.614  -2.181  -6.095
  800    HA   ASN 103           HA       ASN 103 -11.641  -0.218  -8.035
  801   1HB   ASN 103          HB2       ASN 103 -10.087   0.524  -6.366
  802   2HB   ASN 103          HB1       ASN 103 -11.662   0.382  -5.611
  803   1HD2  ASN 103          1HD2      ASN 103 -10.893  -2.732  -5.820
  804   2HD2  ASN 103          2HD2      ASN 103 -10.007  -2.938  -4.360
  805    H    ARG 104           HN       ARG 104  -8.967  -0.307  -7.808
  806    HA   ARG 104           HA       ARG 104  -8.332  -2.886  -9.042
  807   1HB   ARG 104          HB2       ARG 104  -6.952  -0.204  -9.122
  808   2HB   ARG 104          HB1       ARG 104  -6.228  -1.666  -9.772
  809   1HG   ARG 104          HG2       ARG 104  -7.270  -0.341 -11.521
  810   2HG   ARG 104          HG1       ARG 104  -8.075  -1.900 -11.341
  811   1HD   ARG 104          HD2       ARG 104  -9.875  -0.870 -10.102
  812   2HD   ARG 104          HD1       ARG 104  -9.046   0.686 -10.131
  813    HE   ARG 104           HE       ARG 104  -9.397  -0.163 -12.768
  814   1HH1  ARG 104          HH11      ARG 104 -11.338   0.845 -10.051
  815   2HH1  ARG 104          HH12      ARG 104 -12.608   1.490 -11.035
  816   1HH2  ARG 104          HH21      ARG 104 -11.065   0.685 -14.067
  817   2HH2  ARG 104          HH22      ARG 104 -12.453   1.400 -13.317
  818    H    GLY 105           HN       GLY 105  -8.488  -3.577  -6.621
  819   1HA   GLY 105          HA2       GLY 105  -6.649  -2.963  -4.685
  820   2HA   GLY 105          HA1       GLY 105  -7.312  -4.572  -4.914
  821    H    ILE 106           HN       ILE 106  -6.062  -6.163  -5.811
  822    HA   ILE 106           HA       ILE 106  -3.217  -5.565  -5.973
  823    HB   ILE 106           HB       ILE 106  -2.902  -8.011  -5.991
  824   1HG1  ILE 106          2HG1      ILE 106  -4.914  -9.432  -5.479
  825   2HG1  ILE 106          1HG1      ILE 106  -5.919  -8.047  -5.869
  826   1HG2  ILE 106          1HG2      ILE 106  -2.775  -7.402  -3.822
  827   2HG2  ILE 106          2HG2      ILE 106  -4.293  -8.290  -3.698
  828   3HG2  ILE 106          3HG2      ILE 106  -4.312  -6.539  -3.867
  829   1HD1  ILE 106          1HD1      ILE 106  -5.231  -9.980  -7.615
  830   2HD1  ILE 106          2HD1      ILE 106  -3.977  -8.784  -7.933
  831   3HD1  ILE 106          3HD1      ILE 106  -5.677  -8.337  -8.074
  832    H    LEU 107           HN       LEU 107  -1.873  -6.483  -7.697
  833    HA   LEU 107           HA       LEU 107  -2.346  -5.589 -10.146
  834   1HB   LEU 107          HB2       LEU 107  -0.847  -8.026  -9.313
  835   2HB   LEU 107          HB1       LEU 107  -0.943  -7.592 -11.009
  836    HG   LEU 107           HG       LEU 107  -0.039  -5.311 -10.290
  837   1HD1  LEU 107          1HD1      LEU 107   0.427  -6.898  -7.790
  838   2HD1  LEU 107          2HD1      LEU 107  -0.367  -5.335  -7.967
  839   3HD1  LEU 107          3HD1      LEU 107   1.374  -5.470  -8.208
  840   1HD2  LEU 107          1HD2      LEU 107   2.302  -6.198 -10.179
  841   2HD2  LEU 107          2HD2      LEU 107   1.342  -6.804 -11.529
  842   3HD2  LEU 107          3HD2      LEU 107   1.612  -7.821 -10.113
  843    HA   PRO 108           HA       PRO 108  -4.809  -8.900 -12.194
  844   1HB   PRO 108          HB2       PRO 108  -4.241 -11.523 -11.948
  845   2HB   PRO 108          HB1       PRO 108  -3.206 -10.396 -12.826
  846   1HG   PRO 108          HG2       PRO 108  -2.722 -11.752 -10.283
  847   2HG   PRO 108          HG1       PRO 108  -1.578 -10.908 -11.336
  848   1HD   PRO 108          HD2       PRO 108  -2.928  -9.946  -8.933
  849   2HD   PRO 108          HD1       PRO 108  -1.573  -9.237  -9.820
  850    H    CYS 109           HN       CYS 109  -4.546 -11.383  -9.670
  851    HA   CYS 109           HA       CYS 109  -7.072 -12.304  -9.649
  852   1HB   CYS 109          HB2       CYS 109  -5.250 -11.977  -7.270
  853   2HB   CYS 109          HB1       CYS 109  -6.697 -12.978  -7.273
  854    HG   CYS 109           HG       CYS 109  -5.235 -15.028  -7.818
  855    H    LEU 110           HN       LEU 110  -8.311 -12.187  -7.269
  856    HA   LEU 110           HA       LEU 110 -10.289 -10.457  -7.334
  857   1HB   LEU 110          HB2       LEU 110  -9.455 -12.163  -5.478
  858   2HB   LEU 110          HB1       LEU 110  -8.985 -10.692  -4.665
  859    HG   LEU 110           HG       LEU 110 -11.131 -11.416  -3.859
  860   1HD1  LEU 110          1HD1      LEU 110 -10.543  -8.894  -4.647
  861   2HD1  LEU 110          2HD1      LEU 110 -12.002  -9.349  -3.768
  862   3HD1  LEU 110          3HD1      LEU 110 -12.048  -9.176  -5.522
  863   1HD2  LEU 110          1HD2      LEU 110 -12.804 -12.187  -5.140
  864   2HD2  LEU 110          2HD2      LEU 110 -11.555 -12.367  -6.373
  865   3HD2  LEU 110          3HD2      LEU 110 -12.584 -10.935  -6.361
  866    H    LEU 111           HN       LEU 111 -10.763  -8.300  -6.944
  867    HA   LEU 111           HA       LEU 111  -8.468  -6.599  -6.243
  868   1HB   LEU 111          HB2       LEU 111  -9.368  -4.867  -7.755
  869   2HB   LEU 111          HB1       LEU 111  -8.837  -6.317  -8.573
  870    HG   LEU 111           HG       LEU 111 -10.871  -5.406  -9.569
  871   1HD1  LEU 111          1HD1      LEU 111 -12.025  -7.809  -8.384
  872   2HD1  LEU 111          2HD1      LEU 111 -10.380  -8.022  -8.983
  873   3HD1  LEU 111          3HD1      LEU 111 -11.643  -7.436 -10.064
  874   1HD2  LEU 111          1HD2      LEU 111 -11.653  -4.658  -7.136
  875   2HD2  LEU 111          2HD2      LEU 111 -12.549  -6.171  -7.260
  876   3HD2  LEU 111          3HD2      LEU 111 -12.781  -4.908  -8.466
  877    H    ARG 112           HN       ARG 112 -11.805  -7.284  -5.693
  878    HA   ARG 112           HA       ARG 112 -12.580  -4.850  -4.491
  879   1HB   ARG 112          HB2       ARG 112 -13.595  -7.629  -3.859
  880   2HB   ARG 112          HB1       ARG 112 -14.421  -6.114  -3.525
  881   1HG   ARG 112          HG2       ARG 112 -14.576  -5.690  -5.942
  882   2HG   ARG 112          HG1       ARG 112 -13.802  -7.246  -6.244
  883   1HD   ARG 112          HD2       ARG 112 -16.225  -7.413  -6.463
  884   2HD   ARG 112          HD1       ARG 112 -15.638  -8.389  -5.117
  885    HE   ARG 112           HE       ARG 112 -16.367  -5.873  -4.134
  886   1HH1  ARG 112          HH11      ARG 112 -17.856  -8.702  -5.532
  887   2HH1  ARG 112          HH12      ARG 112 -19.362  -8.470  -4.709
  888   1HH2  ARG 112          HH21      ARG 112 -18.345  -5.566  -3.050
  889   2HH2  ARG 112          HH22      ARG 112 -19.639  -6.690  -3.300
  890    H    HIS 113           HN       HIS 113 -12.899  -4.424  -2.181
  891    HA   HIS 113           HA       HIS 113 -11.360  -6.073  -0.341
  892   1HB   HIS 113          HB2       HIS 113  -9.955  -4.255   0.450
  893   2HB   HIS 113          HB1       HIS 113  -9.696  -4.505  -1.277
  894    HD1  HIS 113           HD1      HIS 113 -11.968  -2.282   0.840
  895    HD2  HIS 113           HD2      HIS 113  -9.605  -2.157  -2.574
  896    HE1  HIS 113           HE1      HIS 113 -12.143   0.076  -0.007
  897    HE2  HIS 113           HE2      HIS 113 -10.632   0.154  -2.023
  898    H    CYS 114           HN       CYS 114 -11.399  -5.023   1.919
  899    HA   CYS 114           HA       CYS 114 -13.869  -3.535   2.397
  900   1HB   CYS 114          HB2       CYS 114 -14.513  -5.874   2.636
  901   2HB   CYS 114          HB1       CYS 114 -13.173  -6.156   3.746
  902    HG   CYS 114           HG       CYS 114 -15.238  -3.713   4.729
  903    H    CYS 115           HN       CYS 115 -11.762  -5.268   4.661
  904    HA   CYS 115           HA       CYS 115 -10.593  -2.733   5.538
  905   1HB   CYS 115          HB2       CYS 115 -11.933  -4.704   7.407
  906   2HB   CYS 115          HB1       CYS 115 -11.053  -3.261   7.898
  907    HG   CYS 115           HG       CYS 115 -12.863  -1.467   6.808
  908    H    THR 116           HN       THR 116  -9.207  -3.651   7.739
  909    HA   THR 116           HA       THR 116  -7.390  -5.630   6.534
  910    HB   THR 116           HB       THR 116  -6.797  -3.510   8.610
  911    HG1  THR 116           HG1      THR 116  -5.618  -2.567   6.872
  912   1HG2  THR 116          1HG2      THR 116  -4.764  -5.062   7.058
  913   2HG2  THR 116          2HG2      THR 116  -5.365  -5.620   8.619
  914   3HG2  THR 116          3HG2      THR 116  -4.542  -4.065   8.495
  915    H    ARG 117           HN       ARG 117  -6.582  -7.339   7.818
  916    HA   ARG 117           HA       ARG 117  -8.135  -7.797  10.280
  917   1HB   ARG 117          HB2       ARG 117  -8.571  -9.442   8.531
  918   2HB   ARG 117          HB1       ARG 117  -6.856  -9.795   8.408
  919   1HG   ARG 117          HG2       ARG 117  -8.012 -11.519   9.663
  920   2HG   ARG 117          HG1       ARG 117  -6.863 -10.660  10.691
  921   1HD   ARG 117          HD2       ARG 117  -8.687  -9.312  11.604
  922   2HD   ARG 117          HD1       ARG 117  -9.836 -10.161  10.569
  923    HE   ARG 117           HE       ARG 117  -8.457 -12.053  12.103
  924   1HH1  ARG 117          HH11      ARG 117 -10.773  -9.476  12.524
  925   2HH1  ARG 117          HH12      ARG 117 -11.504 -10.193  13.920
  926   1HH2  ARG 117          HH21      ARG 117  -9.418 -12.997  13.939
  927   2HH2  ARG 117          HH22      ARG 117 -10.735 -12.191  14.724
  928    H    VAL 118           HN       VAL 118  -6.490  -6.412  11.321
  929    HA   VAL 118           HA       VAL 118  -4.392  -8.077  12.432
  930    HB   VAL 118           HB       VAL 118  -2.736  -6.124  12.175
  931   1HG1  VAL 118          1HG1      VAL 118  -3.144  -7.307   9.506
  932   2HG1  VAL 118          2HG1      VAL 118  -3.047  -8.449  10.846
  933   3HG1  VAL 118          3HG1      VAL 118  -1.723  -7.322  10.550
  934   1HG2  VAL 118          1HG2      VAL 118  -3.410  -5.225   9.663
  935   2HG2  VAL 118          2HG2      VAL 118  -3.563  -4.312  11.163
  936   3HG2  VAL 118          3HG2      VAL 118  -4.949  -5.193  10.524
  937    H    ALA 119           HN       ALA 119  -5.124  -4.578  12.416
  938    HA   ALA 119           HA       ALA 119  -4.835  -4.456  15.276
  939   1HB   ALA 119          HB1       ALA 119  -5.896  -2.235  13.560
  940   2HB   ALA 119          HB2       ALA 119  -4.182  -2.650  13.572
  941   3HB   ALA 119          HB3       ALA 119  -4.975  -2.134  15.061
  942    H    LEU 120           HN       LEU 120  -6.788  -2.581  15.961
  943    HA   LEU 120           HA       LEU 120  -8.928  -4.196  16.707
  944   1HB   LEU 120          HB2       LEU 120  -8.863  -1.190  16.429
  945   2HB   LEU 120          HB1       LEU 120 -10.077  -2.098  17.310
  946    HG   LEU 120           HG       LEU 120  -7.142  -1.933  17.999
  947   1HD1  LEU 120          1HD1      LEU 120  -8.612   0.088  18.421
  948   2HD1  LEU 120          2HD1      LEU 120  -7.761  -0.575  19.816
  949   3HD1  LEU 120          3HD1      LEU 120  -9.478  -0.913  19.587
  950   1HD2  LEU 120          1HD2      LEU 120  -9.417  -3.426  19.291
  951   2HD2  LEU 120          2HD2      LEU 120  -7.864  -3.125  20.072
  952   3HD2  LEU 120          3HD2      LEU 120  -7.939  -4.102  18.605
  953    HA   PRO1135           HA       PRO1135  14.209  -2.914  -9.237
  954   1HB   PRO1135          HB2       PRO1135  14.884  -3.916 -11.960
  955   2HB   PRO1135          HB1       PRO1135  15.322  -2.392 -11.182
  956   1HG   PRO1135          HG2       PRO1135  17.113  -4.345 -11.453
  957   2HG   PRO1135          HG1       PRO1135  17.063  -3.348  -9.987
  958   1HD   PRO1135          HD2       PRO1135  16.121  -6.148 -10.413
  959   2HD   PRO1135          HD1       PRO1135  16.858  -5.409  -8.977
  960    H    GLN1136           HN       GLN1136  12.517  -5.399  -9.076
  961    HA   GLN1136           HA       GLN1136  10.322  -4.372 -10.636
  962   1HB   GLN1136          HB2       GLN1136  11.468  -7.106 -11.179
  963   2HB   GLN1136          HB1       GLN1136   9.831  -6.657 -11.629
  964   1HG   GLN1136          HG2       GLN1136  12.342  -5.291 -12.570
  965   2HG   GLN1136          HG1       GLN1136  11.425  -6.483 -13.482
  966    HA   PRO1137           HA       PRO1137   8.540  -7.751  -7.703
  967   1HB   PRO1137          HB2       PRO1137  10.282  -9.194  -6.192
  968   2HB   PRO1137          HB1       PRO1137   9.727  -9.714  -7.788
  969   1HG   PRO1137          HG2       PRO1137  12.274  -8.329  -7.030
  970   2HG   PRO1137          HG1       PRO1137  12.034  -9.705  -8.123
  971   1HD   PRO1137          HD2       PRO1137  12.372  -7.210  -9.054
  972   2HD   PRO1137          HD1       PRO1137  11.287  -8.366  -9.852
  973    H    GLU1138           HN       GLU1138  11.359  -5.911  -6.790
  974    HA   GLU1138           HA       GLU1138  11.193  -5.765  -4.078
  975   1HB   GLU1138          HB2       GLU1138  11.859  -3.242  -4.454
  976   2HB   GLU1138          HB1       GLU1138  12.968  -4.555  -4.816
  977   1HG   GLU1138          HG2       GLU1138  12.281  -4.433  -7.192
  978   2HG   GLU1138          HG1       GLU1138  11.276  -3.044  -6.798
  979   2HN   PTR1139          HN        PTR1139   9.939  -2.842  -5.687
  980   2HN   PTR1139          HN        PTR1139   9.939  -2.842  -5.687
  981    HA   PTR1139           HA       PTR1139   7.830  -2.871  -3.702
  982    HA   PTR1139           HA       PTR1139   7.830  -2.871  -3.702
  983   1HB   PTR1139          HB1       PTR1139   7.572  -0.449  -4.947
  984   1HB   PTR1139          HB1       PTR1139   7.572  -0.449  -4.947
  985   2HB   PTR1139          HB2       PTR1139   9.299  -0.761  -5.053
  986   2HB   PTR1139          HB2       PTR1139   9.299  -0.761  -5.053
  987    HD1  PTR1139           HD1      PTR1139   6.485  -0.254  -2.711
  988    HD1  PTR1139           HD1      PTR1139   6.485  -0.254  -2.711
  989    HD2  PTR1139           HD2      PTR1139  10.693  -0.670  -3.105
  990    HD2  PTR1139           HD2      PTR1139  10.693  -0.670  -3.105
  991    HE1  PTR1139           HE1      PTR1139   6.773   0.531  -0.407
  992    HE1  PTR1139           HE1      PTR1139   6.773   0.531  -0.407
  993    HE2  PTR1139           HE2      PTR1139  11.001   0.131  -0.785
  994    HE2  PTR1139           HE2      PTR1139  11.001   0.131  -0.785
  995    H    VAL1140           HN       VAL1140   7.748  -1.443  -6.961
  996    HA   VAL1140           HA       VAL1140   5.864  -3.281  -7.966
  997    HB   VAL1140           HB       VAL1140   3.923  -1.430  -7.946
  998   1HG1  VAL1140          1HG1      VAL1140   2.824  -3.169  -7.126
  999   2HG1  VAL1140          2HG1      VAL1140   3.527  -2.867  -5.536
 1000   3HG1  VAL1140          3HG1      VAL1140   4.356  -3.923  -6.678
 1001   1HG2  VAL1140          1HG2      VAL1140   5.458  -0.081  -6.389
 1002   2HG2  VAL1140          2HG2      VAL1140   4.877  -1.183  -5.145
 1003   3HG2  VAL1140          3HG2      VAL1140   3.733  -0.178  -6.046
 1004    H    ASN1141           HN       ASN1141   5.385   0.254  -8.219
 1005    HA   ASN1141           HA       ASN1141   5.234   0.495 -10.887
 1006   1HB   ASN1141          HB2       ASN1141   7.188   2.181  -9.271
 1007   2HB   ASN1141          HB1       ASN1141   6.449   2.627 -10.794
 1008   1HD2  ASN1141          1HD2      ASN1141   5.610   1.738  -7.464
 1009   2HD2  ASN1141          2HD2      ASN1141   4.287   2.825  -7.308
 1010    H    GLN1142           HN       GLN1142   7.977  -0.184  -8.856
 1011    HA   GLN1142           HA       GLN1142   9.176  -2.078  -9.282
 1012   1HB   GLN1142          HB2       GLN1142  10.339  -2.552 -11.327
 1013   2HB   GLN1142          HB1       GLN1142   8.604  -2.487 -11.508
 1014   1HG   GLN1142          HG2       GLN1142  10.450  -1.354 -13.191
 1015   2HG   GLN1142          HG1       GLN1142   8.742  -0.958 -13.139
 1016    HA   PRO1143           HA       PRO1143  12.861   0.625  -9.078
 1017   1HB   PRO1143          HB2       PRO1143  12.696   3.297  -9.409
 1018   2HB   PRO1143          HB1       PRO1143  12.705   2.203 -10.797
 1019   1HG   PRO1143          HG2       PRO1143  10.507   3.817  -9.742
 1020   2HG   PRO1143          HG1       PRO1143  10.624   2.965 -11.289
 1021   1HD   PRO1143          HD2       PRO1143   9.389   2.093  -8.767
 1022   2HD   PRO1143          HD1       PRO1143   9.122   1.472 -10.394
 1023    H    ASP1144           HN       ASP1144  10.441   0.468  -7.289
 1024    HA   ASP1144           HA       ASP1144   9.794   0.926  -5.206
 1025   1HB   ASP1144          HB2       ASP1144  12.751   1.460  -4.787
 1026   2HB   ASP1144          HB1       ASP1144  11.586   1.029  -3.538
  Start of MODEL    5
    1   1H    GLY   1          HT1       GLY   1  20.898   2.554  -3.014
    2   2H    GLY   1          HT2       GLY   1  21.766   1.119  -3.235
    3   3H    GLY   1          HT3       GLY   1  22.537   2.483  -2.599
    4   1HA   GLY   1          HA1       GLY   1  20.893   0.506  -1.285
    5   2HA   GLY   1          HA2       GLY   1  22.165   1.524  -0.625
    6    H    SER   2           HN       SER   2  19.055   2.230  -2.216
    7    HA   SER   2           HA       SER   2  18.502   4.412  -0.494
    8   1HB   SER   2          HB2       SER   2  17.576   4.332  -2.745
    9   2HB   SER   2          HB1       SER   2  16.666   2.877  -2.347
   10    HG   SER   2           HG       SER   2  16.299   5.504  -1.374
   11    HA   PRO   3           HA       PRO   3  15.333   1.432   1.624
   12   1HB   PRO   3          HB2       PRO   3  15.681  -1.233   1.251
   13   2HB   PRO   3          HB1       PRO   3  14.646  -0.245   0.215
   14   1HG   PRO   3          HG2       PRO   3  17.454  -1.177  -0.247
   15   2HG   PRO   3          HG1       PRO   3  16.086  -1.142  -1.376
   16   1HD   PRO   3          HD2       PRO   3  18.024   0.738  -1.390
   17   2HD   PRO   3          HD1       PRO   3  16.340   1.107  -1.810
   18    H    ALA   4           HN       ALA   4  15.631   0.888   3.727
   19    HA   ALA   4           HA       ALA   4  18.046  -0.494   4.570
   20   1HB   ALA   4          HB1       ALA   4  18.555   1.989   4.447
   21   2HB   ALA   4          HB2       ALA   4  18.876   1.195   5.989
   22   3HB   ALA   4          HB3       ALA   4  17.428   2.184   5.790
   23    H    SER   5           HN       SER   5  17.892  -0.011   7.284
   24    HA   SER   5           HA       SER   5  15.433  -1.439   7.942
   25   1HB   SER   5          HB2       SER   5  17.914  -0.909   9.595
   26   2HB   SER   5          HB1       SER   5  16.540  -1.885  10.113
   27    HG   SER   5           HG       SER   5  18.067  -2.418   7.784
   28    H    GLY   6           HN       GLY   6  17.302   0.946   9.816
   29   1HA   GLY   6          HA2       GLY   6  16.376   3.166  10.249
   30   2HA   GLY   6          HA1       GLY   6  14.783   2.425  10.246
   31    H    THR   7           HN       THR   7  14.660   3.620  12.328
   32    HA   THR   7           HA       THR   7  15.745   1.957  14.505
   33    HB   THR   7           HB       THR   7  15.865   3.996  15.899
   34    HG1  THR   7           HG1      THR   7  14.306   5.197  14.655
   35   2HG2  THR   7          2HG2      THR   7  17.911   3.367  14.822
   36   2HG2  THR   7          2HG2      THR   7  17.750   5.123  14.776
   37   3HG2  THR   7          3HG2      THR   7  17.418   4.168  13.330
   38    H    SER   8           HN       SER   8  14.454   1.885  16.445
   39    HA   SER   8           HA       SER   8  11.742   1.405  15.973
   40   1HB   SER   8          HB2       SER   8  11.533   1.245  18.431
   41   2HB   SER   8          HB1       SER   8  12.946   0.375  17.835
   42    HG   SER   8           HG       SER   8  13.961   1.531  19.269
   43    H    LEU   9           HN       LEU   9  10.496   3.018  15.189
   44    HA   LEU   9           HA       LEU   9   9.895   5.223  16.981
   45   1HB   LEU   9          HB2       LEU   9  11.735   6.021  15.493
   46   2HB   LEU   9          HB1       LEU   9  10.695   5.732  14.113
   47    HG   LEU   9           HG       LEU   9  10.070   7.685  16.330
   48   1HD1  LEU   9          1HD1      LEU   9  12.067   8.016  14.561
   49   2HD1  LEU   9          2HD1      LEU   9  11.088   9.341  15.188
   50   3HD1  LEU   9          3HD1      LEU   9  10.713   8.635  13.616
   51   1HD2  LEU   9          1HD2      LEU   9   8.669   6.808  13.860
   52   2HD2  LEU   9          2HD2      LEU   9   8.579   8.511  14.309
   53   3HD2  LEU   9          3HD2      LEU   9   8.014   7.273  15.430
   54    H    SER  10           HN       SER  10   7.763   5.462  17.077
   55    HA   SER  10           HA       SER  10   6.150   4.642  14.752
   56   1HB   SER  10          HB2       SER  10   5.938   2.975  16.533
   57   2HB   SER  10          HB1       SER  10   5.490   4.238  17.680
   58    HG   SER  10           HG       SER  10   3.549   3.670  17.045
   59    H    ALA  11           HN       ALA  11   4.161   5.761  14.444
   60    HA   ALA  11           HA       ALA  11   4.218   8.478  15.555
   61   1HB   ALA  11          HB1       ALA  11   4.148   7.766  12.976
   62   2HB   ALA  11          HB2       ALA  11   3.429   9.258  13.581
   63   3HB   ALA  11          HB3       ALA  11   2.416   7.843  13.299
   64    H    ALA  12           HN       ALA  12   1.871   9.475  15.528
   65    HA   ALA  12           HA       ALA  12  -0.151   7.603  16.456
   66   1HB   ALA  12          HB1       ALA  12   0.287   9.865  18.307
   67   2HB   ALA  12          HB2       ALA  12   1.464   8.554  18.364
   68   3HB   ALA  12          HB3       ALA  12  -0.246   8.216  18.634
   69    H    ILE  13           HN       ILE  13   0.247   9.566  14.246
   70    HA   ILE  13           HA       ILE  13  -1.583  11.723  14.787
   71    HB   ILE  13           HB       ILE  13   0.302  12.009  13.224
   72   1HG1  ILE  13          2HG1      ILE  13  -2.421  12.300  11.932
   73   2HG1  ILE  13          1HG1      ILE  13  -1.675  13.454  13.032
   74   2HG2  ILE  13          2HG2      ILE  13  -1.048  10.572  11.038
   75   2HG2  ILE  13          2HG2      ILE  13  -0.301   9.562  12.274
   76   3HG2  ILE  13          3HG2      ILE  13   0.669  10.744  11.397
   77   1HD1  ILE  13          1HD1      ILE  13  -0.612  14.429  11.359
   78   2HD1  ILE  13          2HD1      ILE  13  -1.498  13.383  10.249
   79   3HD1  ILE  13          3HD1      ILE  13   0.088  12.894  10.843
   80    H    HIS  14           HN       HIS  14  -3.102   9.770  15.480
   81    HA   HIS  14           HA       HIS  14  -5.032   9.487  13.298
   82   1HB   HIS  14          HB2       HIS  14  -4.326   7.151  15.078
   83   2HB   HIS  14          HB1       HIS  14  -5.348   7.145  13.645
   84    HD1  HIS  14           HD1      HIS  14  -1.726   8.039  14.404
   85    HD2  HIS  14           HD2      HIS  14  -4.022   6.127  11.520
   86    HE1  HIS  14           HE1      HIS  14  -0.093   7.224  12.681
   87    HE2  HIS  14           HE2      HIS  14  -1.494   5.980  10.995
   88    H    ARG  15           HN       ARG  15  -7.144   9.663  13.958
   89    HA   ARG  15           HA       ARG  15  -7.678   9.578  16.832
   90   1HB   ARG  15          HB2       ARG  15  -9.073  11.632  16.632
   91   2HB   ARG  15          HB1       ARG  15  -7.351  11.910  16.382
   92   1HG   ARG  15          HG2       ARG  15  -7.647  12.037  14.005
   93   2HG   ARG  15          HG1       ARG  15  -9.327  11.525  14.137
   94   1HD   ARG  15          HD2       ARG  15  -8.132  14.146  15.064
   95   2HD   ARG  15          HD1       ARG  15  -9.279  13.889  13.751
   96    HE   ARG  15           HE       ARG  15 -10.452  12.909  16.073
   97   1HH1  ARG  15          HH11      ARG  15  -9.378  15.969  14.782
   98   2HH1  ARG  15          HH12      ARG  15 -10.552  16.892  15.656
   99   1HH2  ARG  15          HH21      ARG  15 -11.997  14.124  17.225
  100   2HH2  ARG  15          HH22      ARG  15 -12.039  15.846  17.045
  101    H    THR  16           HN       THR  16  -8.348   8.161  14.175
  102    HA   THR  16           HA       THR  16 -11.105   7.571  14.930
  103    HB   THR  16           HB       THR  16 -11.883   7.679  12.618
  104    HG1  THR  16           HG1      THR  16 -10.546   7.836  11.011
  105   2HG2  THR  16          2HG2      THR  16 -10.652  10.284  12.526
  106   2HG2  THR  16          2HG2      THR  16 -11.280   9.912  14.131
  107   3HG2  THR  16          3HG2      THR  16 -12.347   9.838  12.728
  108    H    GLN  17           HN       GLN  17 -11.261   5.951  12.349
  109    HA   GLN  17           HA       GLN  17  -9.799   3.641  13.373
  110   1HB   GLN  17          HB2       GLN  17 -11.175   2.395  11.645
  111   2HB   GLN  17          HB1       GLN  17 -12.079   3.133  12.959
  112   1HG   GLN  17          HG2       GLN  17 -13.205   3.435  10.832
  113   2HG   GLN  17          HG1       GLN  17 -12.707   4.983  11.510
  114    H    LEU  18           HN       LEU  18  -8.443   5.833  12.070
  115    HA   LEU  18           HA       LEU  18  -7.799   5.456   9.411
  116   1HB   LEU  18          HB2       LEU  18  -5.901   6.331  11.584
  117   2HB   LEU  18          HB1       LEU  18  -5.776   6.698   9.875
  118    HG   LEU  18           HG       LEU  18  -7.883   7.718  11.780
  119   1HD1  LEU  18          1HD1      LEU  18  -6.139   9.546  10.269
  120   2HD1  LEU  18          2HD1      LEU  18  -5.355   8.605  11.539
  121   3HD1  LEU  18          3HD1      LEU  18  -6.726   9.643  11.929
  122   1HD2  LEU  18          1HD2      LEU  18  -8.772   7.291   9.515
  123   2HD2  LEU  18          2HD2      LEU  18  -7.520   8.345   8.855
  124   3HD2  LEU  18          3HD2      LEU  18  -8.748   9.003   9.938
  125    H    TRP  19           HN       TRP  19  -5.964   4.508   8.390
  126    HA   TRP  19           HA       TRP  19  -4.573   2.409   9.872
  127   1HB   TRP  19          HB2       TRP  19  -4.990   0.769   8.076
  128   2HB   TRP  19          HB1       TRP  19  -6.479   1.275   8.862
  129    HD1  TRP  19           HD1      TRP  19  -4.906   0.958   5.510
  130    HE1  TRP  19           HE1      TRP  19  -6.445   1.961   3.709
  131    HE3  TRP  19           HE3      TRP  19  -8.215   3.405   8.541
  132    HZ2  TRP  19           HZ2      TRP  19  -8.751   3.583   3.588
  133    HZ3  TRP  19           HZ3      TRP  19 -10.058   4.660   7.502
  134    HH2  TRP  19           HH2      TRP  19 -10.320   4.748   5.076
  135    H    PHE  20           HN       PHE  20  -3.226   4.499   9.497
  136    HA   PHE  20           HA       PHE  20  -1.608   4.116   7.067
  137   1HB   PHE  20          HB2       PHE  20  -2.691   6.181   6.735
  138   2HB   PHE  20          HB1       PHE  20  -2.526   6.640   8.424
  139    HD1  PHE  20           HD1      PHE  20   0.090   5.387   6.094
  140    HD2  PHE  20           HD2      PHE  20  -1.425   8.665   8.343
  141    HE1  PHE  20           HE1      PHE  20   2.107   6.689   5.549
  142    HE2  PHE  20           HE2      PHE  20   0.586   9.972   7.803
  143    HZ   PHE  20           HZ       PHE  20   2.353   8.986   6.406
  144    H    HIS  21           HN       HIS  21   0.517   3.803   7.350
  145    HA   HIS  21           HA       HIS  21   1.777   4.558   9.899
  146   1HB   HIS  21          HB2       HIS  21   0.969   2.123   9.887
  147   2HB   HIS  21          HB1       HIS  21   2.206   1.833   8.671
  148    HD1  HIS  21           HD1      HIS  21   3.113   0.138  10.561
  149    HD2  HIS  21           HD2      HIS  21   3.449   4.190  11.416
  150    HE1  HIS  21           HE1      HIS  21   4.762   0.291  12.452
  151    HE2  HIS  21           HE2      HIS  21   4.881   2.745  13.010
  152    H    GLY  22           HN       GLY  22   4.164   4.717   9.749
  153   1HA   GLY  22          HA2       GLY  22   5.005   5.264   7.011
  154   2HA   GLY  22          HA1       GLY  22   5.761   5.883   8.466
  155    H    ARG  23           HN       ARG  23   7.364   4.770   9.413
  156    HA   ARG  23           HA       ARG  23   8.788   2.911   7.866
  157   1HB   ARG  23          HB2       ARG  23   9.636   4.536   9.664
  158   2HB   ARG  23          HB1       ARG  23   9.222   3.273  10.809
  159   1HG   ARG  23          HG2       ARG  23  10.697   1.717   9.627
  160   2HG   ARG  23          HG1       ARG  23  11.142   3.002   8.504
  161   1HD   ARG  23          HD2       ARG  23  12.874   2.904  10.105
  162   2HD   ARG  23          HD1       ARG  23  11.909   4.321  10.520
  163    HE   ARG  23           HE       ARG  23  11.505   3.347  12.533
  164   1HH1  ARG  23          HH11      ARG  23  12.289   0.824  10.249
  165   2HH1  ARG  23          HH12      ARG  23  12.168  -0.445  11.420
  166   1HH2  ARG  23          HH21      ARG  23  11.352   1.673  14.073
  167   2HH2  ARG  23          HH22      ARG  23  11.639   0.035  13.589
  168    H    ILE  24           HN       ILE  24   7.824   1.027   7.438
  169    HA   ILE  24           HA       ILE  24   7.631  -0.841   9.665
  170    HB   ILE  24           HB       ILE  24   5.317  -0.198   9.354
  171   1HG1  ILE  24          2HG1      ILE  24   5.889  -2.908   8.136
  172   2HG1  ILE  24          1HG1      ILE  24   5.783  -2.553   9.857
  173   2HG2  ILE  24          2HG2      ILE  24   5.374  -1.175   6.531
  174   2HG2  ILE  24          2HG2      ILE  24   5.753   0.502   6.924
  175   3HG2  ILE  24          3HG2      ILE  24   4.176  -0.167   7.341
  176   1HD1  ILE  24          1HD1      ILE  24   3.639  -2.837   7.838
  177   2HD1  ILE  24          2HD1      ILE  24   3.389  -1.677   9.142
  178   3HD1  ILE  24          3HD1      ILE  24   3.699  -3.372   9.517
  179    H    SER  25           HN       SER  25   9.235  -2.133   9.150
  180    HA   SER  25           HA       SER  25  10.616  -2.574   6.939
  181   1HB   SER  25          HB2       SER  25  11.010  -4.928   7.704
  182   2HB   SER  25          HB1       SER  25  11.186  -3.714   8.972
  183    HG   SER  25           HG       SER  25   9.374  -4.400   9.909
  184    H    ARG  26           HN       ARG  26   9.599  -2.451   4.990
  185    HA   ARG  26           HA       ARG  26   7.318  -3.709   4.121
  186   1HB   ARG  26          HB2       ARG  26   8.088  -2.192   2.576
  187   2HB   ARG  26          HB1       ARG  26   9.758  -2.661   2.784
  188   1HG   ARG  26          HG2       ARG  26   8.021  -4.675   1.529
  189   2HG   ARG  26          HG1       ARG  26   8.284  -3.204   0.599
  190   1HD   ARG  26          HD2       ARG  26  10.542  -4.804   1.784
  191   2HD   ARG  26          HD1       ARG  26   9.880  -5.145   0.191
  192    HE   ARG  26           HE       ARG  26  10.853  -3.202  -0.621
  193   1HH1  ARG  26          HH11      ARG  26  11.414  -3.499   2.820
  194   2HH1  ARG  26          HH12      ARG  26  12.473  -2.132   2.886
  195   1HH2  ARG  26          HH21      ARG  26  12.251  -1.414  -0.522
  196   2HH2  ARG  26          HH22      ARG  26  12.950  -0.953   0.993
  197    H    GLU  27           HN       GLU  27  10.639  -4.967   3.891
  198    HA   GLU  27           HA       GLU  27  10.113  -7.373   2.642
  199   1HB   GLU  27          HB2       GLU  27  12.177  -6.814   4.778
  200   2HB   GLU  27          HB1       GLU  27  12.191  -8.196   3.690
  201   1HG   GLU  27          HG2       GLU  27  12.418  -6.694   1.779
  202   2HG   GLU  27          HG1       GLU  27  12.401  -5.308   2.868
  203    H    GLU  28           HN       GLU  28  10.127  -6.713   6.145
  204    HA   GLU  28           HA       GLU  28   9.302  -9.399   6.766
  205   1HB   GLU  28          HB2       GLU  28   9.474  -6.954   8.529
  206   2HB   GLU  28          HB1       GLU  28   9.210  -8.597   9.092
  207   1HG   GLU  28          HG2       GLU  28  11.662  -7.595   7.662
  208   2HG   GLU  28          HG1       GLU  28  11.522  -7.905   9.393
  209    H    SER  29           HN       SER  29   7.718  -6.365   6.174
  210    HA   SER  29           HA       SER  29   5.327  -6.655   7.530
  211   1HB   SER  29          HB2       SER  29   5.767  -5.501   4.765
  212   2HB   SER  29          HB1       SER  29   4.321  -5.256   5.744
  213    HG   SER  29           HG       SER  29   5.629  -3.520   6.116
  214    H    GLN  30           HN       GLN  30   6.300  -8.058   4.440
  215    HA   GLN  30           HA       GLN  30   3.821  -9.169   3.747
  216   1HB   GLN  30          HB2       GLN  30   6.586 -10.201   3.083
  217   2HB   GLN  30          HB1       GLN  30   5.098 -10.644   2.256
  218   1HG   GLN  30          HG2       GLN  30   4.812  -8.339   1.521
  219   2HG   GLN  30          HG1       GLN  30   6.300  -7.888   2.353
  220    H    ARG  31           HN       ARG  31   6.153 -10.112   6.111
  221    HA   ARG  31           HA       ARG  31   5.307 -12.848   6.301
  222   1HB   ARG  31          HB2       ARG  31   7.575 -12.190   6.942
  223   2HB   ARG  31          HB1       ARG  31   6.930 -11.152   8.205
  224   1HG   ARG  31          HG2       ARG  31   7.747 -13.175   9.191
  225   2HG   ARG  31          HG1       ARG  31   5.987 -13.150   9.314
  226   1HD   ARG  31          HD2       ARG  31   7.470 -14.576   7.115
  227   2HD   ARG  31          HD1       ARG  31   7.020 -15.351   8.633
  228    HE   ARG  31           HE       ARG  31   4.718 -14.212   7.573
  229   1HH1  ARG  31          HH11      ARG  31   7.008 -16.706   6.731
  230   2HH1  ARG  31          HH12      ARG  31   5.847 -17.652   5.862
  231   1HH2  ARG  31          HH21      ARG  31   3.189 -15.454   6.430
  232   2HH2  ARG  31          HH22      ARG  31   3.679 -16.941   5.689
  233    H    LEU  32           HN       LEU  32   4.593  -9.844   8.009
  234    HA   LEU  32           HA       LEU  32   2.957 -11.123   9.992
  235   1HB   LEU  32          HB2       LEU  32   3.268  -8.223   9.220
  236   2HB   LEU  32          HB1       LEU  32   2.278  -8.780  10.555
  237    HG   LEU  32           HG       LEU  32   4.308  -9.728  11.624
  238   1HD1  LEU  32          1HD1      LEU  32   5.764 -10.155   9.830
  239   2HD1  LEU  32          2HD1      LEU  32   6.505  -8.832  10.730
  240   3HD1  LEU  32          3HD1      LEU  32   5.639  -8.502   9.229
  241   1HD2  LEU  32          1HD2      LEU  32   5.310  -7.539  12.230
  242   2HD2  LEU  32          2HD2      LEU  32   3.549  -7.559  12.319
  243   3HD2  LEU  32          3HD2      LEU  32   4.354  -6.791  10.950
  244    H    ILE  33           HN       ILE  33   2.220  -8.897   7.301
  245    HA   ILE  33           HA       ILE  33  -0.595  -9.375   7.476
  246    HB   ILE  33           HB       ILE  33   1.063  -8.055   5.320
  247   1HG1  ILE  33          2HG1      ILE  33   0.012  -5.981   6.224
  248   2HG1  ILE  33          1HG1      ILE  33  -0.719  -6.946   7.500
  249   2HG2  ILE  33          2HG2      ILE  33  -1.832  -8.682   5.448
  250   2HG2  ILE  33          2HG2      ILE  33  -0.759  -8.554   4.055
  251   3HG2  ILE  33          3HG2      ILE  33  -1.371  -7.094   4.833
  252   1HD1  ILE  33          1HD1      ILE  33   1.408  -5.659   8.043
  253   2HD1  ILE  33          2HD1      ILE  33   2.245  -6.883   7.087
  254   3HD1  ILE  33          3HD1      ILE  33   1.335  -7.355   8.522
  255    H    GLY  34           HN       GLY  34   1.902 -11.276   6.301
  256   1HA   GLY  34          HA2       GLY  34   0.269 -12.450   4.171
  257   2HA   GLY  34          HA1       GLY  34   1.963 -12.800   4.482
  258    H    GLN  35           HN       GLN  35  -0.192 -12.664   7.123
  259    HA   GLN  35           HA       GLN  35  -0.153 -15.588   7.345
  260   1HB   GLN  35          HB2       GLN  35  -0.299 -15.354   9.711
  261   2HB   GLN  35          HB1       GLN  35   0.935 -14.215   9.193
  262   1HG   GLN  35          HG2       GLN  35  -0.294 -13.010  10.738
  263   2HG   GLN  35          HG1       GLN  35  -0.961 -12.482   9.194
  264    H    GLN  36           HN       GLN  36  -2.022 -12.851   6.640
  265    HA   GLN  36           HA       GLN  36  -4.514 -13.724   7.698
  266   1HB   GLN  36          HB2       GLN  36  -3.544 -11.494   6.081
  267   2HB   GLN  36          HB1       GLN  36  -5.158 -12.030   5.626
  268   1HG   GLN  36          HG2       GLN  36  -6.059 -11.115   7.425
  269   2HG   GLN  36          HG1       GLN  36  -4.881 -11.883   8.486
  270    H    GLY  37           HN       GLY  37  -6.076 -14.982   6.783
  271   1HA   GLY  37          HA2       GLY  37  -5.365 -16.296   4.254
  272   2HA   GLY  37          HA1       GLY  37  -6.494 -16.918   5.453
  273    H    LEU  38           HN       LEU  38  -6.757 -13.582   4.657
  274    HA   LEU  38           HA       LEU  38  -9.383 -14.017   3.564
  275   1HB   LEU  38          HB2       LEU  38  -7.804 -11.481   3.978
  276   2HB   LEU  38          HB1       LEU  38  -9.469 -11.543   3.431
  277    HG   LEU  38           HG       LEU  38  -9.415 -11.000   5.779
  278   1HD1  LEU  38          1HD1      LEU  38 -11.255 -12.392   4.992
  279   2HD1  LEU  38          2HD1      LEU  38 -10.832 -12.776   6.661
  280   3HD1  LEU  38          3HD1      LEU  38 -10.319 -13.843   5.353
  281   1HD2  LEU  38          1HD2      LEU  38  -8.322 -12.223   7.426
  282   2HD2  LEU  38          2HD2      LEU  38  -7.167 -12.219   6.094
  283   3HD2  LEU  38          3HD2      LEU  38  -8.156 -13.646   6.399
  284    H    VAL  39           HN       VAL  39  -9.980 -12.538   1.623
  285    HA   VAL  39           HA       VAL  39  -8.471 -13.481  -0.623
  286    HB   VAL  39           HB       VAL  39 -10.224 -12.408  -1.977
  287   1HG1  VAL  39          1HG1      VAL  39 -12.076 -13.813  -1.254
  288   2HG1  VAL  39          2HG1      VAL  39 -11.317 -14.027   0.324
  289   3HG1  VAL  39          3HG1      VAL  39 -10.549 -14.686  -1.121
  290   2HG2  VAL  39          2HG2      VAL  39 -10.708 -11.039   0.552
  291   2HG2  VAL  39          2HG2      VAL  39 -12.181 -11.697  -0.166
  292   3HG2  VAL  39          3HG2      VAL  39 -11.172 -10.585  -1.090
  293    H    ASP  40           HN       ASP  40  -8.472 -11.787  -2.536
  294    HA   ASP  40           HA       ASP  40  -6.367  -9.987  -1.969
  295   1HB   ASP  40          HB2       ASP  40  -8.231  -9.937  -4.349
  296   2HB   ASP  40          HB1       ASP  40  -6.615  -9.270  -4.262
  297    H    GLY  41           HN       GLY  41  -8.045  -9.330  -0.088
  298   1HA   GLY  41          HA2       GLY  41  -9.047  -6.699  -1.006
  299   2HA   GLY  41          HA1       GLY  41 -10.131  -7.749  -0.113
  300    H    LEU  42           HN       LEU  42  -7.238  -8.342   1.249
  301    HA   LEU  42           HA       LEU  42  -7.796  -6.345   3.306
  302   1HB   LEU  42          HB2       LEU  42  -6.286  -8.946   3.356
  303   2HB   LEU  42          HB1       LEU  42  -6.203  -7.796   4.675
  304    HG   LEU  42           HG       LEU  42  -7.832  -9.686   4.994
  305   1HD1  LEU  42          1HD1      LEU  42  -7.963  -7.130   5.835
  306   2HD1  LEU  42          2HD1      LEU  42  -9.117  -8.377   6.307
  307   3HD1  LEU  42          3HD1      LEU  42  -9.509  -7.263   4.997
  308   1HD2  LEU  42          1HD2      LEU  42  -9.458  -8.216   2.930
  309   2HD2  LEU  42          2HD2      LEU  42  -9.916  -9.669   3.814
  310   3HD2  LEU  42          3HD2      LEU  42  -8.608  -9.732   2.633
  311    H    PHE  43           HN       PHE  43  -6.884  -4.552   2.599
  312    HA   PHE  43           HA       PHE  43  -3.980  -4.631   2.143
  313   1HB   PHE  43          HB2       PHE  43  -4.211  -2.712   0.650
  314   2HB   PHE  43          HB1       PHE  43  -5.168  -4.075   0.092
  315    HD1  PHE  43           HD1      PHE  43  -5.936  -1.934  -1.274
  316    HD2  PHE  43           HD2      PHE  43  -6.923  -2.705   2.792
  317    HE1  PHE  43           HE1      PHE  43  -7.891  -0.462  -1.467
  318    HE2  PHE  43           HE2      PHE  43  -8.875  -1.234   2.606
  319    HZ   PHE  43           HZ       PHE  43  -9.366  -0.109   0.472
  320    H    LEU  44           HN       LEU  44  -2.846  -2.542   2.568
  321    HA   LEU  44           HA       LEU  44  -4.046  -0.941   4.710
  322   1HB   LEU  44          HB2       LEU  44  -2.770  -2.724   5.813
  323   2HB   LEU  44          HB1       LEU  44  -1.348  -2.291   4.886
  324    HG   LEU  44           HG       LEU  44  -1.330  -0.071   6.007
  325   1HD1  LEU  44          1HD1      LEU  44  -3.426   0.446   6.738
  326   2HD1  LEU  44          2HD1      LEU  44  -2.736  -0.184   8.234
  327   3HD1  LEU  44          3HD1      LEU  44  -3.780  -1.205   7.247
  328   1HD2  LEU  44          1HD2      LEU  44  -0.198  -0.837   7.854
  329   2HD2  LEU  44          2HD2      LEU  44  -0.201  -2.280   6.839
  330   3HD2  LEU  44          3HD2      LEU  44  -1.356  -2.131   8.164
  331    H    VAL  45           HN       VAL  45  -3.130   1.179   4.908
  332    HA   VAL  45           HA       VAL  45  -1.533   1.931   2.554
  333    HB   VAL  45           HB       VAL  45  -3.274   3.699   4.279
  334   1HG1  VAL  45          1HG1      VAL  45  -1.312   4.854   3.301
  335   2HG1  VAL  45          2HG1      VAL  45  -2.843   5.434   2.646
  336   3HG1  VAL  45          3HG1      VAL  45  -1.838   4.337   1.698
  337   2HG2  VAL  45          2HG2      VAL  45  -3.668   2.598   1.499
  338   2HG2  VAL  45          2HG2      VAL  45  -4.701   3.806   2.264
  339   3HG2  VAL  45          3HG2      VAL  45  -4.598   2.179   2.938
  340    H    ARG  46           HN       ARG  46   0.369   1.176   3.644
  341    HA   ARG  46           HA       ARG  46   1.356   2.909   5.809
  342   1HB   ARG  46          HB2       ARG  46   3.018   1.132   6.106
  343   2HB   ARG  46          HB1       ARG  46   1.387   0.455   6.140
  344   1HG   ARG  46          HG2       ARG  46   1.586  -0.190   3.807
  345   2HG   ARG  46          HG1       ARG  46   3.204   0.506   3.742
  346   1HD   ARG  46          HD2       ARG  46   3.305  -1.191   5.892
  347   2HD   ARG  46          HD1       ARG  46   2.297  -2.042   4.721
  348    HE   ARG  46           HE       ARG  46   4.207  -2.467   3.578
  349   1HH1  ARG  46          HH11      ARG  46   4.622   0.620   5.133
  350   2HH1  ARG  46          HH12      ARG  46   6.259   0.792   4.603
  351   1HH2  ARG  46          HH21      ARG  46   6.337  -2.235   2.882
  352   2HH2  ARG  46          HH22      ARG  46   7.232  -0.836   3.363
  353    H    GLU  47           HN       GLU  47   3.829   3.320   5.617
  354    HA   GLU  47           HA       GLU  47   4.643   3.448   2.830
  355   1HB   GLU  47          HB2       GLU  47   5.138   5.798   2.852
  356   2HB   GLU  47          HB1       GLU  47   3.485   5.618   3.392
  357   1HG   GLU  47          HG2       GLU  47   4.090   6.047   5.633
  358   2HG   GLU  47          HG1       GLU  47   5.809   5.947   5.253
  359    H    SER  48           HN       SER  48   6.887   5.173   3.481
  360    HA   SER  48           HA       SER  48   8.332   3.578   5.439
  361   1HB   SER  48          HB2       SER  48  10.269   3.330   3.933
  362   2HB   SER  48          HB1       SER  48   8.851   2.506   3.294
  363    HG   SER  48           HG       SER  48   9.136   3.664   1.578
  364    H    GLN  49           HN       GLN  49   9.876   4.710   6.509
  365    HA   GLN  49           HA       GLN  49   9.875   7.583   5.967
  366   1HB   GLN  49          HB2       GLN  49  10.526   7.889   8.249
  367   2HB   GLN  49          HB1       GLN  49   9.247   6.670   8.255
  368   1HG   GLN  49          HG2       GLN  49  10.899   5.950   9.777
  369   2HG   GLN  49          HG1       GLN  49  11.044   4.931   8.348
  370    H    ARG  50           HN       ARG  50  11.402   5.187   4.741
  371    HA   ARG  50           HA       ARG  50  14.138   6.191   5.023
  372   1HB   ARG  50          HB2       ARG  50  13.806   3.778   5.433
  373   2HB   ARG  50          HB1       ARG  50  13.136   3.602   3.819
  374   1HG   ARG  50          HG2       ARG  50  15.364   2.841   3.712
  375   2HG   ARG  50          HG1       ARG  50  15.339   4.420   2.928
  376   1HD   ARG  50          HD2       ARG  50  16.143   3.960   5.798
  377   2HD   ARG  50          HD1       ARG  50  17.281   4.051   4.456
  378    HE   ARG  50           HE       ARG  50  16.088   6.230   5.807
  379   1HH1  ARG  50          HH11      ARG  50  17.099   5.195   2.630
  380   2HH1  ARG  50          HH12      ARG  50  17.329   6.808   2.043
  381   1HH2  ARG  50          HH21      ARG  50  16.394   8.350   5.036
  382   2HH2  ARG  50          HH22      ARG  50  16.932   8.598   3.409
  383    H    ASN  51           HN       ASN  51  11.616   5.396   2.615
  384    HA   ASN  51           HA       ASN  51  13.271   6.364   0.454
  385   1HB   ASN  51          HB2       ASN  51  10.309   5.789   0.416
  386   2HB   ASN  51          HB1       ASN  51  11.394   5.872  -0.967
  387   1HD2  ASN  51          1HD2      ASN  51  13.260   4.417   1.237
  388   2HD2  ASN  51          2HD2      ASN  51  12.839   2.769   0.960
  389    HA   PRO  52           HA       PRO  52  12.541  10.751   1.059
  390   1HB   PRO  52          HB2       PRO  52  12.482  10.635  -1.935
  391   2HB   PRO  52          HB1       PRO  52  13.331  11.766  -0.873
  392   1HG   PRO  52          HG2       PRO  52  14.640   9.771  -2.062
  393   2HG   PRO  52          HG1       PRO  52  15.031  10.262  -0.405
  394   1HD   PRO  52          HD2       PRO  52  13.607   7.844  -1.375
  395   2HD   PRO  52          HD1       PRO  52  14.579   8.073   0.092
  396    H    GLN  53           HN       GLN  53  10.743   8.763  -1.170
  397    HA   GLN  53           HA       GLN  53   8.243  10.077  -0.419
  398   1HB   GLN  53          HB2       GLN  53   7.495   9.991  -2.792
  399   2HB   GLN  53          HB1       GLN  53   8.799  11.133  -2.521
  400   1HG   GLN  53          HG2       GLN  53  10.398   9.495  -3.396
  401   2HG   GLN  53          HG1       GLN  53   9.073   8.376  -3.698
  402    H    GLY  54           HN       GLY  54   8.521   8.049   0.896
  403   1HA   GLY  54          HA2       GLY  54   8.009   5.607  -0.619
  404   2HA   GLY  54          HA1       GLY  54   8.535   5.698   1.040
  405    H    PHE  55           HN       PHE  55   5.656   6.658  -0.881
  406    HA   PHE  55           HA       PHE  55   3.971   5.829   1.373
  407   1HB   PHE  55          HB2       PHE  55   3.296   7.358  -1.156
  408   2HB   PHE  55          HB1       PHE  55   2.131   6.916   0.086
  409    HD1  PHE  55           HD1      PHE  55   5.526   8.493   0.055
  410    HD2  PHE  55           HD2      PHE  55   1.487   8.673   1.386
  411    HE1  PHE  55           HE1      PHE  55   6.025  10.569   1.273
  412    HE2  PHE  55           HE2      PHE  55   1.979  10.754   2.603
  413    HZ   PHE  55           HZ       PHE  55   4.250  11.704   2.547
  414    H    VAL  56           HN       VAL  56   3.190   3.874   1.375
  415    HA   VAL  56           HA       VAL  56   2.773   2.475  -1.167
  416    HB   VAL  56           HB       VAL  56   4.213   0.877  -0.568
  417   1HG1  VAL  56          1HG1      VAL  56   5.734   1.161   1.089
  418   2HG1  VAL  56          2HG1      VAL  56   4.527   1.633   2.277
  419   3HG1  VAL  56          3HG1      VAL  56   5.064   2.791   1.053
  420   2HG2  VAL  56          2HG2      VAL  56   3.734  -0.640   1.291
  421   2HG2  VAL  56          2HG2      VAL  56   2.295  -0.310   0.331
  422   3HG2  VAL  56          3HG2      VAL  56   2.518   0.488   1.889
  423    H    LEU  57           HN       LEU  57   1.297   0.810  -1.247
  424    HA   LEU  57           HA       LEU  57  -0.794   0.775   0.804
  425   1HB   LEU  57          HB2       LEU  57  -1.402   1.958  -1.443
  426   2HB   LEU  57          HB1       LEU  57  -1.385   0.342  -2.120
  427    HG   LEU  57           HG       LEU  57  -3.214   1.401   0.022
  428   1HD1  LEU  57          1HD1      LEU  57  -3.832   1.986  -2.253
  429   2HD1  LEU  57          2HD1      LEU  57  -4.962   0.814  -1.578
  430   3HD1  LEU  57          3HD1      LEU  57  -3.734   0.291  -2.729
  431   1HD2  LEU  57          1HD2      LEU  57  -4.201  -0.832   0.097
  432   2HD2  LEU  57          2HD2      LEU  57  -2.518  -0.852   0.628
  433   3HD2  LEU  57          3HD2      LEU  57  -2.942  -1.424  -0.987
  434    H    SER  58           HN       SER  58  -0.707  -1.216   1.684
  435    HA   SER  58           HA       SER  58   0.557  -3.353   0.147
  436   1HB   SER  58          HB2       SER  58  -0.233  -3.466   3.054
  437   2HB   SER  58          HB1       SER  58   1.011  -4.400   2.219
  438    HG   SER  58           HG       SER  58   1.103  -1.584   2.483
  439    H    LEU  59           HN       LEU  59  -0.412  -5.174  -0.452
  440    HA   LEU  59           HA       LEU  59  -3.297  -5.372   0.031
  441   1HB   LEU  59          HB2       LEU  59  -1.528  -6.446  -2.158
  442   2HB   LEU  59          HB1       LEU  59  -3.203  -6.928  -1.966
  443    HG   LEU  59           HG       LEU  59  -2.734  -5.120  -3.686
  444   1HD1  LEU  59          1HD1      LEU  59  -4.834  -5.341  -1.734
  445   2HD1  LEU  59          2HD1      LEU  59  -4.926  -4.910  -3.441
  446   3HD1  LEU  59          3HD1      LEU  59  -4.625  -3.662  -2.232
  447   1HD2  LEU  59          1HD2      LEU  59  -2.296  -2.914  -3.004
  448   2HD2  LEU  59          2HD2      LEU  59  -1.133  -3.908  -2.124
  449   3HD2  LEU  59          3HD2      LEU  59  -2.572  -3.299  -1.305
  450    H    CYS  60           HN       CYS  60  -4.123  -7.688  -0.074
  451    HA   CYS  60           HA       CYS  60  -2.365  -9.631   1.151
  452   1HB   CYS  60          HB2       CYS  60  -3.529  -8.481   3.048
  453   2HB   CYS  60          HB1       CYS  60  -5.065  -8.941   2.324
  454    HG   CYS  60           HG       CYS  60  -3.094 -10.673   4.316
  455    H    HIS  61           HN       HIS  61  -2.451 -10.432  -0.840
  456    HA   HIS  61           HA       HIS  61  -4.945 -11.170  -2.016
  457   1HB   HIS  61          HB2       HIS  61  -3.582 -10.430  -3.606
  458   2HB   HIS  61          HB1       HIS  61  -2.127 -10.861  -2.758
  459    HD1  HIS  61           HD1      HIS  61  -1.055 -11.664  -4.929
  460    HD2  HIS  61           HD2      HIS  61  -4.569 -13.696  -4.058
  461    HE1  HIS  61           HE1      HIS  61  -1.168 -13.556  -6.574
  462    HE2  HIS  61           HE2      HIS  61  -3.330 -14.736  -6.060
  463    H    LEU  62           HN       LEU  62  -5.239 -13.475  -2.737
  464    HA   LEU  62           HA       LEU  62  -4.545 -15.158  -0.458
  465   1HB   LEU  62          HB2       LEU  62  -6.271 -16.725  -1.322
  466   2HB   LEU  62          HB1       LEU  62  -6.879 -15.142  -0.894
  467    HG   LEU  62           HG       LEU  62  -7.898 -16.093  -2.945
  468   1HD1  LEU  62          1HD1      LEU  62  -7.124 -13.502  -2.470
  469   2HD1  LEU  62          2HD1      LEU  62  -8.256 -14.040  -3.708
  470   3HD1  LEU  62          3HD1      LEU  62  -6.557 -13.797  -4.115
  471   1HD2  LEU  62          1HD2      LEU  62  -6.652 -16.220  -5.000
  472   2HD2  LEU  62          2HD2      LEU  62  -5.892 -17.248  -3.788
  473   3HD2  LEU  62          3HD2      LEU  62  -5.185 -15.682  -4.186
  474    H    GLN  63           HN       GLN  63  -2.549 -14.651  -1.849
  475    HA   GLN  63           HA       GLN  63  -1.664 -17.250  -2.344
  476   1HB   GLN  63          HB2       GLN  63  -1.379 -15.189  -4.529
  477   2HB   GLN  63          HB1       GLN  63  -0.460 -16.680  -4.474
  478   1HG   GLN  63          HG2       GLN  63  -3.461 -16.560  -4.595
  479   2HG   GLN  63          HG1       GLN  63  -2.416 -16.728  -6.004
  480    H    LYS  64           HN       LYS  64  -1.070 -13.792  -2.277
  481    HA   LYS  64           HA       LYS  64   1.103 -14.259  -0.455
  482   1HB   LYS  64          HB2       LYS  64   2.786 -12.994  -1.740
  483   2HB   LYS  64          HB1       LYS  64   2.299 -14.475  -2.543
  484   1HG   LYS  64          HG2       LYS  64   2.434 -12.880  -4.240
  485   2HG   LYS  64          HG1       LYS  64   0.709 -13.038  -3.903
  486   1HD   LYS  64          HD2       LYS  64   0.675 -10.999  -2.686
  487   2HD   LYS  64          HD1       LYS  64   2.437 -10.905  -2.666
  488   1HE   LYS  64          HE2       LYS  64   0.649 -10.679  -5.084
  489   2HE   LYS  64          HE1       LYS  64   1.517  -9.364  -4.296
  490   1HZ   LYS  64          HZ1       LYS  64   2.527 -11.465  -6.049
  491   2HZ   LYS  64          HZ2       LYS  64   3.541 -10.960  -4.793
  492   3HZ   LYS  64          HZ3       LYS  64   2.985  -9.840  -5.932
  493    H    VAL  65           HN       VAL  65   2.271 -11.741  -0.509
  494    HA   VAL  65           HA       VAL  65   0.124  -9.785  -0.187
  495    HB   VAL  65           HB       VAL  65   1.028  -9.025   1.969
  496   1HG1  VAL  65          1HG1      VAL  65   0.062 -10.725   3.319
  497   2HG1  VAL  65          2HG1      VAL  65   0.392 -11.962   2.105
  498   3HG1  VAL  65          3HG1      VAL  65  -0.819 -10.718   1.790
  499   2HG2  VAL  65          2HG2      VAL  65   2.569 -10.602   3.191
  500   2HG2  VAL  65          2HG2      VAL  65   3.301  -9.702   1.863
  501   3HG2  VAL  65          3HG2      VAL  65   2.856 -11.395   1.644
  502    H    LYS  66           HN       LYS  66   0.808  -7.650  -0.679
  503    HA   LYS  66           HA       LYS  66   3.685  -7.328  -1.195
  504   1HB   LYS  66          HB2       LYS  66   3.358  -6.498  -3.417
  505   2HB   LYS  66          HB1       LYS  66   2.589  -8.071  -3.285
  506   1HG   LYS  66          HG2       LYS  66   0.433  -6.756  -2.830
  507   2HG   LYS  66          HG1       LYS  66   1.320  -5.369  -3.464
  508   1HD   LYS  66          HD2       LYS  66   0.584  -7.920  -4.875
  509   2HD   LYS  66          HD1       LYS  66   0.151  -6.269  -5.305
  510   1HE   LYS  66          HE2       LYS  66   2.922  -7.454  -5.404
  511   2HE   LYS  66          HE1       LYS  66   1.877  -7.155  -6.791
  512   1HZ   LYS  66          HZ1       LYS  66   3.105  -5.269  -6.830
  513   2HZ   LYS  66          HZ2       LYS  66   3.393  -5.266  -5.163
  514   3HZ   LYS  66          HZ3       LYS  66   1.901  -4.743  -5.763
  515    H    HIS  67           HN       HIS  67   3.861  -4.930  -2.317
  516    HA   HIS  67           HA       HIS  67   2.422  -3.042  -0.574
  517   1HB   HIS  67          HB2       HIS  67   5.384  -2.924  -1.178
  518   2HB   HIS  67          HB1       HIS  67   4.480  -1.849  -0.114
  519    HD1  HIS  67           HD1      HIS  67   3.352  -3.170   2.024
  520    HD2  HIS  67           HD2      HIS  67   6.545  -4.998   0.101
  521    HE1  HIS  67           HE1      HIS  67   4.214  -4.890   3.643
  522    HE2  HIS  67           HE2      HIS  67   6.217  -5.905   2.501
  523    H    TYR  68           HN       TYR  68   2.098  -0.966  -1.446
  524    HA   TYR  68           HA       TYR  68   2.731  -0.689  -4.308
  525   1HB   TYR  68          HB2       TYR  68   0.257   0.047  -2.787
  526   2HB   TYR  68          HB1       TYR  68   0.640   0.804  -4.324
  527    HD1  TYR  68           HD1      TYR  68  -0.781   0.016  -5.921
  528    HD2  TYR  68           HD2      TYR  68   0.880  -2.739  -3.143
  529    HE1  TYR  68           HE1      TYR  68  -1.846  -1.834  -7.131
  530    HE2  TYR  68           HE2      TYR  68  -0.176  -4.599  -4.350
  531    HH   TYR  68           HH       TYR  68  -1.159  -5.173  -6.340
  532    H    LEU  69           HN       LEU  69   4.743   0.513  -3.610
  533    HA   LEU  69           HA       LEU  69   4.021   3.308  -3.076
  534   1HB   LEU  69          HB2       LEU  69   4.732   2.854  -0.957
  535   2HB   LEU  69          HB1       LEU  69   5.867   1.647  -1.468
  536    HG   LEU  69           HG       LEU  69   6.720   3.915  -0.477
  537   1HD1  LEU  69          1HD1      LEU  69   7.788   2.112  -2.444
  538   2HD1  LEU  69          2HD1      LEU  69   8.597   2.912  -1.101
  539   3HD1  LEU  69          3HD1      LEU  69   8.441   3.729  -2.656
  540   1HD2  LEU  69          1HD2      LEU  69   6.982   4.929  -3.203
  541   2HD2  LEU  69          2HD2      LEU  69   6.613   5.783  -1.720
  542   3HD2  LEU  69          3HD2      LEU  69   5.331   4.970  -2.601
  543    H    ILE  70           HN       ILE  70   4.732   4.468  -4.715
  544    HA   ILE  70           HA       ILE  70   7.596   4.213  -5.193
  545    HB   ILE  70           HB       ILE  70   5.682   4.032  -7.482
  546   1HG1  ILE  70          2HG1      ILE  70   6.136   1.943  -6.214
  547   2HG1  ILE  70          1HG1      ILE  70   6.748   1.864  -7.851
  548   2HG2  ILE  70          2HG2      ILE  70   8.584   3.835  -7.963
  549   2HG2  ILE  70          2HG2      ILE  70   7.973   5.446  -7.598
  550   3HG2  ILE  70          3HG2      ILE  70   7.318   4.544  -8.962
  551   1HD1  ILE  70          1HD1      ILE  70   8.648   2.830  -5.854
  552   2HD1  ILE  70          2HD1      ILE  70   8.862   1.719  -7.204
  553   3HD1  ILE  70          3HD1      ILE  70   8.144   1.149  -5.701
  554    H    LEU  71           HN       LEU  71   4.652   5.831  -5.870
  555    HA   LEU  71           HA       LEU  71   6.092   8.383  -5.614
  556   1HB   LEU  71          HB2       LEU  71   4.091   7.820  -7.777
  557   2HB   LEU  71          HB1       LEU  71   5.038   9.282  -7.578
  558    HG   LEU  71           HG       LEU  71   6.142   6.557  -8.269
  559   1HD1  LEU  71          1HD1      LEU  71   5.652   8.997  -9.967
  560   2HD1  LEU  71          2HD1      LEU  71   4.861   7.426 -10.107
  561   3HD1  LEU  71          3HD1      LEU  71   6.580   7.585 -10.475
  562   1HD2  LEU  71          1HD2      LEU  71   7.722   9.017  -8.673
  563   2HD2  LEU  71          2HD2      LEU  71   8.232   7.403  -8.174
  564   3HD2  LEU  71          3HD2      LEU  71   7.496   8.498  -7.002
  565    HA   PRO  72           HA       PRO  72   2.376   9.248  -3.261
  566   1HB   PRO  72          HB2       PRO  72   3.289  11.349  -1.922
  567   2HB   PRO  72          HB1       PRO  72   4.002   9.757  -1.655
  568   1HG   PRO  72          HG2       PRO  72   5.041  12.043  -3.274
  569   2HG   PRO  72          HG1       PRO  72   5.920  10.936  -2.205
  570   1HD   PRO  72          HD2       PRO  72   5.721  10.707  -4.988
  571   2HD   PRO  72          HD1       PRO  72   6.224   9.420  -3.878
  572    H    SER  73           HN       SER  73   2.604  12.444  -2.897
  573    HA   SER  73           HA       SER  73   0.882  12.983  -5.187
  574   1HB   SER  73          HB2       SER  73   0.054  13.647  -2.980
  575   2HB   SER  73          HB1       SER  73   1.482  14.652  -2.731
  576    HG   SER  73           HG       SER  73  -0.522  15.703  -3.531
  577    H    GLU  74           HN       GLU  74   1.575  14.047  -6.928
  578    HA   GLU  74           HA       GLU  74   4.069  15.603  -6.709
  579   1HB   GLU  74          HB2       GLU  74   3.025  14.006  -9.054
  580   2HB   GLU  74          HB1       GLU  74   4.430  15.061  -9.119
  581   1HG   GLU  74          HG2       GLU  74   5.117  12.763  -8.872
  582   2HG   GLU  74          HG1       GLU  74   5.537  13.682  -7.427
  583    H    GLU  75           HN       GLU  75   4.237  17.150  -8.732
  584    HA   GLU  75           HA       GLU  75   1.789  18.754  -8.657
  585   1HB   GLU  75          HB2       GLU  75   4.572  19.472  -9.607
  586   2HB   GLU  75          HB1       GLU  75   3.207  20.578  -9.528
  587   1HG   GLU  75          HG2       GLU  75   4.463  19.186  -7.173
  588   2HG   GLU  75          HG1       GLU  75   4.748  20.858  -7.650
  589    H    GLU  76           HN       GLU  76   2.362  16.325 -10.299
  590    HA   GLU  76           HA       GLU  76   1.706  17.455 -12.927
  591   1HB   GLU  76          HB2       GLU  76   3.853  16.251 -12.976
  592   2HB   GLU  76          HB1       GLU  76   3.078  14.828 -12.295
  593   1HG   GLU  76          HG2       GLU  76   1.687  14.625 -14.289
  594   2HG   GLU  76          HG1       GLU  76   2.454  16.059 -14.970
  595    H    GLY  77           HN       GLY  77   0.606  15.856 -10.198
  596   1HA   GLY  77          HA2       GLY  77  -1.967  15.394 -11.229
  597   2HA   GLY  77          HA1       GLY  77  -1.093  13.870 -11.217
  598    H    ARG  78           HN       ARG  78  -1.783  12.719  -9.531
  599    HA   ARG  78           HA       ARG  78  -1.888  14.058  -6.910
  600   1HB   ARG  78          HB2       ARG  78  -3.760  11.906  -7.905
  601   2HB   ARG  78          HB1       ARG  78  -3.822  12.680  -6.329
  602   1HG   ARG  78          HG2       ARG  78  -4.233  14.057  -8.976
  603   2HG   ARG  78          HG1       ARG  78  -5.510  13.574  -7.859
  604   1HD   ARG  78          HD2       ARG  78  -3.318  15.580  -7.347
  605   2HD   ARG  78          HD1       ARG  78  -5.031  15.926  -7.582
  606    HE   ARG  78           HE       ARG  78  -4.767  14.152  -5.436
  607   1HH1  ARG  78          HH11      ARG  78  -4.016  17.462  -6.249
  608   2HH1  ARG  78          HH12      ARG  78  -4.132  18.023  -4.615
  609   1HH2  ARG  78          HH21      ARG  78  -4.919  14.888  -3.284
  610   2HH2  ARG  78          HH22      ARG  78  -4.644  16.561  -2.931
  611    H    LEU  79           HN       LEU  79  -2.776  10.959  -6.307
  612    HA   LEU  79           HA       LEU  79  -0.173  10.243  -5.339
  613   1HB   LEU  79          HB2       LEU  79  -2.651   8.524  -5.557
  614   2HB   LEU  79          HB1       LEU  79  -1.242   8.196  -4.572
  615    HG   LEU  79           HG       LEU  79  -3.182  10.470  -4.171
  616   1HD1  LEU  79          1HD1      LEU  79  -2.686   7.969  -2.562
  617   2HD1  LEU  79          2HD1      LEU  79  -4.108   8.306  -3.550
  618   3HD1  LEU  79          3HD1      LEU  79  -3.777   9.282  -2.120
  619   1HD2  LEU  79          1HD2      LEU  79  -1.927  10.971  -2.165
  620   2HD2  LEU  79          2HD2      LEU  79  -0.865  11.056  -3.570
  621   3HD2  LEU  79          3HD2      LEU  79  -0.807   9.652  -2.503
  622    H    TYR  80           HN       TYR  80   1.400   9.478  -6.657
  623    HA   TYR  80           HA       TYR  80   0.634   8.378  -9.206
  624   1HB   TYR  80          HB2       TYR  80   3.139   9.459  -8.080
  625   2HB   TYR  80          HB1       TYR  80   3.262   8.340  -9.435
  626    HD1  TYR  80           HD1      TYR  80   3.940   9.725 -11.196
  627    HD2  TYR  80           HD2      TYR  80   0.635  10.884  -8.787
  628    HE1  TYR  80           HE1      TYR  80   3.457  11.563 -12.756
  629    HE2  TYR  80           HE2      TYR  80   0.143  12.725 -10.335
  630    HH   TYR  80           HH       TYR  80   0.649  13.127 -12.936
  631    H    PHE  81           HN       PHE  81   0.475   6.401  -9.750
  632    HA   PHE  81           HA       PHE  81   2.086   4.335  -8.538
  633   1HB   PHE  81          HB2       PHE  81  -0.916   4.251  -8.708
  634   2HB   PHE  81          HB1       PHE  81   0.073   2.824  -8.432
  635    HD1  PHE  81           HD1      PHE  81   0.273   2.123  -6.264
  636    HD2  PHE  81           HD2      PHE  81  -0.311   6.270  -7.023
  637    HE1  PHE  81           HE1      PHE  81   0.219   2.562  -3.839
  638    HE2  PHE  81           HE2      PHE  81  -0.349   6.706  -4.602
  639    HZ   PHE  81           HZ       PHE  81  -0.088   4.854  -3.012
  640    H    SER  82           HN       SER  82   2.744   2.756  -9.891
  641    HA   SER  82           HA       SER  82   1.452   2.432 -12.466
  642   1HB   SER  82          HB2       SER  82   3.606   2.726 -13.687
  643   2HB   SER  82          HB1       SER  82   2.959   4.215 -13.006
  644    HG   SER  82           HG       SER  82   4.456   4.068 -11.349
  645    H    MET  83           HN       MET  83   1.801   0.696 -10.204
  646    HA   MET  83           HA       MET  83   3.794  -1.132 -10.178
  647   1HB   MET  83          HB2       MET  83   2.235  -2.749  -9.330
  648   2HB   MET  83          HB1       MET  83   1.760  -1.164  -8.737
  649   1HG   MET  83          HG2       MET  83  -0.025  -1.025 -10.292
  650   2HG   MET  83          HG1       MET  83   0.529  -2.462 -11.146
  651   1HE   MET  83          HE1       MET  83  -2.716  -3.892  -9.749
  652   2HE   MET  83          HE2       MET  83  -1.870  -3.186 -11.127
  653   3HE   MET  83          HE3       MET  83  -2.650  -2.139  -9.941
  654    H    ASP  84           HN       ASP  84   3.173  -3.608 -10.843
  655    HA   ASP  84           HA       ASP  84   4.015  -4.030 -13.390
  656   1HB   ASP  84          HB2       ASP  84   2.082  -5.764 -11.846
  657   2HB   ASP  84          HB1       ASP  84   3.031  -6.287 -13.233
  658    H    ASP  85           HN       ASP  85   0.596  -3.996 -12.383
  659    HA   ASP  85           HA       ASP  85  -0.111  -3.219 -15.126
  660   1HB   ASP  85          HB2       ASP  85  -0.511  -5.654 -14.858
  661   2HB   ASP  85          HB1       ASP  85  -1.590  -5.309 -13.511
  662    H    GLY  86           HN       GLY  86   0.172  -1.595 -12.803
  663   1HA   GLY  86          HA2       GLY  86  -2.586  -0.599 -12.627
  664   2HA   GLY  86          HA1       GLY  86  -1.685  -0.858 -11.142
  665    H    GLN  87           HN       GLN  87  -2.308   1.241 -13.740
  666    HA   GLN  87           HA       GLN  87  -0.245   3.106 -12.781
  667   1HB   GLN  87          HB2       GLN  87  -0.340   4.134 -15.057
  668   2HB   GLN  87          HB1       GLN  87   0.292   2.496 -15.047
  669   1HG   GLN  87          HG2       GLN  87  -2.587   3.092 -15.636
  670   2HG   GLN  87          HG1       GLN  87  -1.350   3.130 -16.886
  671    H    THR  88           HN       THR  88  -2.128   3.437 -11.211
  672    HA   THR  88           HA       THR  88  -4.137   5.207 -12.380
  673    HB   THR  88           HB       THR  88  -5.382   4.856 -10.270
  674    HG1  THR  88           HG1      THR  88  -4.566   3.703  -8.697
  675   2HG2  THR  88          2HG2      THR  88  -5.238   2.119 -10.741
  676   2HG2  THR  88          2HG2      THR  88  -4.872   2.880 -12.291
  677   3HG2  THR  88          3HG2      THR  88  -6.374   3.267 -11.447
  678    H    ARG  89           HN       ARG  89  -1.373   6.011 -11.669
  679    HA   ARG  89           HA       ARG  89  -0.941   7.477  -9.481
  680   1HB   ARG  89          HB2       ARG  89   0.306   9.097 -10.880
  681   2HB   ARG  89          HB1       ARG  89   0.630   7.428 -11.321
  682   1HG   ARG  89          HG2       ARG  89  -0.707   7.592 -13.269
  683   2HG   ARG  89          HG1       ARG  89  -1.365   9.149 -12.765
  684   1HD   ARG  89          HD2       ARG  89   0.829  10.175 -12.986
  685   2HD   ARG  89          HD1       ARG  89   1.531   8.617 -13.424
  686    HE   ARG  89           HE       ARG  89   0.214  10.418 -15.158
  687   1HH1  ARG  89          HH11      ARG  89   0.598   7.004 -14.534
  688   2HH1  ARG  89          HH12      ARG  89   0.223   6.539 -16.158
  689   1HH2  ARG  89          HH21      ARG  89  -0.273   9.805 -17.295
  690   2HH2  ARG  89          HH22      ARG  89  -0.269   8.127 -17.727
  691    H    PHE  90           HN       PHE  90  -3.424   7.882  -9.050
  692    HA   PHE  90           HA       PHE  90  -3.865  10.744  -9.476
  693   1HB   PHE  90          HB2       PHE  90  -5.159   9.421 -11.199
  694   2HB   PHE  90          HB1       PHE  90  -6.069   8.707  -9.874
  695    HD1  PHE  90           HD1      PHE  90  -8.213   9.529  -9.948
  696    HD2  PHE  90           HD2      PHE  90  -4.955  12.203 -10.532
  697    HE1  PHE  90           HE1      PHE  90  -9.785  11.421 -10.019
  698    HE2  PHE  90           HE2      PHE  90  -6.519  14.100 -10.603
  699    HZ   PHE  90           HZ       PHE  90  -8.938  13.710 -10.345
  700    H    THR  91           HN       THR  91  -6.097  11.222  -8.082
  701    HA   THR  91           HA       THR  91  -5.347  10.588  -5.390
  702    HB   THR  91           HB       THR  91  -7.748  12.053  -6.506
  703    HG1  THR  91           HG1      THR  91  -6.600  13.827  -6.182
  704   2HG2  THR  91          2HG2      THR  91  -8.655  12.169  -4.499
  705   2HG2  THR  91          2HG2      THR  91  -7.151  12.800  -3.828
  706   3HG2  THR  91          3HG2      THR  91  -7.426  11.059  -3.893
  707    H    ASP  92           HN       ASP  92  -5.563   8.205  -6.023
  708    HA   ASP  92           HA       ASP  92  -7.944   6.897  -6.449
  709   1HB   ASP  92          HB2       ASP  92  -5.750   5.793  -6.491
  710   2HB   ASP  92          HB1       ASP  92  -5.629   5.959  -4.741
  711    H    LEU  93           HN       LEU  93  -6.852   8.449  -3.548
  712    HA   LEU  93           HA       LEU  93  -8.057   7.232  -1.476
  713   1HB   LEU  93          HB2       LEU  93  -6.854   9.334  -1.268
  714   2HB   LEU  93          HB1       LEU  93  -8.156  10.185  -2.076
  715    HG   LEU  93           HG       LEU  93  -9.660   9.640  -0.191
  716   1HD1  LEU  93          1HD1      LEU  93  -9.139   8.215   1.440
  717   2HD1  LEU  93          2HD1      LEU  93  -7.539   8.924   1.662
  718   3HD1  LEU  93          3HD1      LEU  93  -7.797   7.704   0.416
  719   1HD2  LEU  93          1HD2      LEU  93  -8.107  10.960   1.547
  720   2HD2  LEU  93          2HD2      LEU  93  -8.900  11.738   0.177
  721   3HD2  LEU  93          3HD2      LEU  93  -7.205  11.263   0.062
  722    H    LEU  94           HN       LEU  94  -9.845   9.815  -3.178
  723    HA   LEU  94           HA       LEU  94 -12.337   9.220  -2.105
  724   1HB   LEU  94          HB2       LEU  94 -11.692  11.286  -3.363
  725   2HB   LEU  94          HB1       LEU  94 -11.809  10.364  -4.848
  726    HG   LEU  94           HG       LEU  94 -13.797  11.764  -4.426
  727   1HD1  LEU  94          1HD1      LEU  94 -14.853   9.020  -4.125
  728   2HD1  LEU  94          2HD1      LEU  94 -13.745   9.306  -5.469
  729   3HD1  LEU  94          3HD1      LEU  94 -15.224  10.257  -5.326
  730   1HD2  LEU  94          1HD2      LEU  94 -14.951  11.763  -2.507
  731   2HD2  LEU  94          2HD2      LEU  94 -13.507  11.020  -1.822
  732   3HD2  LEU  94          3HD2      LEU  94 -14.859  10.011  -2.337
  733    H    GLN  95           HN       GLN  95 -10.836   8.039  -5.092
  734    HA   GLN  95           HA       GLN  95 -13.031   6.598  -6.072
  735   1HB   GLN  95          HB2       GLN  95 -11.051   7.092  -7.429
  736   2HB   GLN  95          HB1       GLN  95 -10.078   6.037  -6.414
  737   1HG   GLN  95          HG2       GLN  95 -11.424   4.122  -7.114
  738   2HG   GLN  95          HG1       GLN  95 -12.394   5.179  -8.134
  739    H    LEU  96           HN       LEU  96 -10.415   5.675  -3.898
  740    HA   LEU  96           HA       LEU  96 -10.830   2.971  -3.642
  741   1HB   LEU  96          HB2       LEU  96  -9.020   4.289  -2.552
  742   2HB   LEU  96          HB1       LEU  96 -10.194   4.877  -1.389
  743    HG   LEU  96           HG       LEU  96 -10.582   2.291  -0.989
  744   1HD1  LEU  96          1HD1      LEU  96  -9.205   1.124  -2.333
  745   2HD1  LEU  96          2HD1      LEU  96  -8.040   1.441  -1.049
  746   3HD1  LEU  96          3HD1      LEU  96  -8.055   2.450  -2.494
  747   1HD2  LEU  96          1HD2      LEU  96  -8.448   2.549   0.607
  748   2HD2  LEU  96          2HD2      LEU  96  -9.993   3.344   0.915
  749   3HD2  LEU  96          3HD2      LEU  96  -8.678   4.237   0.149
  750    H    VAL  97           HN       VAL  97 -12.280   5.517  -1.625
  751    HA   VAL  97           HA       VAL  97 -13.874   4.032   0.010
  752    HB   VAL  97           HB       VAL  97 -14.682   6.651  -1.257
  753   1HG1  VAL  97          1HG1      VAL  97 -16.439   6.704   0.111
  754   2HG1  VAL  97          2HG1      VAL  97 -15.467   6.211   1.498
  755   3HG1  VAL  97          3HG1      VAL  97 -16.143   4.993   0.416
  756   2HG2  VAL  97          2HG2      VAL  97 -12.422   6.130   0.258
  757   2HG2  VAL  97          2HG2      VAL  97 -13.576   6.781   1.420
  758   3HG2  VAL  97          3HG2      VAL  97 -13.158   7.708  -0.021
  759    H    GLU  98           HN       GLU  98 -15.156   5.567  -2.959
  760    HA   GLU  98           HA       GLU  98 -17.537   4.017  -2.931
  761   1HB   GLU  98          HB2       GLU  98 -17.413   6.214  -4.000
  762   2HB   GLU  98          HB1       GLU  98 -16.276   5.586  -5.185
  763   1HG   GLU  98          HG2       GLU  98 -17.992   4.068  -6.029
  764   2HG   GLU  98          HG1       GLU  98 -19.131   4.695  -4.839
  765    H    PHE  99           HN       PHE  99 -14.686   3.832  -5.075
  766    HA   PHE  99           HA       PHE  99 -15.652   1.523  -6.405
  767   1HB   PHE  99          HB2       PHE  99 -12.883   2.721  -6.308
  768   2HB   PHE  99          HB1       PHE  99 -13.335   1.365  -7.330
  769    HD1  PHE  99           HD1      PHE  99 -13.582   1.922  -9.514
  770    HD2  PHE  99           HD2      PHE  99 -14.829   4.718  -6.558
  771    HE1  PHE  99           HE1      PHE  99 -14.313   3.466 -11.283
  772    HE2  PHE  99           HE2      PHE  99 -15.566   6.262  -8.320
  773    HZ   PHE  99           HZ       PHE  99 -15.309   5.637 -10.688
  774    H    HIS 100           HN       HIS 100 -14.635   1.748  -3.270
  775    HA   HIS 100           HA       HIS 100 -12.862  -0.338  -2.845
  776   1HB   HIS 100          HB2       HIS 100 -13.645  -0.431  -0.607
  777   2HB   HIS 100          HB1       HIS 100 -13.880   1.239  -1.099
  778    HD1  HIS 100           HD1      HIS 100 -16.552   1.262  -2.406
  779    HD2  HIS 100           HD2      HIS 100 -15.757  -1.079   0.933
  780    HE1  HIS 100           HE1      HIS 100 -18.790   0.809  -1.355
  781    HE2  HIS 100           HE2      HIS 100 -18.292  -0.682   0.612
  782    H    GLN 101           HN       GLN 101 -16.242  -0.351  -3.614
  783    HA   GLN 101           HA       GLN 101 -16.732  -3.106  -3.104
  784   1HB   GLN 101          HB2       GLN 101 -18.821  -2.684  -4.408
  785   2HB   GLN 101          HB1       GLN 101 -18.568  -1.558  -3.081
  786   1HG   GLN 101          HG2       GLN 101 -17.530  -0.019  -4.852
  787   2HG   GLN 101          HG1       GLN 101 -18.295  -1.084  -6.025
  788    H    LEU 102           HN       LEU 102 -15.575  -1.285  -5.874
  789    HA   LEU 102           HA       LEU 102 -14.897  -3.789  -7.177
  790   1HB   LEU 102          HB2       LEU 102 -17.243  -2.978  -7.899
  791   2HB   LEU 102          HB1       LEU 102 -16.385  -1.728  -8.779
  792    HG   LEU 102           HG       LEU 102 -16.978  -3.579 -10.246
  793   1HD1  LEU 102          1HD1      LEU 102 -14.823  -3.992 -11.239
  794   2HD1  LEU 102          2HD1      LEU 102 -14.008  -3.537  -9.743
  795   3HD1  LEU 102          3HD1      LEU 102 -14.898  -2.326 -10.666
  796   1HD2  LEU 102          1HD2      LEU 102 -15.298  -5.258  -8.391
  797   2HD2  LEU 102          2HD2      LEU 102 -15.956  -5.790  -9.938
  798   3HD2  LEU 102          3HD2      LEU 102 -17.043  -5.369  -8.615
  799    H    ASN 103           HN       ASN 103 -12.900  -2.568  -6.271
  800    HA   ASN 103           HA       ASN 103 -11.835  -0.861  -8.423
  801   1HB   ASN 103          HB2       ASN 103 -10.305   0.128  -6.678
  802   2HB   ASN 103          HB1       ASN 103 -11.994   0.565  -6.552
  803   1HD2  ASN 103          1HD2      ASN 103 -11.346  -2.624  -5.506
  804   2HD2  ASN 103          2HD2      ASN 103 -11.360  -2.294  -3.819
  805    H    ARG 104           HN       ARG 104  -9.676  -1.106  -9.027
  806    HA   ARG 104           HA       ARG 104  -8.731  -3.780  -8.964
  807   1HB   ARG 104          HB2       ARG 104  -7.501  -1.220  -9.975
  808   2HB   ARG 104          HB1       ARG 104  -6.711  -2.782 -10.126
  809   1HG   ARG 104          HG2       ARG 104  -7.834  -2.194 -12.183
  810   2HG   ARG 104          HG1       ARG 104  -8.596  -3.606 -11.449
  811   1HD   ARG 104          HD2       ARG 104 -10.395  -2.233 -10.596
  812   2HD   ARG 104          HD1       ARG 104  -9.607  -0.774 -11.196
  813    HE   ARG 104           HE       ARG 104 -10.002  -2.519 -13.347
  814   1HH1  ARG 104          HH11      ARG 104 -11.874  -0.584 -11.127
  815   2HH1  ARG 104          HH12      ARG 104 -13.176  -0.341 -12.241
  816   1HH2  ARG 104          HH21      ARG 104 -11.714  -2.200 -14.814
  817   2HH2  ARG 104          HH22      ARG 104 -13.087  -1.259 -14.335
  818    H    GLY 105           HN       GLY 105  -8.773  -3.709  -6.471
  819   1HA   GLY 105          HA2       GLY 105  -6.965  -2.412  -4.871
  820   2HA   GLY 105          HA1       GLY 105  -7.490  -4.065  -4.590
  821    H    ILE 106           HN       ILE 106  -6.246  -5.791  -5.517
  822    HA   ILE 106           HA       ILE 106  -3.411  -5.076  -5.834
  823    HB   ILE 106           HB       ILE 106  -4.041  -6.590  -3.947
  824   1HG1  ILE 106          2HG1      ILE 106  -1.798  -6.662  -5.311
  825   2HG1  ILE 106          1HG1      ILE 106  -2.138  -7.888  -4.102
  826   2HG2  ILE 106          2HG2      ILE 106  -5.883  -7.719  -5.091
  827   2HG2  ILE 106          2HG2      ILE 106  -4.734  -8.853  -4.379
  828   3HG2  ILE 106          3HG2      ILE 106  -4.718  -8.553  -6.118
  829   1HD1  ILE 106          1HD1      ILE 106  -1.344  -8.355  -6.667
  830   2HD1  ILE 106          2HD1      ILE 106  -3.088  -8.597  -6.765
  831   3HD1  ILE 106          3HD1      ILE 106  -2.132  -9.524  -5.611
  832    H    LEU 107           HN       LEU 107  -2.137  -6.465  -7.370
  833    HA   LEU 107           HA       LEU 107  -2.814  -6.341  -9.946
  834   1HB   LEU 107          HB2       LEU 107  -1.371  -8.590  -8.569
  835   2HB   LEU 107          HB1       LEU 107  -1.545  -8.541 -10.310
  836    HG   LEU 107           HG       LEU 107  -0.393  -6.306 -10.281
  837   1HD1  LEU 107          1HD1      LEU 107  -0.152  -6.998  -7.386
  838   2HD1  LEU 107          2HD1      LEU 107  -0.613  -5.474  -8.140
  839   3HD1  LEU 107          3HD1      LEU 107   1.065  -6.007  -8.188
  840   1HD2  LEU 107          1HD2      LEU 107   0.754  -8.406 -10.852
  841   2HD2  LEU 107          2HD2      LEU 107   1.185  -8.613  -9.155
  842   3HD2  LEU 107          3HD2      LEU 107   1.825  -7.246 -10.067
  843    HA   PRO 108           HA       PRO 108  -6.188  -8.518 -11.699
  844   1HB   PRO 108          HB2       PRO 108  -4.137 -10.522 -12.576
  845   2HB   PRO 108          HB1       PRO 108  -5.510  -9.862 -13.473
  846   1HG   PRO 108          HG2       PRO 108  -2.992  -8.904 -13.753
  847   2HG   PRO 108          HG1       PRO 108  -4.433  -7.893 -13.943
  848   1HD   PRO 108          HD2       PRO 108  -2.397  -7.799 -11.871
  849   2HD   PRO 108          HD1       PRO 108  -3.721  -6.662 -12.181
  850    H    CYS 109           HN       CYS 109  -6.800  -9.045  -9.414
  851    HA   CYS 109           HA       CYS 109  -7.265 -11.894  -9.210
  852   1HB   CYS 109          HB2       CYS 109  -6.157 -10.514  -6.757
  853   2HB   CYS 109          HB1       CYS 109  -6.402 -12.231  -7.033
  854    HG   CYS 109           HG       CYS 109  -4.228 -12.697  -8.500
  855    H    LEU 110           HN       LEU 110  -8.184 -11.475  -6.352
  856    HA   LEU 110           HA       LEU 110 -10.831 -10.615  -6.933
  857   1HB   LEU 110          HB2       LEU 110  -9.377 -11.272  -4.387
  858   2HB   LEU 110          HB1       LEU 110 -11.004 -10.623  -4.353
  859    HG   LEU 110           HG       LEU 110 -10.951 -13.063  -4.141
  860   1HD1  LEU 110          1HD1      LEU 110 -12.696 -11.587  -5.542
  861   2HD1  LEU 110          2HD1      LEU 110 -12.867 -13.327  -5.310
  862   3HD1  LEU 110          3HD1      LEU 110 -12.170 -12.701  -6.804
  863   1HD2  LEU 110          1HD2      LEU 110 -10.372 -14.433  -6.106
  864   2HD2  LEU 110          2HD2      LEU 110  -8.983 -13.564  -5.456
  865   3HD2  LEU 110          3HD2      LEU 110  -9.780 -12.984  -6.917
  866    H    LEU 111           HN       LEU 111 -10.020  -8.585  -7.905
  867    HA   LEU 111           HA       LEU 111  -8.821  -6.473  -6.757
  868   1HB   LEU 111          HB2       LEU 111 -10.037  -5.011  -8.241
  869   2HB   LEU 111          HB1       LEU 111  -9.595  -6.490  -9.060
  870    HG   LEU 111           HG       LEU 111 -11.782  -5.864  -9.773
  871   1HD1  LEU 111          1HD1      LEU 111 -11.344  -8.275  -9.338
  872   2HD1  LEU 111          2HD1      LEU 111 -13.045  -7.816  -9.288
  873   3HD1  LEU 111          3HD1      LEU 111 -12.161  -8.089  -7.787
  874   1HD2  LEU 111          1HD2      LEU 111 -12.086  -4.728  -7.307
  875   2HD2  LEU 111          2HD2      LEU 111 -13.170  -6.114  -7.224
  876   3HD2  LEU 111          3HD2      LEU 111 -13.357  -4.927  -8.511
  877    H    ARG 112           HN       ARG 112 -12.051  -7.564  -5.943
  878    HA   ARG 112           HA       ARG 112 -12.904  -5.213  -4.630
  879   1HB   ARG 112          HB2       ARG 112 -13.722  -8.051  -3.987
  880   2HB   ARG 112          HB1       ARG 112 -14.616  -6.586  -3.612
  881   1HG   ARG 112          HG2       ARG 112 -14.930  -6.167  -6.001
  882   2HG   ARG 112          HG1       ARG 112 -14.050  -7.653  -6.369
  883   1HD   ARG 112          HD2       ARG 112 -16.459  -8.013  -6.476
  884   2HD   ARG 112          HD1       ARG 112 -15.736  -8.952  -5.172
  885    HE   ARG 112           HE       ARG 112 -16.615  -6.512  -4.123
  886   1HH1  ARG 112          HH11      ARG 112 -17.936  -9.441  -5.487
  887   2HH1  ARG 112          HH12      ARG 112 -19.415  -9.339  -4.592
  888   1HH2  ARG 112          HH21      ARG 112 -18.561  -6.377  -2.946
  889   2HH2  ARG 112          HH22      ARG 112 -19.770  -7.599  -3.150
  890    H    HIS 113           HN       HIS 113 -12.408  -4.374  -2.683
  891    HA   HIS 113           HA       HIS 113 -11.180  -6.108  -0.664
  892   1HB   HIS 113          HB2       HIS 113  -9.424  -4.462  -0.186
  893   2HB   HIS 113          HB1       HIS 113  -9.306  -5.059  -1.840
  894    HD1  HIS 113           HD1      HIS 113 -11.173  -2.123  -0.259
  895    HD2  HIS 113           HD2      HIS 113  -8.629  -3.007  -3.423
  896    HE1  HIS 113           HE1      HIS 113 -10.848   0.044  -1.487
  897    HE2  HIS 113           HE2      HIS 113  -9.358  -0.529  -3.436
  898    H    CYS 114           HN       CYS 114 -10.879  -4.810   1.453
  899    HA   CYS 114           HA       CYS 114 -12.996  -2.826   1.813
  900   1HB   CYS 114          HB2       CYS 114 -14.058  -4.943   2.365
  901   2HB   CYS 114          HB1       CYS 114 -12.740  -5.353   3.461
  902    HG   CYS 114           HG       CYS 114 -14.034  -4.496   5.499
  903    H    CYS 115           HN       CYS 115 -11.229  -4.592   4.321
  904    HA   CYS 115           HA       CYS 115  -9.512  -2.262   4.778
  905   1HB   CYS 115          HB2       CYS 115 -11.199  -3.559   6.934
  906   2HB   CYS 115          HB1       CYS 115 -10.033  -2.263   7.179
  907    HG   CYS 115           HG       CYS 115 -11.454  -0.335   5.829
  908    H    THR 116           HN       THR 116  -8.372  -3.130   7.185
  909    HA   THR 116           HA       THR 116  -6.874  -5.465   6.236
  910    HB   THR 116           HB       THR 116  -6.203  -3.471   8.411
  911    HG1  THR 116           HG1      THR 116  -5.894  -2.378   6.594
  912   2HG2  THR 116          2HG2      THR 116  -4.495  -5.612   7.168
  913   2HG2  THR 116          2HG2      THR 116  -5.086  -5.576   8.829
  914   3HG2  THR 116          3HG2      THR 116  -3.934  -4.360   8.276
  915    H    ARG 117           HN       ARG 117  -6.200  -7.096   7.820
  916    HA   ARG 117           HA       ARG 117  -8.240  -7.465   9.919
  917   1HB   ARG 117          HB2       ARG 117  -8.458  -9.101   8.110
  918   2HB   ARG 117          HB1       ARG 117  -6.776  -9.566   8.314
  919   1HG   ARG 117          HG2       ARG 117  -8.270 -11.185   9.339
  920   2HG   ARG 117          HG1       ARG 117  -7.261 -10.396  10.552
  921   1HD   ARG 117          HD2       ARG 117  -9.115  -8.896  11.111
  922   2HD   ARG 117          HD1       ARG 117 -10.121  -9.691   9.901
  923    HE   ARG 117           HE       ARG 117  -9.174 -11.635  11.674
  924   1HH1  ARG 117          HH11      ARG 117 -11.322  -8.884  11.664
  925   2HH1  ARG 117          HH12      ARG 117 -12.333  -9.511  12.922
  926   1HH2  ARG 117          HH21      ARG 117 -10.504 -12.462  13.328
  927   2HH2  ARG 117          HH22      ARG 117 -11.869 -11.543  13.866
  928    H    VAL 118           HN       VAL 118  -6.688  -6.163  11.213
  929    HA   VAL 118           HA       VAL 118  -4.898  -7.959  12.632
  930    HB   VAL 118           HB       VAL 118  -3.130  -6.092  12.683
  931   1HG1  VAL 118          1HG1      VAL 118  -1.931  -7.217  11.088
  932   2HG1  VAL 118          2HG1      VAL 118  -3.290  -7.297   9.966
  933   3HG1  VAL 118          3HG1      VAL 118  -3.235  -8.374  11.361
  934   2HG2  VAL 118          2HG2      VAL 118  -3.368  -5.118  10.115
  935   2HG2  VAL 118          2HG2      VAL 118  -3.693  -4.221  11.598
  936   3HG2  VAL 118          3HG2      VAL 118  -5.014  -5.013  10.741
  937    H    ALA 119           HN       ALA 119  -5.448  -4.426  12.589
  938    HA   ALA 119           HA       ALA 119  -5.612  -4.374  15.460
  939   1HB   ALA 119          HB1       ALA 119  -6.411  -1.986  13.916
  940   2HB   ALA 119          HB2       ALA 119  -4.762  -2.562  13.675
  941   3HB   ALA 119          HB3       ALA 119  -5.319  -2.137  15.293
  942    H    LEU 120           HN       LEU 120  -7.525  -2.486  15.985
  943    HA   LEU 120           HA       LEU 120  -9.857  -4.004  16.225
  944   1HB   LEU 120          HB2       LEU 120  -9.556  -1.003  16.338
  945   2HB   LEU 120          HB1       LEU 120 -10.936  -1.907  16.931
  946    HG   LEU 120           HG       LEU 120  -8.124  -2.058  18.019
  947   1HD1  LEU 120          1HD1      LEU 120  -9.763  -0.028  18.435
  948   2HD1  LEU 120          2HD1      LEU 120  -8.764  -0.693  19.727
  949   3HD1  LEU 120          3HD1      LEU 120 -10.464  -1.148  19.604
  950   1HD2  LEU 120          1HD2      LEU 120  -8.832  -4.135  18.571
  951   2HD2  LEU 120          2HD2      LEU 120 -10.538  -3.712  18.429
  952   3HD2  LEU 120          3HD2      LEU 120  -9.634  -3.258  19.873
  953    HA   PRO1135           HA       PRO1135  17.723  -4.913 -11.131
  954   1HB   PRO1135          HB2       PRO1135  14.787  -4.949 -11.648
  955   2HB   PRO1135          HB1       PRO1135  15.904  -3.580 -11.596
  956   1HG   PRO1135          HG2       PRO1135  15.005  -4.507 -13.923
  957   2HG   PRO1135          HG1       PRO1135  16.684  -3.964 -13.747
  958   1HD   PRO1135          HD2       PRO1135  15.593  -6.738 -13.890
  959   2HD   PRO1135          HD1       PRO1135  17.120  -6.089 -14.523
  960    H    GLN1136           HN       GLN1136  16.517  -4.470  -9.071
  961    HA   GLN1136           HA       GLN1136  15.741  -7.018  -7.821
  962   1HB   GLN1136          HB2       GLN1136  16.819  -4.503  -6.531
  963   2HB   GLN1136          HB1       GLN1136  16.413  -5.991  -5.689
  964   1HG   GLN1136          HG2       GLN1136  18.146  -7.172  -6.946
  965   2HG   GLN1136          HG1       GLN1136  18.556  -5.676  -7.778
  966    HA   PRO1137           HA       PRO1137  11.895  -4.352  -8.008
  967   1HB   PRO1137          HB2       PRO1137  10.245  -6.429  -8.667
  968   2HB   PRO1137          HB1       PRO1137  11.067  -5.415  -9.858
  969   1HG   PRO1137          HG2       PRO1137  11.827  -8.119  -8.824
  970   2HG   PRO1137          HG1       PRO1137  11.874  -7.501 -10.486
  971   1HD   PRO1137          HD2       PRO1137  14.090  -7.670  -8.965
  972   2HD   PRO1137          HD1       PRO1137  13.854  -6.357 -10.137
  973    H    GLU1138           HN       GLU1138  11.102  -3.959  -6.047
  974    HA   GLU1138           HA       GLU1138  10.341  -6.242  -4.362
  975   1HB   GLU1138          HB2       GLU1138  12.474  -5.272  -3.545
  976   2HB   GLU1138          HB1       GLU1138  11.673  -3.723  -3.357
  977   1HG   GLU1138          HG2       GLU1138  11.846  -4.838  -1.233
  978   2HG   GLU1138          HG1       GLU1138  10.157  -4.717  -1.718
  979   2HN   PTR1139          HN        PTR1139   9.811  -2.866  -5.240
  980   2HN   PTR1139          HN        PTR1139   9.811  -2.866  -5.240
  981    HA   PTR1139           HA       PTR1139   7.506  -2.729  -3.541
  982    HA   PTR1139           HA       PTR1139   7.506  -2.729  -3.541
  983   1HB   PTR1139          HB1       PTR1139   7.419  -0.387  -4.865
  984   1HB   PTR1139          HB1       PTR1139   7.419  -0.387  -4.865
  985   2HB   PTR1139          HB2       PTR1139   9.125  -0.787  -5.022
  986   2HB   PTR1139          HB2       PTR1139   9.125  -0.787  -5.022
  987    HD1  PTR1139           HD1      PTR1139   6.418  -0.347  -2.540
  988    HD1  PTR1139           HD1      PTR1139   6.418  -0.347  -2.540
  989    HD2  PTR1139           HD2      PTR1139  10.617  -0.379  -3.212
  990    HD2  PTR1139           HD2      PTR1139  10.617  -0.379  -3.212
  991    HE1  PTR1139           HE1      PTR1139   6.793   0.521  -0.276
  992    HE1  PTR1139           HE1      PTR1139   6.793   0.521  -0.276
  993    HE2  PTR1139           HE2      PTR1139  10.992   0.510  -0.915
  994    HE2  PTR1139           HE2      PTR1139  10.992   0.510  -0.915
  995    H    VAL1140           HN       VAL1140   6.960  -0.949  -6.395
  996    HA   VAL1140           HA       VAL1140   5.424  -3.092  -7.625
  997    HB   VAL1140           HB       VAL1140   3.425  -1.414  -7.847
  998   1HG1  VAL1140          1HG1      VAL1140   2.712  -3.324  -6.883
  999   2HG1  VAL1140          2HG1      VAL1140   2.660  -2.299  -5.451
 1000   3HG1  VAL1140          3HG1      VAL1140   4.041  -3.361  -5.721
 1001   2HG2  VAL1140          2HG2      VAL1140   3.234   0.293  -6.414
 1002   2HG2  VAL1140          2HG2      VAL1140   4.995   0.175  -6.363
 1003   3HG2  VAL1140          3HG2      VAL1140   4.032  -0.581  -5.104
 1004    H    ASN1141           HN       ASN1141   5.112   0.478  -8.079
 1005    HA   ASN1141           HA       ASN1141   5.080   0.446 -10.807
 1006   1HB   ASN1141          HB2       ASN1141   7.017   2.306  -9.383
 1007   2HB   ASN1141          HB1       ASN1141   6.194   2.579 -10.901
 1008   1HD2  ASN1141          1HD2      ASN1141   4.897   1.623  -7.682
 1009   2HD2  ASN1141          2HD2      ASN1141   3.940   3.037  -7.458
 1010    H    GLN1142           HN       GLN1142   7.568   0.075  -8.442
 1011    HA   GLN1142           HA       GLN1142   8.696  -2.161  -9.307
 1012   1HB   GLN1142          HB2       GLN1142  10.794  -1.565 -10.361
 1013   2HB   GLN1142          HB1       GLN1142   9.453  -1.001 -11.323
 1014   1HG   GLN1142          HG2       GLN1142  11.050   0.737  -9.464
 1015   2HG   GLN1142          HG1       GLN1142  11.327   0.609 -11.199
 1016    HA   PRO1143           HA       PRO1143  10.911  -1.364  -5.581
 1017   1HB   PRO1143          HB2       PRO1143  13.636  -1.344  -5.826
 1018   2HB   PRO1143          HB1       PRO1143  12.667  -2.817  -5.890
 1019   1HG   PRO1143          HG2       PRO1143  13.975  -1.319  -8.077
 1020   2HG   PRO1143          HG1       PRO1143  13.599  -3.044  -7.961
 1021   1HD   PRO1143          HD2       PRO1143  12.180  -1.125  -9.420
 1022   2HD   PRO1143          HD1       PRO1143  11.618  -2.759  -9.028
 1023    H    ASP1144           HN       ASP1144  10.403   0.879  -7.412
 1024    HA   ASP1144           HA       ASP1144  10.186   3.090  -7.046
 1025   1HB   ASP1144          HB2       ASP1144  12.657   3.030  -5.288
 1026   2HB   ASP1144          HB1       ASP1144  11.453   4.307  -5.396
  Start of MODEL    6
    1   1H    GLY   1          HT1       GLY   1  24.959   5.088  -4.228
    2   2H    GLY   1          HT2       GLY   1  23.890   3.807  -4.506
    3   3H    GLY   1          HT3       GLY   1  25.557   3.524  -4.476
    4   1HA   GLY   1          HA1       GLY   1  24.605   2.756  -2.425
    5   2HA   GLY   1          HA2       GLY   1  25.637   4.146  -2.130
    6    H    SER   2           HN       SER   2  22.522   2.831  -1.804
    7    HA   SER   2           HA       SER   2  21.670   5.179  -0.340
    8   1HB   SER   2          HB2       SER   2  20.814   5.777  -2.491
    9   2HB   SER   2          HB1       SER   2  20.142   4.171  -2.746
   10    HG   SER   2           HG       SER   2  18.565   4.588  -1.297
   11    HA   PRO   3           HA       PRO   3  18.500   1.614   0.619
   12   1HB   PRO   3          HB2       PRO   3  19.151  -0.815  -0.526
   13   2HB   PRO   3          HB1       PRO   3  17.927   0.295  -1.151
   14   1HG   PRO   3          HG2       PRO   3  20.769  -0.072  -2.008
   15   2HG   PRO   3          HG1       PRO   3  19.321   0.174  -3.003
   16   1HD   PRO   3          HD2       PRO   3  21.021   2.178  -2.534
   17   2HD   PRO   3          HD1       PRO   3  19.270   2.458  -2.587
   18    H    ALA   4           HN       ALA   4  19.805   2.011   2.505
   19    HA   ALA   4           HA       ALA   4  21.321  -0.360   3.295
   20   1HB   ALA   4          HB1       ALA   4  23.221   0.793   2.859
   21   2HB   ALA   4          HB2       ALA   4  22.893   1.473   4.453
   22   3HB   ALA   4          HB3       ALA   4  22.432   2.363   3.002
   23    H    SER   5           HN       SER   5  20.303  -1.077   5.041
   24    HA   SER   5           HA       SER   5  18.994   0.823   6.839
   25   1HB   SER   5          HB2       SER   5  17.900  -1.171   7.804
   26   2HB   SER   5          HB1       SER   5  17.647  -1.068   6.061
   27    HG   SER   5           HG       SER   5  18.289  -3.103   6.282
   28    H    GLY   6           HN       GLY   6  19.126   0.327   9.214
   29   1HA   GLY   6          HA2       GLY   6  21.255  -1.149  10.316
   30   2HA   GLY   6          HA1       GLY   6  21.777   0.514  10.100
   31    H    THR   7           HN       THR   7  19.812   2.075  10.822
   32    HA   THR   7           HA       THR   7  19.359   1.367  13.627
   33    HB   THR   7           HB       THR   7  18.892   3.774  13.938
   34    HG1  THR   7           HG1      THR   7  18.129   4.479  12.033
   35   1HG2  THR   7          1HG2      THR   7  21.045   4.405  14.045
   36   2HG2  THR   7          2HG2      THR   7  21.391   3.904  12.391
   37   3HG2  THR   7          3HG2      THR   7  21.331   2.704  13.682
   38    H    SER   8           HN       SER   8  17.312   1.734  14.626
   39    HA   SER   8           HA       SER   8  15.060   1.537  12.734
   40   1HB   SER   8          HB2       SER   8  13.878   0.269  14.494
   41   2HB   SER   8          HB1       SER   8  15.385  -0.518  14.025
   42    HG   SER   8           HG       SER   8  15.431  -0.517  16.202
   43    H    LEU   9           HN       LEU   9  13.186   2.702  13.131
   44    HA   LEU   9           HA       LEU   9  13.416   4.794  15.195
   45   1HB   LEU   9          HB2       LEU   9  12.084   4.974  12.491
   46   2HB   LEU   9          HB1       LEU   9  12.100   6.243  13.701
   47    HG   LEU   9           HG       LEU   9  14.512   5.151  12.250
   48   1HD1  LEU   9          1HD1      LEU   9  13.379   7.925  12.089
   49   2HD1  LEU   9          2HD1      LEU   9  12.866   6.639  10.997
   50   3HD1  LEU   9          3HD1      LEU   9  14.554   7.148  11.027
   51   1HD2  LEU   9          1HD2      LEU   9  15.421   7.367  13.390
   52   2HD2  LEU   9          2HD2      LEU   9  15.480   5.803  14.203
   53   3HD2  LEU   9          3HD2      LEU   9  14.197   6.950  14.588
   54    H    SER  10           HN       SER  10  11.163   5.790  15.654
   55    HA   SER  10           HA       SER  10   9.062   3.752  15.638
   56   1HB   SER  10          HB2       SER  10  10.216   3.466  17.779
   57   2HB   SER  10          HB1       SER  10  10.016   5.182  18.131
   58    HG   SER  10           HG       SER  10   8.111   3.127  18.113
   59    H    ALA  11           HN       ALA  11   7.273   4.635  14.868
   60    HA   ALA  11           HA       ALA  11   6.667   7.435  15.536
   61   1HB   ALA  11          HB1       ALA  11   7.567   7.194  13.207
   62   2HB   ALA  11          HB2       ALA  11   5.959   7.911  13.315
   63   3HB   ALA  11          HB3       ALA  11   6.141   6.225  12.829
   64    H    ALA  12           HN       ALA  12   4.651   7.781  16.251
   65    HA   ALA  12           HA       ALA  12   2.535   5.875  15.609
   66   1HB   ALA  12          HB1       ALA  12   1.952   6.087  18.187
   67   2HB   ALA  12          HB2       ALA  12   3.701   6.287  18.307
   68   3HB   ALA  12          HB3       ALA  12   3.028   4.832  17.572
   69    H    ILE  13           HN       ILE  13   2.581   8.275  14.488
   70    HA   ILE  13           HA       ILE  13   1.225  10.260  16.076
   71    HB   ILE  13           HB       ILE  13   2.794  10.913  14.292
   72   1HG1  ILE  13          2HG1      ILE  13  -0.057  11.815  13.810
   73   2HG1  ILE  13          1HG1      ILE  13   1.047  12.483  15.007
   74   1HG2  ILE  13          1HG2      ILE  13   2.731   9.744  12.397
   75   2HG2  ILE  13          2HG2      ILE  13   1.348  10.742  11.947
   76   3HG2  ILE  13          3HG2      ILE  13   1.092   9.173  12.710
   77   1HD1  ILE  13          1HD1      ILE  13   0.647  13.513  12.548
   78   2HD1  ILE  13          2HD1      ILE  13   2.054  12.492  12.254
   79   3HD1  ILE  13          3HD1      ILE  13   2.116  13.741  13.497
   80    H    HIS  14           HN       HIS  14  -0.399   8.301  16.455
   81    HA   HIS  14           HA       HIS  14  -2.625   8.686  14.563
   82   1HB   HIS  14          HB2       HIS  14  -1.997   6.194  16.159
   83   2HB   HIS  14          HB1       HIS  14  -3.356   6.400  15.059
   84    HD1  HIS  14           HD1      HIS  14   0.417   6.819  14.767
   85    HD2  HIS  14           HD2      HIS  14  -2.811   5.235  12.689
   86    HE1  HIS  14           HE1      HIS  14   1.389   5.845  12.670
   87    HE2  HIS  14           HE2      HIS  14  -0.594   4.973  11.379
   88    H    ARG  15           HN       ARG  15  -4.429   9.506  15.399
   89    HA   ARG  15           HA       ARG  15  -4.870   9.271  18.287
   90   1HB   ARG  15          HB2       ARG  15  -5.795  11.565  18.290
   91   2HB   ARG  15          HB1       ARG  15  -4.088  11.521  17.854
   92   1HG   ARG  15          HG2       ARG  15  -4.607  11.813  15.529
   93   2HG   ARG  15          HG1       ARG  15  -6.331  11.629  15.839
   94   1HD   ARG  15          HD2       ARG  15  -4.547  13.925  16.680
   95   2HD   ARG  15          HD1       ARG  15  -5.869  13.955  15.515
   96    HE   ARG  15           HE       ARG  15  -6.928  13.113  17.944
   97   1HH1  ARG  15          HH11      ARG  15  -5.440  15.965  16.592
   98   2HH1  ARG  15          HH12      ARG  15  -6.298  17.056  17.626
   99   1HH2  ARG  15          HH21      ARG  15  -8.058  14.546  19.306
  100   2HH2  ARG  15          HH22      ARG  15  -7.785  16.252  19.168
  101    H    THR  16           HN       THR  16  -5.931   8.254  15.541
  102    HA   THR  16           HA       THR  16  -8.707   8.099  16.435
  103    HB   THR  16           HB       THR  16  -9.532   8.511  14.139
  104    HG1  THR  16           HG1      THR  16  -8.146   8.474  12.589
  105   1HG2  THR  16          1HG2      THR  16  -8.712  10.973  13.957
  106   2HG2  THR  16          2HG2      THR  16  -8.012  10.647  15.542
  107   3HG2  THR  16          3HG2      THR  16  -9.748  10.473  15.293
  108    H    GLN  17           HN       GLN  17  -9.674   6.687  14.197
  109    HA   GLN  17           HA       GLN  17  -8.281   4.154  14.591
  110   1HB   GLN  17          HB2       GLN  17 -10.304   3.155  13.531
  111   2HB   GLN  17          HB1       GLN  17 -10.648   4.061  14.996
  112   1HG   GLN  17          HG2       GLN  17 -12.340   4.519  13.365
  113   2HG   GLN  17          HG1       GLN  17 -11.372   5.968  13.612
  114    H    LEU  18           HN       LEU  18  -7.475   6.460  12.739
  115    HA   LEU  18           HA       LEU  18  -7.822   5.795  10.073
  116   1HB   LEU  18          HB2       LEU  18  -5.923   7.139   9.583
  117   2HB   LEU  18          HB1       LEU  18  -6.750   7.873  10.943
  118    HG   LEU  18           HG       LEU  18  -4.238   6.204  11.108
  119   1HD1  LEU  18          1HD1      LEU  18  -4.765   9.106  10.887
  120   2HD1  LEU  18          2HD1      LEU  18  -3.389   8.154  10.331
  121   3HD1  LEU  18          3HD1      LEU  18  -3.522   8.600  12.032
  122   1HD2  LEU  18          1HD2      LEU  18  -4.217   7.116  13.464
  123   2HD2  LEU  18          2HD2      LEU  18  -5.423   5.875  13.124
  124   3HD2  LEU  18          3HD2      LEU  18  -5.901   7.571  13.207
  125    H    TRP  19           HN       TRP  19  -5.842   5.141   8.643
  126    HA   TRP  19           HA       TRP  19  -4.427   2.852   9.785
  127   1HB   TRP  19          HB2       TRP  19  -5.052   1.766   7.410
  128   2HB   TRP  19          HB1       TRP  19  -6.017   1.520   8.859
  129    HD1  TRP  19           HD1      TRP  19  -8.455   1.531   8.161
  130    HE1  TRP  19           HE1      TRP  19  -9.954   2.979   6.656
  131    HE3  TRP  19           HE3      TRP  19  -4.912   4.714   6.270
  132    HZ2  TRP  19           HZ2      TRP  19  -9.681   5.166   4.906
  133    HZ3  TRP  19           HZ3      TRP  19  -5.621   6.451   4.688
  134    HH2  TRP  19           HH2      TRP  19  -7.957   6.672   4.018
  135    H    PHE  20           HN       PHE  20  -3.119   5.107   9.392
  136    HA   PHE  20           HA       PHE  20  -1.611   4.641   6.908
  137   1HB   PHE  20          HB2       PHE  20  -2.931   6.684   6.679
  138   2HB   PHE  20          HB1       PHE  20  -2.268   7.304   8.186
  139    HD1  PHE  20           HD1      PHE  20  -0.700   8.942   7.949
  140    HD2  PHE  20           HD2      PHE  20  -0.936   5.897   4.988
  141    HE1  PHE  20           HE1      PHE  20   1.124  10.021   6.699
  142    HE2  PHE  20           HE2      PHE  20   0.890   6.965   3.736
  143    HZ   PHE  20           HZ       PHE  20   1.923   9.031   4.590
  144    H    HIS  21           HN       HIS  21   0.392   3.998   7.322
  145    HA   HIS  21           HA       HIS  21   1.881   5.259   9.505
  146   1HB   HIS  21          HB2       HIS  21   0.943   3.138  10.380
  147   2HB   HIS  21          HB1       HIS  21   1.765   2.260   9.092
  148    HD1  HIS  21           HD1      HIS  21   3.026   4.910  11.528
  149    HD2  HIS  21           HD2      HIS  21   3.866   1.037  10.287
  150    HE1  HIS  21           HE1      HIS  21   5.094   4.234  12.787
  151    HE2  HIS  21           HE2      HIS  21   5.535   1.856  12.083
  152    H    GLY  22           HN       GLY  22   4.261   4.957   9.290
  153   1HA   GLY  22          HA2       GLY  22   4.989   4.836   6.453
  154   2HA   GLY  22          HA1       GLY  22   5.912   5.615   7.722
  155    H    ARG  23           HN       ARG  23   7.462   4.548   8.721
  156    HA   ARG  23           HA       ARG  23   8.908   2.584   7.683
  157   1HB   ARG  23          HB2       ARG  23   9.589   3.833   9.659
  158   2HB   ARG  23          HB1       ARG  23   8.418   2.969  10.639
  159   1HG   ARG  23          HG2       ARG  23  10.665   2.116  10.991
  160   2HG   ARG  23          HG1       ARG  23   9.625   0.887  10.272
  161   1HD   ARG  23          HD2       ARG  23  10.573   1.376   8.068
  162   2HD   ARG  23          HD1       ARG  23  11.607   2.609   8.787
  163    HE   ARG  23           HE       ARG  23  13.050   0.951   9.357
  164   1HH1  ARG  23          HH11      ARG  23   9.887  -0.476   8.971
  165   2HH1  ARG  23          HH12      ARG  23  10.434  -2.082   9.314
  166   1HH2  ARG  23          HH21      ARG  23  13.770  -1.162   9.797
  167   2HH2  ARG  23          HH22      ARG  23  12.636  -2.473   9.779
  168    H    ILE  24           HN       ILE  24   7.909   0.881   6.741
  169    HA   ILE  24           HA       ILE  24   7.112  -1.262   8.534
  170    HB   ILE  24           HB       ILE  24   5.315  -0.076   6.448
  171   1HG1  ILE  24          2HG1      ILE  24   4.934  -0.995   9.294
  172   2HG1  ILE  24          1HG1      ILE  24   5.062   0.670   8.743
  173   1HG2  ILE  24          1HG2      ILE  24   5.322  -2.919   7.421
  174   2HG2  ILE  24          2HG2      ILE  24   5.272  -2.327   5.761
  175   3HG2  ILE  24          3HG2      ILE  24   3.865  -2.138   6.807
  176   1HD1  ILE  24          1HD1      ILE  24   2.741  -0.805   9.104
  177   2HD1  ILE  24          2HD1      ILE  24   2.952  -0.710   7.357
  178   3HD1  ILE  24          3HD1      ILE  24   2.892   0.767   8.319
  179    H    SER  25           HN       SER  25   9.002  -2.288   7.960
  180    HA   SER  25           HA       SER  25  10.188  -2.630   5.530
  181   1HB   SER  25          HB2       SER  25   9.902  -4.710   7.711
  182   2HB   SER  25          HB1       SER  25  11.081  -4.775   6.403
  183    HG   SER  25           HG       SER  25  11.912  -3.871   8.368
  184    H    ARG  26           HN       ARG  26   8.858  -2.877   3.741
  185    HA   ARG  26           HA       ARG  26   6.654  -4.504   3.488
  186   1HB   ARG  26          HB2       ARG  26   7.454  -4.672   0.965
  187   2HB   ARG  26          HB1       ARG  26   6.806  -3.181   1.627
  188   1HG   ARG  26          HG2       ARG  26   8.607  -2.334   0.629
  189   2HG   ARG  26          HG1       ARG  26   9.382  -2.767   2.140
  190   1HD   ARG  26          HD2       ARG  26  10.389  -4.670   1.156
  191   2HD   ARG  26          HD1       ARG  26   9.353  -4.562  -0.271
  192    HE   ARG  26           HE       ARG  26  10.876  -3.106  -1.146
  193   1HH1  ARG  26          HH11      ARG  26  11.204  -3.058   2.333
  194   2HH1  ARG  26          HH12      ARG  26  12.341  -1.754   2.334
  195   1HH2  ARG  26          HH21      ARG  26  12.354  -1.366  -1.133
  196   2HH2  ARG  26          HH22      ARG  26  12.996  -0.799   0.373
  197    H    GLU  27           HN       GLU  27   9.957  -5.441   2.485
  198    HA   GLU  27           HA       GLU  27   9.439  -8.008   1.698
  199   1HB   GLU  27          HB2       GLU  27  11.771  -8.566   2.275
  200   2HB   GLU  27          HB1       GLU  27  11.632  -7.049   1.403
  201   1HG   GLU  27          HG2       GLU  27  11.846  -7.164   4.393
  202   2HG   GLU  27          HG1       GLU  27  13.257  -7.131   3.342
  203    H    GLU  28           HN       GLU  28  10.023  -6.916   5.029
  204    HA   GLU  28           HA       GLU  28   9.744  -9.588   6.077
  205   1HB   GLU  28          HB2       GLU  28   9.838  -6.918   7.492
  206   2HB   GLU  28          HB1       GLU  28   9.894  -8.485   8.285
  207   1HG   GLU  28          HG2       GLU  28  11.935  -7.401   6.357
  208   2HG   GLU  28          HG1       GLU  28  12.107  -7.511   8.109
  209    H    SER  29           HN       SER  29   7.758  -6.722   5.765
  210    HA   SER  29           HA       SER  29   5.638  -7.432   7.426
  211   1HB   SER  29          HB2       SER  29   5.871  -5.187   6.501
  212   2HB   SER  29          HB1       SER  29   5.598  -5.806   4.874
  213    HG   SER  29           HG       SER  29   3.501  -6.431   5.555
  214    H    GLN  30           HN       GLN  30   6.449  -8.497   4.195
  215    HA   GLN  30           HA       GLN  30   3.966  -9.486   3.418
  216   1HB   GLN  30          HB2       GLN  30   6.451 -10.981   2.679
  217   2HB   GLN  30          HB1       GLN  30   5.028 -10.637   1.703
  218   1HG   GLN  30          HG2       GLN  30   7.220  -8.733   2.451
  219   2HG   GLN  30          HG1       GLN  30   6.846  -9.377   0.856
  220    H    ARG  31           HN       ARG  31   6.377 -10.786   5.563
  221    HA   ARG  31           HA       ARG  31   5.232 -13.405   5.726
  222   1HB   ARG  31          HB2       ARG  31   7.619 -12.974   6.179
  223   2HB   ARG  31          HB1       ARG  31   7.173 -12.012   7.580
  224   1HG   ARG  31          HG2       ARG  31   7.838 -14.118   8.398
  225   2HG   ARG  31          HG1       ARG  31   6.079 -14.079   8.511
  226   1HD   ARG  31          HD2       ARG  31   7.607 -15.339   6.238
  227   2HD   ARG  31          HD1       ARG  31   7.020 -16.226   7.642
  228    HE   ARG  31           HE       ARG  31   5.514 -15.469   5.370
  229   1HH1  ARG  31          HH11      ARG  31   5.265 -15.817   8.836
  230   2HH1  ARG  31          HH12      ARG  31   3.553 -16.068   8.812
  231   1HH2  ARG  31          HH21      ARG  31   3.262 -15.803   5.339
  232   2HH2  ARG  31          HH22      ARG  31   2.415 -16.062   6.828
  233    H    LEU  32           HN       LEU  32   5.049 -10.441   7.653
  234    HA   LEU  32           HA       LEU  32   3.498 -11.624   9.743
  235   1HB   LEU  32          HB2       LEU  32   3.970  -8.746   8.980
  236   2HB   LEU  32          HB1       LEU  32   3.041  -9.233  10.384
  237    HG   LEU  32           HG       LEU  32   5.061 -10.384  11.272
  238   1HD1  LEU  32          1HD1      LEU  32   6.329  -9.156   8.840
  239   2HD1  LEU  32          2HD1      LEU  32   6.304 -10.855   9.311
  240   3HD1  LEU  32          3HD1      LEU  32   7.247  -9.695  10.246
  241   1HD2  LEU  32          1HD2      LEU  32   4.370  -7.955  11.734
  242   2HD2  LEU  32          2HD2      LEU  32   5.722  -7.519  10.688
  243   3HD2  LEU  32          3HD2      LEU  32   6.009  -8.448  12.160
  244    H    ILE  33           HN       ILE  33   2.592  -9.189   7.296
  245    HA   ILE  33           HA       ILE  33  -0.201  -9.530   7.753
  246    HB   ILE  33           HB       ILE  33   1.299  -8.169   5.508
  247   1HG1  ILE  33          2HG1      ILE  33   0.480  -6.106   6.637
  248   2HG1  ILE  33          1HG1      ILE  33  -0.198  -7.106   7.917
  249   1HG2  ILE  33          1HG2      ILE  33  -1.595  -8.665   5.879
  250   2HG2  ILE  33          2HG2      ILE  33  -0.658  -8.460   4.400
  251   3HG2  ILE  33          3HG2      ILE  33  -1.120  -7.050   5.353
  252   1HD1  ILE  33          1HD1      ILE  33   2.713  -7.221   7.240
  253   2HD1  ILE  33          2HD1      ILE  33   1.899  -7.687   8.732
  254   3HD1  ILE  33          3HD1      ILE  33   2.063  -5.982   8.313
  255    H    GLY  34           HN       GLY  34   2.000 -11.516   6.189
  256   1HA   GLY  34          HA2       GLY  34   0.054 -12.433   4.199
  257   2HA   GLY  34          HA1       GLY  34   1.741 -12.922   4.296
  258    H    GLN  35           HN       GLN  35  -0.160 -12.788   7.140
  259    HA   GLN  35           HA       GLN  35  -0.287 -15.717   7.226
  260   1HB   GLN  35          HB2       GLN  35  -0.228 -15.586   9.615
  261   2HB   GLN  35          HB1       GLN  35   1.065 -14.557   9.020
  262   1HG   GLN  35          HG2       GLN  35   0.105 -13.316  10.726
  263   2HG   GLN  35          HG1       GLN  35  -0.608 -12.636   9.266
  264    H    GLN  36           HN       GLN  36  -2.044 -12.859   6.796
  265    HA   GLN  36           HA       GLN  36  -4.453 -13.528   8.114
  266   1HB   GLN  36          HB2       GLN  36  -3.529 -11.460   6.304
  267   2HB   GLN  36          HB1       GLN  36  -5.186 -11.944   5.955
  268   1HG   GLN  36          HG2       GLN  36  -5.976 -11.002   7.814
  269   2HG   GLN  36          HG1       GLN  36  -4.641 -11.601   8.795
  270    H    GLY  37           HN       GLY  37  -6.270 -14.619   7.408
  271   1HA   GLY  37          HA2       GLY  37  -5.864 -16.276   5.016
  272   2HA   GLY  37          HA1       GLY  37  -6.980 -16.624   6.332
  273    H    LEU  38           HN       LEU  38  -7.108 -13.375   5.369
  274    HA   LEU  38           HA       LEU  38  -9.741 -13.763   4.267
  275   1HB   LEU  38          HB2       LEU  38  -8.092 -11.265   4.649
  276   2HB   LEU  38          HB1       LEU  38  -9.748 -11.286   4.075
  277    HG   LEU  38           HG       LEU  38  -9.698 -10.698   6.419
  278   1HD1  LEU  38          1HD1      LEU  38 -11.561 -12.080   5.542
  279   2HD1  LEU  38          2HD1      LEU  38 -11.268 -12.301   7.268
  280   3HD1  LEU  38          3HD1      LEU  38 -10.715 -13.517   6.117
  281   1HD2  LEU  38          1HD2      LEU  38  -8.742 -12.010   8.111
  282   2HD2  LEU  38          2HD2      LEU  38  -7.526 -11.961   6.835
  283   3HD2  LEU  38          3HD2      LEU  38  -8.533 -13.394   7.039
  284    H    VAL  39           HN       VAL  39 -10.253 -12.246   2.286
  285    HA   VAL  39           HA       VAL  39  -8.765 -13.320   0.081
  286    HB   VAL  39           HB       VAL  39 -10.414 -12.201  -1.341
  287   1HG1  VAL  39          1HG1      VAL  39 -12.328 -13.498  -0.691
  288   2HG1  VAL  39          2HG1      VAL  39 -11.744 -13.610   0.969
  289   3HG1  VAL  39          3HG1      VAL  39 -10.873 -14.426  -0.328
  290   1HG2  VAL  39          1HG2      VAL  39 -10.934 -10.750   1.152
  291   2HG2  VAL  39          2HG2      VAL  39 -12.388 -11.282   0.306
  292   3HG2  VAL  39          3HG2      VAL  39 -11.208 -10.267  -0.522
  293    H    ASP  40           HN       ASP  40  -8.477 -11.757  -1.854
  294    HA   ASP  40           HA       ASP  40  -6.389  -9.964  -1.132
  295   1HB   ASP  40          HB2       ASP  40  -7.796  -9.867  -3.788
  296   2HB   ASP  40          HB1       ASP  40  -6.093  -9.605  -3.431
  297    H    GLY  41           HN       GLY  41  -8.288  -9.182   0.416
  298   1HA   GLY  41          HA2       GLY  41  -9.145  -6.612  -0.778
  299   2HA   GLY  41          HA1       GLY  41 -10.318  -7.601   0.081
  300    H    LEU  42           HN       LEU  42  -7.457  -8.037   1.664
  301    HA   LEU  42           HA       LEU  42  -8.234  -5.983   3.595
  302   1HB   LEU  42          HB2       LEU  42  -6.584  -8.485   3.855
  303   2HB   LEU  42          HB1       LEU  42  -6.613  -7.260   5.107
  304    HG   LEU  42           HG       LEU  42  -8.141  -9.185   5.524
  305   1HD1  LEU  42          1HD1      LEU  42  -9.733  -7.886   6.531
  306   2HD1  LEU  42          2HD1      LEU  42  -9.884  -6.802   5.149
  307   3HD1  LEU  42          3HD1      LEU  42  -8.490  -6.674   6.223
  308   1HD2  LEU  42          1HD2      LEU  42  -9.695  -8.064   3.198
  309   2HD2  LEU  42          2HD2      LEU  42 -10.172  -9.403   4.237
  310   3HD2  LEU  42          3HD2      LEU  42  -8.776  -9.568   3.172
  311    H    PHE  43           HN       PHE  43  -7.402  -4.187   2.864
  312    HA   PHE  43           HA       PHE  43  -4.511  -4.110   2.315
  313   1HB   PHE  43          HB2       PHE  43  -4.885  -2.235   0.873
  314   2HB   PHE  43          HB1       PHE  43  -6.029  -3.497   0.433
  315    HD1  PHE  43           HD1      PHE  43  -7.593  -2.519   3.213
  316    HD2  PHE  43           HD2      PHE  43  -6.461  -0.826  -0.522
  317    HE1  PHE  43           HE1      PHE  43  -9.416  -0.891   3.408
  318    HE2  PHE  43           HE2      PHE  43  -8.291   0.804  -0.331
  319    HZ   PHE  43           HZ       PHE  43  -9.770   0.776   1.634
  320    H    LEU  44           HN       LEU  44  -3.335  -2.182   2.843
  321    HA   LEU  44           HA       LEU  44  -4.431  -0.497   4.967
  322   1HB   LEU  44          HB2       LEU  44  -3.224  -2.340   6.094
  323   2HB   LEU  44          HB1       LEU  44  -1.785  -1.951   5.172
  324    HG   LEU  44           HG       LEU  44  -1.728   0.294   6.289
  325   1HD1  LEU  44          1HD1      LEU  44  -4.312  -0.130   6.901
  326   2HD1  LEU  44          2HD1      LEU  44  -3.265   0.978   7.788
  327   3HD1  LEU  44          3HD1      LEU  44  -3.554  -0.647   8.407
  328   1HD2  LEU  44          1HD2      LEU  44  -1.455  -2.300   7.720
  329   2HD2  LEU  44          2HD2      LEU  44  -1.317  -0.812   8.656
  330   3HD2  LEU  44          3HD2      LEU  44  -0.232  -1.103   7.297
  331    H    VAL  45           HN       VAL  45  -3.516   1.595   4.983
  332    HA   VAL  45           HA       VAL  45  -1.858   2.162   2.624
  333    HB   VAL  45           HB       VAL  45  -3.394   4.096   4.374
  334   1HG1  VAL  45          1HG1      VAL  45  -1.350   5.010   3.244
  335   2HG1  VAL  45          2HG1      VAL  45  -2.861   5.783   2.766
  336   3HG1  VAL  45          3HG1      VAL  45  -2.097   4.605   1.698
  337   1HG2  VAL  45          1HG2      VAL  45  -4.871   4.298   2.380
  338   2HG2  VAL  45          2HG2      VAL  45  -4.928   2.712   3.148
  339   3HG2  VAL  45          3HG2      VAL  45  -4.010   2.939   1.658
  340    H    ARG  46           HN       ARG  46   0.074   1.421   3.523
  341    HA   ARG  46           HA       ARG  46   1.201   3.194   5.583
  342   1HB   ARG  46          HB2       ARG  46   2.439   1.381   6.496
  343   2HB   ARG  46          HB1       ARG  46   0.802   0.780   6.287
  344   1HG   ARG  46          HG2       ARG  46   2.257  -0.948   5.580
  345   2HG   ARG  46          HG1       ARG  46   1.580  -0.240   4.110
  346   1HD   ARG  46          HD2       ARG  46   3.555   0.946   3.654
  347   2HD   ARG  46          HD1       ARG  46   4.196   0.663   5.261
  348    HE   ARG  46           HE       ARG  46   3.812  -1.726   3.715
  349   1HH1  ARG  46          HH11      ARG  46   5.956   0.869   4.587
  350   2HH1  ARG  46          HH12      ARG  46   7.375   0.088   3.985
  351   1HH2  ARG  46          HH21      ARG  46   5.716  -2.764   2.916
  352   2HH2  ARG  46          HH22      ARG  46   7.240  -1.950   3.041
  353    H    GLU  47           HN       GLU  47   3.681   3.338   5.414
  354    HA   GLU  47           HA       GLU  47   4.550   2.848   2.684
  355   1HB   GLU  47          HB2       GLU  47   5.325   5.115   2.327
  356   2HB   GLU  47          HB1       GLU  47   3.600   5.103   2.626
  357   1HG   GLU  47          HG2       GLU  47   5.572   5.675   4.804
  358   2HG   GLU  47          HG1       GLU  47   4.969   6.933   3.728
  359    H    SER  48           HN       SER  48   6.899   4.604   3.087
  360    HA   SER  48           HA       SER  48   8.250   3.098   5.198
  361   1HB   SER  48          HB2       SER  48  10.178   2.716   3.746
  362   2HB   SER  48          HB1       SER  48   8.734   2.001   3.033
  363    HG   SER  48           HG       SER  48   9.635   3.099   1.392
  364    H    GLN  49           HN       GLN  49   9.884   4.152   6.206
  365    HA   GLN  49           HA       GLN  49  10.028   7.026   5.672
  366   1HB   GLN  49          HB2       GLN  49  10.899   7.236   7.938
  367   2HB   GLN  49          HB1       GLN  49   9.406   6.301   7.963
  368   1HG   GLN  49          HG2       GLN  49  10.912   5.255   9.450
  369   2HG   GLN  49          HG1       GLN  49  10.809   4.232   8.019
  370    H    ARG  50           HN       ARG  50  11.382   4.641   4.323
  371    HA   ARG  50           HA       ARG  50  14.187   5.438   4.633
  372   1HB   ARG  50          HB2       ARG  50  13.746   3.046   4.953
  373   2HB   ARG  50          HB1       ARG  50  12.987   2.964   3.370
  374   1HG   ARG  50          HG2       ARG  50  15.113   3.526   2.312
  375   2HG   ARG  50          HG1       ARG  50  15.876   3.622   3.901
  376   1HD   ARG  50          HD2       ARG  50  14.588   1.170   2.704
  377   2HD   ARG  50          HD1       ARG  50  16.322   1.475   2.809
  378    HE   ARG  50           HE       ARG  50  14.667   0.433   4.850
  379   1HH1  ARG  50          HH11      ARG  50  17.395   2.553   4.347
  380   2HH1  ARG  50          HH12      ARG  50  18.014   2.340   5.949
  381   1HH2  ARG  50          HH21      ARG  50  15.484   0.149   6.955
  382   2HH2  ARG  50          HH22      ARG  50  16.932   0.974   7.429
  383    H    ASN  51           HN       ASN  51  11.545   5.073   2.303
  384    HA   ASN  51           HA       ASN  51  13.223   5.883   0.099
  385   1HB   ASN  51          HB2       ASN  51  10.215   5.643   0.244
  386   2HB   ASN  51          HB1       ASN  51  11.180   5.778  -1.224
  387   1HD2  ASN  51          1HD2      ASN  51  13.086   3.982   0.690
  388   2HD2  ASN  51          2HD2      ASN  51  12.525   2.404   0.290
  389    HA   PRO  52           HA       PRO  52  13.234  10.282   0.826
  390   1HB   PRO  52          HB2       PRO  52  12.851  10.279  -2.146
  391   2HB   PRO  52          HB1       PRO  52  13.961  11.237  -1.159
  392   1HG   PRO  52          HG2       PRO  52  14.826   9.102  -2.503
  393   2HG   PRO  52          HG1       PRO  52  15.449   9.483  -0.888
  394   1HD   PRO  52          HD2       PRO  52  13.598   7.328  -1.739
  395   2HD   PRO  52          HD1       PRO  52  14.716   7.380  -0.362
  396    H    GLN  53           HN       GLN  53  10.874   8.757  -1.282
  397    HA   GLN  53           HA       GLN  53   8.742  10.320  -0.099
  398   1HB   GLN  53          HB2       GLN  53   7.808  11.040  -2.238
  399   2HB   GLN  53          HB1       GLN  53   9.412  11.710  -2.005
  400   1HG   GLN  53          HG2       GLN  53   8.731   9.351  -3.749
  401   2HG   GLN  53          HG1       GLN  53   9.039  10.990  -4.303
  402    H    GLY  54           HN       GLY  54   8.775   7.965   0.658
  403   1HA   GLY  54          HA2       GLY  54   7.539   6.177  -1.299
  404   2HA   GLY  54          HA1       GLY  54   8.247   5.695   0.229
  405    H    PHE  55           HN       PHE  55   5.473   6.071  -1.433
  406    HA   PHE  55           HA       PHE  55   3.813   5.944   0.992
  407   1HB   PHE  55          HB2       PHE  55   3.220   7.546  -1.514
  408   2HB   PHE  55          HB1       PHE  55   2.024   7.186  -0.273
  409    HD1  PHE  55           HD1      PHE  55   5.514   8.524  -0.408
  410    HD2  PHE  55           HD2      PHE  55   1.582   8.894   1.176
  411    HE1  PHE  55           HE1      PHE  55   6.215  10.514   0.854
  412    HE2  PHE  55           HE2      PHE  55   2.274  10.890   2.435
  413    HZ   PHE  55           HZ       PHE  55   4.593  11.703   2.275
  414    H    VAL  56           HN       VAL  56   2.894   4.011   1.024
  415    HA   VAL  56           HA       VAL  56   2.202   2.727  -1.524
  416    HB   VAL  56           HB       VAL  56   3.710   1.103  -1.087
  417   1HG1  VAL  56          1HG1      VAL  56   5.179   1.147   0.635
  418   2HG1  VAL  56          2HG1      VAL  56   3.946   1.509   1.833
  419   3HG1  VAL  56          3HG1      VAL  56   4.550   2.786   0.779
  420   1HG2  VAL  56          1HG2      VAL  56   3.110  -0.630   0.488
  421   2HG2  VAL  56          2HG2      VAL  56   1.670  -0.063  -0.345
  422   3HG2  VAL  56          3HG2      VAL  56   1.997   0.456   1.308
  423    H    LEU  57           HN       LEU  57   0.627   1.209  -1.567
  424    HA   LEU  57           HA       LEU  57  -1.323   1.268   0.627
  425   1HB   LEU  57          HB2       LEU  57  -2.017   2.233  -1.694
  426   2HB   LEU  57          HB1       LEU  57  -1.984   0.565  -2.231
  427    HG   LEU  57           HG       LEU  57  -3.807   1.823  -0.198
  428   1HD1  LEU  57          1HD1      LEU  57  -4.581   2.054  -2.436
  429   2HD1  LEU  57          2HD1      LEU  57  -5.532   0.781  -1.670
  430   3HD1  LEU  57          3HD1      LEU  57  -4.237   0.362  -2.792
  431   1HD2  LEU  57          1HD2      LEU  57  -3.000  -0.281   0.740
  432   2HD2  LEU  57          2HD2      LEU  57  -3.451  -1.122  -0.745
  433   3HD2  LEU  57          3HD2      LEU  57  -4.696  -0.395   0.271
  434    H    SER  58           HN       SER  58  -1.228  -0.653   1.665
  435    HA   SER  58           HA       SER  58   0.050  -2.887   0.290
  436   1HB   SER  58          HB2       SER  58  -0.694  -2.718   3.213
  437   2HB   SER  58          HB1       SER  58   0.489  -3.787   2.459
  438    HG   SER  58           HG       SER  58   0.708  -0.962   2.433
  439    H    LEU  59           HN       LEU  59  -0.895  -4.763  -0.158
  440    HA   LEU  59           HA       LEU  59  -3.769  -4.985   0.390
  441   1HB   LEU  59          HB2       LEU  59  -2.107  -6.326  -1.746
  442   2HB   LEU  59          HB1       LEU  59  -3.847  -6.460  -1.563
  443    HG   LEU  59           HG       LEU  59  -2.386  -3.881  -2.145
  444   1HD1  LEU  59          1HD1      LEU  59  -2.896  -4.094  -4.385
  445   2HD1  LEU  59          2HD1      LEU  59  -4.130  -5.318  -4.097
  446   3HD1  LEU  59          3HD1      LEU  59  -2.424  -5.735  -3.949
  447   1HD2  LEU  59          1HD2      LEU  59  -5.222  -4.606  -1.650
  448   2HD2  LEU  59          2HD2      LEU  59  -4.878  -3.376  -2.866
  449   3HD2  LEU  59          3HD2      LEU  59  -4.329  -3.151  -1.205
  450    H    CYS  60           HN       CYS  60  -4.516  -7.387   0.425
  451    HA   CYS  60           HA       CYS  60  -2.627  -9.127   1.754
  452   1HB   CYS  60          HB2       CYS  60  -3.810  -7.894   3.579
  453   2HB   CYS  60          HB1       CYS  60  -5.332  -8.490   2.932
  454    HG   CYS  60           HG       CYS  60  -4.243  -9.838   5.330
  455    H    HIS  61           HN       HIS  61  -2.686 -10.221  -0.079
  456    HA   HIS  61           HA       HIS  61  -5.194 -11.151  -1.096
  457   1HB   HIS  61          HB2       HIS  61  -3.981 -10.534  -2.827
  458   2HB   HIS  61          HB1       HIS  61  -2.459 -10.726  -2.005
  459    HD1  HIS  61           HD1      HIS  61  -1.525 -11.585  -4.266
  460    HD2  HIS  61           HD2      HIS  61  -4.507 -14.008  -2.706
  461    HE1  HIS  61           HE1      HIS  61  -1.477 -13.683  -5.638
  462    HE2  HIS  61           HE2      HIS  61  -3.404 -15.051  -4.780
  463    H    LEU  62           HN       LEU  62  -5.448 -13.526  -1.559
  464    HA   LEU  62           HA       LEU  62  -4.545 -14.932   0.839
  465   1HB   LEU  62          HB2       LEU  62  -6.259 -16.644   0.273
  466   2HB   LEU  62          HB1       LEU  62  -6.898 -15.045   0.577
  467    HG   LEU  62           HG       LEU  62  -7.989 -16.297  -1.297
  468   1HD1  LEU  62          1HD1      LEU  62  -8.618 -14.310  -2.027
  469   2HD1  LEU  62          2HD1      LEU  62  -7.062 -14.057  -2.816
  470   3HD1  LEU  62          3HD1      LEU  62  -7.281 -13.590  -1.130
  471   1HD2  LEU  62          1HD2      LEU  62  -5.410 -15.757  -2.754
  472   2HD2  LEU  62          2HD2      LEU  62  -6.873 -16.472  -3.427
  473   3HD2  LEU  62          3HD2      LEU  62  -5.952 -17.341  -2.200
  474    H    GLN  63           HN       GLN  63  -2.676 -14.526  -0.761
  475    HA   GLN  63           HA       GLN  63  -1.702 -17.129  -0.962
  476   1HB   GLN  63          HB2       GLN  63  -1.530 -15.399  -3.435
  477   2HB   GLN  63          HB1       GLN  63  -0.734 -16.947  -3.225
  478   1HG   GLN  63          HG2       GLN  63  -3.711 -16.527  -3.248
  479   2HG   GLN  63          HG1       GLN  63  -2.754 -17.083  -4.616
  480    H    LYS  64           HN       LYS  64  -1.335 -13.693  -1.378
  481    HA   LYS  64           HA       LYS  64   0.998 -13.753   0.296
  482   1HB   LYS  64          HB2       LYS  64   2.439 -12.507  -1.259
  483   2HB   LYS  64          HB1       LYS  64   2.015 -14.088  -1.899
  484   1HG   LYS  64          HG2       LYS  64   0.325 -13.069  -3.330
  485   2HG   LYS  64          HG1       LYS  64   0.730 -11.480  -2.680
  486   1HD   LYS  64          HD2       LYS  64   1.808 -11.842  -4.839
  487   2HD   LYS  64          HD1       LYS  64   3.006 -11.700  -3.550
  488   1HE   LYS  64          HE2       LYS  64   3.567 -13.512  -5.088
  489   2HE   LYS  64          HE1       LYS  64   3.225 -14.127  -3.473
  490   1HZ   LYS  64          HZ1       LYS  64   1.248 -15.053  -4.148
  491   2HZ   LYS  64          HZ2       LYS  64   2.203 -15.288  -5.524
  492   3HZ   LYS  64          HZ3       LYS  64   1.078 -14.027  -5.482
  493    H    VAL  65           HN       VAL  65   1.887 -11.221   0.034
  494    HA   VAL  65           HA       VAL  65  -0.383  -9.391   0.086
  495    HB   VAL  65           HB       VAL  65   0.341  -8.329   2.161
  496   1HG1  VAL  65          1HG1      VAL  65  -0.642 -11.066   2.019
  497   2HG1  VAL  65          2HG1      VAL  65  -1.233  -9.697   2.961
  498   3HG1  VAL  65          3HG1      VAL  65   0.101 -10.674   3.566
  499   1HG2  VAL  65          1HG2      VAL  65   2.364 -10.557   2.310
  500   2HG2  VAL  65          2HG2      VAL  65   2.018  -9.405   3.601
  501   3HG2  VAL  65          3HG2      VAL  65   2.702  -8.842   2.075
  502    H    LYS  66           HN       LYS  66   0.315  -7.150  -0.328
  503    HA   LYS  66           HA       LYS  66   3.145  -6.961  -1.097
  504   1HB   LYS  66          HB2       LYS  66   2.423  -5.885  -3.267
  505   2HB   LYS  66          HB1       LYS  66   2.152  -7.617  -3.126
  506   1HG   LYS  66          HG2       LYS  66  -0.204  -6.624  -2.203
  507   2HG   LYS  66          HG1       LYS  66   0.233  -5.427  -3.419
  508   1HD   LYS  66          HD2       LYS  66  -0.050  -8.404  -3.809
  509   2HD   LYS  66          HD1       LYS  66  -1.097  -7.140  -4.454
  510   1HE   LYS  66          HE2       LYS  66   0.711  -6.311  -5.837
  511   2HE   LYS  66          HE1       LYS  66   1.818  -7.493  -5.143
  512   1HZ   LYS  66          HZ1       LYS  66   0.587  -7.912  -7.413
  513   2HZ   LYS  66          HZ2       LYS  66  -0.632  -8.487  -6.391
  514   3HZ   LYS  66          HZ3       LYS  66   0.910  -9.178  -6.337
  515    H    HIS  67           HN       HIS  67   3.584  -4.680  -2.072
  516    HA   HIS  67           HA       HIS  67   2.215  -2.573  -0.557
  517   1HB   HIS  67          HB2       HIS  67   5.197  -3.087  -0.548
  518   2HB   HIS  67          HB1       HIS  67   4.414  -1.689   0.180
  519    HD1  HIS  67           HD1      HIS  67   2.508  -2.437   2.063
  520    HD2  HIS  67           HD2      HIS  67   5.549  -5.126   1.194
  521    HE1  HIS  67           HE1      HIS  67   2.547  -4.051   3.989
  522    HE2  HIS  67           HE2      HIS  67   4.308  -5.741   3.377
  523    H    TYR  68           HN       TYR  68   1.749  -0.897  -1.890
  524    HA   TYR  68           HA       TYR  68   3.277  -0.640  -4.377
  525   1HB   TYR  68          HB2       TYR  68   0.480   0.268  -3.714
  526   2HB   TYR  68          HB1       TYR  68   1.280   0.576  -5.244
  527    HD1  TYR  68           HD1      TYR  68  -0.958  -0.493  -5.996
  528    HD2  TYR  68           HD2      TYR  68   2.136  -2.670  -4.063
  529    HE1  TYR  68           HE1      TYR  68  -1.877  -2.588  -6.894
  530    HE2  TYR  68           HE2      TYR  68   1.230  -4.766  -4.948
  531    HH   TYR  68           HH       TYR  68  -0.346  -5.297  -7.201
  532    H    LEU  69           HN       LEU  69   4.976   0.862  -3.781
  533    HA   LEU  69           HA       LEU  69   3.944   3.570  -3.367
  534   1HB   LEU  69          HB2       LEU  69   5.100   4.147  -1.495
  535   2HB   LEU  69          HB1       LEU  69   4.681   2.502  -1.152
  536    HG   LEU  69           HG       LEU  69   7.000   1.876  -1.820
  537   1HD1  LEU  69          1HD1      LEU  69   8.264   4.326  -1.239
  538   2HD1  LEU  69          2HD1      LEU  69   7.212   4.542  -2.635
  539   3HD1  LEU  69          3HD1      LEU  69   8.450   3.276  -2.639
  540   1HD2  LEU  69          1HD2      LEU  69   6.293   3.511   0.540
  541   2HD2  LEU  69          2HD2      LEU  69   7.974   3.032   0.309
  542   3HD2  LEU  69          3HD2      LEU  69   6.721   1.808   0.433
  543    H    ILE  70           HN       ILE  70   4.808   4.975  -4.694
  544    HA   ILE  70           HA       ILE  70   7.684   4.742  -5.025
  545    HB   ILE  70           HB       ILE  70   5.943   4.503  -7.445
  546   1HG1  ILE  70          2HG1      ILE  70   8.320   3.016  -6.316
  547   2HG1  ILE  70          1HG1      ILE  70   6.653   2.460  -6.316
  548   1HG2  ILE  70          1HG2      ILE  70   7.342   5.870  -8.550
  549   2HG2  ILE  70          2HG2      ILE  70   8.572   4.632  -8.322
  550   3HG2  ILE  70          3HG2      ILE  70   8.446   5.966  -7.180
  551   1HD1  ILE  70          1HD1      ILE  70   6.743   1.787  -8.440
  552   2HD1  ILE  70          2HD1      ILE  70   8.472   1.712  -8.118
  553   3HD1  ILE  70          3HD1      ILE  70   7.788   3.110  -8.945
  554    H    LEU  71           HN       LEU  71   4.838   6.503  -5.819
  555    HA   LEU  71           HA       LEU  71   6.350   8.948  -5.224
  556   1HB   LEU  71          HB2       LEU  71   4.509   9.242  -7.490
  557   2HB   LEU  71          HB1       LEU  71   6.062   9.983  -7.202
  558    HG   LEU  71           HG       LEU  71   7.061   7.689  -7.786
  559   1HD1  LEU  71          1HD1      LEU  71   5.552   6.474  -9.448
  560   2HD1  LEU  71          2HD1      LEU  71   4.221   7.341  -8.686
  561   3HD1  LEU  71          3HD1      LEU  71   5.218   6.245  -7.733
  562   1HD2  LEU  71          1HD2      LEU  71   6.604   8.173 -10.300
  563   2HD2  LEU  71          2HD2      LEU  71   7.494   9.348  -9.331
  564   3HD2  LEU  71          3HD2      LEU  71   5.787   9.611  -9.685
  565    HA   PRO  72           HA       PRO  72   2.606   9.766  -2.903
  566   1HB   PRO  72          HB2       PRO  72   3.360  12.207  -1.968
  567   2HB   PRO  72          HB1       PRO  72   3.968  10.697  -1.291
  568   1HG   PRO  72          HG2       PRO  72   5.257  12.547  -3.256
  569   2HG   PRO  72          HG1       PRO  72   5.972  11.726  -1.856
  570   1HD   PRO  72          HD2       PRO  72   6.281  10.826  -4.392
  571   2HD   PRO  72          HD1       PRO  72   6.219   9.737  -2.992
  572    H    SER  73           HN       SER  73   1.737  12.467  -2.629
  573    HA   SER  73           HA       SER  73   0.498  12.829  -5.207
  574   1HB   SER  73          HB2       SER  73  -0.769  14.632  -4.092
  575   2HB   SER  73          HB1       SER  73  -0.825  13.133  -3.164
  576    HG   SER  73           HG       SER  73   1.004  15.243  -2.666
  577    H    GLU  74           HN       GLU  74   1.410  13.965  -6.799
  578    HA   GLU  74           HA       GLU  74   3.374  16.035  -6.083
  579   1HB   GLU  74          HB2       GLU  74   2.973  14.449  -8.612
  580   2HB   GLU  74          HB1       GLU  74   4.011  15.866  -8.543
  581   1HG   GLU  74          HG2       GLU  74   5.350  13.897  -8.309
  582   2HG   GLU  74          HG1       GLU  74   5.337  14.769  -6.777
  583    H    GLU  75           HN       GLU  75   3.502  17.734  -8.044
  584    HA   GLU  75           HA       GLU  75   0.848  18.968  -8.056
  585   1HB   GLU  75          HB2       GLU  75   3.554  20.129  -8.752
  586   2HB   GLU  75          HB1       GLU  75   2.044  21.027  -8.715
  587   1HG   GLU  75          HG2       GLU  75   1.833  20.578  -6.323
  588   2HG   GLU  75          HG1       GLU  75   3.348  19.678  -6.362
  589    H    GLU  76           HN       GLU  76   2.086  16.798  -9.839
  590    HA   GLU  76           HA       GLU  76   1.464  18.011 -12.435
  591   1HB   GLU  76          HB2       GLU  76   3.654  16.906 -12.352
  592   2HB   GLU  76          HB1       GLU  76   2.903  15.428 -11.767
  593   1HG   GLU  76          HG2       GLU  76   1.686  15.211 -13.872
  594   2HG   GLU  76          HG1       GLU  76   2.437  16.694 -14.458
  595    H    GLY  77           HN       GLY  77   0.349  16.039  -9.903
  596   1HA   GLY  77          HA2       GLY  77  -2.165  15.594 -11.137
  597   2HA   GLY  77          HA1       GLY  77  -1.220  14.110 -11.125
  598    H    ARG  78           HN       ARG  78  -2.764  13.161  -9.701
  599    HA   ARG  78           HA       ARG  78  -2.958  14.306  -7.014
  600   1HB   ARG  78          HB2       ARG  78  -4.331  11.842  -8.072
  601   2HB   ARG  78          HB1       ARG  78  -4.781  12.795  -6.669
  602   1HG   ARG  78          HG2       ARG  78  -4.847  13.860  -9.476
  603   2HG   ARG  78          HG1       ARG  78  -6.223  13.080  -8.704
  604   1HD   ARG  78          HD2       ARG  78  -6.497  15.431  -8.442
  605   2HD   ARG  78          HD1       ARG  78  -6.046  14.774  -6.869
  606    HE   ARG  78           HE       ARG  78  -3.742  15.612  -8.243
  607   1HH1  ARG  78          HH11      ARG  78  -6.541  16.913  -6.622
  608   2HH1  ARG  78          HH12      ARG  78  -5.756  18.394  -6.185
  609   1HH2  ARG  78          HH21      ARG  78  -2.704  17.558  -7.669
  610   2HH2  ARG  78          HH22      ARG  78  -3.577  18.760  -6.779
  611    H    LEU  79           HN       LEU  79  -3.493  11.143  -6.474
  612    HA   LEU  79           HA       LEU  79  -0.959  10.732  -5.211
  613   1HB   LEU  79          HB2       LEU  79  -3.272   8.839  -5.669
  614   2HB   LEU  79          HB1       LEU  79  -1.879   8.486  -4.665
  615    HG   LEU  79           HG       LEU  79  -3.941  10.632  -4.165
  616   1HD1  LEU  79          1HD1      LEU  79  -4.452   8.145  -3.730
  617   2HD1  LEU  79          2HD1      LEU  79  -4.763   9.311  -2.446
  618   3HD1  LEU  79          3HD1      LEU  79  -3.316   8.305  -2.391
  619   1HD2  LEU  79          1HD2      LEU  79  -1.514   9.881  -2.541
  620   2HD2  LEU  79          2HD2      LEU  79  -2.747  11.055  -2.086
  621   3HD2  LEU  79          3HD2      LEU  79  -1.709  11.361  -3.478
  622    H    TYR  80           HN       TYR  80   0.826   9.747  -6.053
  623    HA   TYR  80           HA       TYR  80   0.515   8.739  -8.762
  624   1HB   TYR  80          HB2       TYR  80   2.773   9.983  -7.296
  625   2HB   TYR  80          HB1       TYR  80   3.122   8.924  -8.658
  626    HD1  TYR  80           HD1      TYR  80   3.959  10.466 -10.223
  627    HD2  TYR  80           HD2      TYR  80   0.228  11.208  -8.327
  628    HE1  TYR  80           HE1      TYR  80   3.535  12.309 -11.794
  629    HE2  TYR  80           HE2      TYR  80  -0.206  13.050  -9.887
  630    HH   TYR  80           HH       TYR  80   1.605  13.537 -12.707
  631    H    PHE  81           HN       PHE  81  -0.226   6.638  -8.281
  632    HA   PHE  81           HA       PHE  81   1.964   4.833  -7.933
  633   1HB   PHE  81          HB2       PHE  81  -0.432   4.216  -6.246
  634   2HB   PHE  81          HB1       PHE  81   1.206   3.591  -6.109
  635    HD1  PHE  81           HD1      PHE  81  -1.117   6.145  -5.083
  636    HD2  PHE  81           HD2      PHE  81   2.988   5.043  -5.151
  637    HE1  PHE  81           HE1      PHE  81  -0.649   7.806  -3.328
  638    HE2  PHE  81           HE2      PHE  81   3.467   6.704  -3.399
  639    HZ   PHE  81           HZ       PHE  81   1.645   8.088  -2.487
  640    H    SER  82           HN       SER  82   1.156   2.505  -8.076
  641    HA   SER  82           HA       SER  82  -1.109   2.269  -9.859
  642   1HB   SER  82          HB2       SER  82   1.673   1.519 -10.731
  643   2HB   SER  82          HB1       SER  82   0.185   1.313 -11.655
  644    HG   SER  82           HG       SER  82   1.753   3.455 -11.501
  645    H    MET  83           HN       MET  83   1.062  -0.156 -10.416
  646    HA   MET  83           HA       MET  83   0.340  -1.875  -8.212
  647   1HB   MET  83          HB2       MET  83  -1.546  -1.888  -9.944
  648   2HB   MET  83          HB1       MET  83  -0.404  -2.641 -11.041
  649   1HG   MET  83          HG2       MET  83  -0.323  -4.607  -9.791
  650   2HG   MET  83          HG1       MET  83  -1.031  -3.839  -8.372
  651   1HE   MET  83          HE1       MET  83  -3.426  -2.898  -8.303
  652   2HE   MET  83          HE2       MET  83  -4.736  -3.363  -9.388
  653   3HE   MET  83          HE3       MET  83  -3.534  -2.183  -9.912
  654    H    ASP  84           HN       ASP  84   1.282  -4.254  -9.038
  655    HA   ASP  84           HA       ASP  84   4.033  -3.990  -9.163
  656   1HB   ASP  84          HB2       ASP  84   2.375  -6.263 -10.256
  657   2HB   ASP  84          HB1       ASP  84   4.093  -6.339  -9.891
  658    H    ASP  85           HN       ASP  85   1.645  -4.077 -11.733
  659    HA   ASP  85           HA       ASP  85   3.708  -3.137 -13.590
  660   1HB   ASP  85          HB2       ASP  85   1.792  -5.395 -14.203
  661   2HB   ASP  85          HB1       ASP  85   2.874  -4.636 -15.368
  662    H    GLY  86           HN       GLY  86   1.968  -1.365 -12.480
  663   1HA   GLY  86          HA2       GLY  86   0.165  -0.811 -14.748
  664   2HA   GLY  86          HA1       GLY  86  -0.423  -0.680 -13.099
  665    H    GLN  87           HN       GLN  87  -0.740   1.483 -14.568
  666    HA   GLN  87           HA       GLN  87   1.162   3.373 -13.413
  667   1HB   GLN  87          HB2       GLN  87   1.173   4.673 -15.551
  668   2HB   GLN  87          HB1       GLN  87   2.001   3.125 -15.647
  669   1HG   GLN  87          HG2       GLN  87   0.047   2.143 -16.732
  670   2HG   GLN  87          HG1       GLN  87  -0.787   3.693 -16.635
  671    H    THR  88           HN       THR  88  -0.733   3.596 -11.943
  672    HA   THR  88           HA       THR  88  -2.864   5.165 -13.191
  673    HB   THR  88           HB       THR  88  -4.304   4.493 -11.311
  674    HG1  THR  88           HG1      THR  88  -3.416   3.646  -9.634
  675   1HG2  THR  88          1HG2      THR  88  -3.307   2.732 -13.345
  676   2HG2  THR  88          2HG2      THR  88  -4.934   2.876 -12.679
  677   3HG2  THR  88          3HG2      THR  88  -3.750   1.829 -11.896
  678    H    ARG  89           HN       ARG  89  -0.216   5.921 -11.755
  679    HA   ARG  89           HA       ARG  89  -0.479   7.325  -9.501
  680   1HB   ARG  89          HB2       ARG  89   1.116   9.023 -10.536
  681   2HB   ARG  89          HB1       ARG  89   1.622   7.344 -10.521
  682   1HG   ARG  89          HG2       ARG  89   2.203   8.247 -12.631
  683   2HG   ARG  89          HG1       ARG  89   0.828   7.174 -12.887
  684   1HD   ARG  89          HD2       ARG  89  -0.673   9.054 -13.012
  685   2HD   ARG  89          HD1       ARG  89   0.624  10.173 -12.589
  686    HE   ARG  89           HE       ARG  89   1.368   8.763 -14.894
  687   1HH1  ARG  89          HH11      ARG  89  -0.972  11.146 -13.878
  688   2HH1  ARG  89          HH12      ARG  89  -1.095  11.875 -15.444
  689   1HH2  ARG  89          HH21      ARG  89   1.207   9.722 -16.954
  690   2HH2  ARG  89          HH22      ARG  89   0.142  11.067 -17.190
  691    H    PHE  90           HN       PHE  90  -2.916   7.783  -9.752
  692    HA   PHE  90           HA       PHE  90  -3.198  10.645 -10.242
  693   1HB   PHE  90          HB2       PHE  90  -5.412  10.261 -11.360
  694   2HB   PHE  90          HB1       PHE  90  -4.031   9.721 -12.300
  695    HD1  PHE  90           HD1      PHE  90  -4.368   7.801 -13.462
  696    HD2  PHE  90           HD2      PHE  90  -6.273   8.238  -9.680
  697    HE1  PHE  90           HE1      PHE  90  -5.398   5.583 -13.726
  698    HE2  PHE  90           HE2      PHE  90  -7.300   6.023  -9.936
  699    HZ   PHE  90           HZ       PHE  90  -6.865   4.690 -11.960
  700    H    THR  91           HN       THR  91  -6.028  10.685  -9.736
  701    HA   THR  91           HA       THR  91  -6.007  10.699  -6.913
  702    HB   THR  91           HB       THR  91  -7.495  12.178  -8.123
  703    HG1  THR  91           HG1      THR  91  -8.458  11.834  -6.256
  704   1HG2  THR  91          1HG2      THR  91  -8.553  11.514  -9.944
  705   2HG2  THR  91          2HG2      THR  91  -9.639  10.583  -8.911
  706   3HG2  THR  91          3HG2      THR  91  -8.200   9.822  -9.593
  707    H    ASP  92           HN       ASP  92  -5.488   8.682  -6.095
  708    HA   ASP  92           HA       ASP  92  -7.085   6.382  -6.868
  709   1HB   ASP  92          HB2       ASP  92  -4.669   6.097  -6.520
  710   2HB   ASP  92          HB1       ASP  92  -4.842   6.624  -4.851
  711    H    LEU  93           HN       LEU  93  -6.413   8.246  -3.916
  712    HA   LEU  93           HA       LEU  93  -7.870   6.979  -2.030
  713   1HB   LEU  93          HB2       LEU  93  -6.623   9.025  -1.611
  714   2HB   LEU  93          HB1       LEU  93  -7.803   9.954  -2.516
  715    HG   LEU  93           HG       LEU  93  -9.516   9.414  -0.832
  716   1HD1  LEU  93          1HD1      LEU  93  -9.088   7.466   0.234
  717   2HD1  LEU  93          2HD1      LEU  93  -8.314   8.546   1.393
  718   3HD1  LEU  93          3HD1      LEU  93  -7.340   7.699   0.192
  719   1HD2  LEU  93          1HD2      LEU  93  -8.113  10.554   1.139
  720   2HD2  LEU  93          2HD2      LEU  93  -8.689  11.444  -0.270
  721   3HD2  LEU  93          3HD2      LEU  93  -7.022  10.873  -0.210
  722    H    LEU  94           HN       LEU  94  -9.345   9.674  -3.850
  723    HA   LEU  94           HA       LEU  94 -11.946   9.332  -3.085
  724   1HB   LEU  94          HB2       LEU  94 -11.043  11.182  -4.490
  725   2HB   LEU  94          HB1       LEU  94 -11.051  10.096  -5.865
  726    HG   LEU  94           HG       LEU  94 -12.974  11.653  -5.837
  727   1HD1  LEU  94          1HD1      LEU  94 -14.416  10.136  -6.723
  728   2HD1  LEU  94          2HD1      LEU  94 -14.195   8.987  -5.404
  729   3HD1  LEU  94          3HD1      LEU  94 -12.965   9.134  -6.659
  730   1HD2  LEU  94          1HD2      LEU  94 -14.390  11.885  -4.109
  731   2HD2  LEU  94          2HD2      LEU  94 -13.054  11.222  -3.168
  732   3HD2  LEU  94          3HD2      LEU  94 -14.356  10.167  -3.714
  733    H    GLN  95           HN       GLN  95 -10.356   7.746  -5.857
  734    HA   GLN  95           HA       GLN  95 -12.584   6.313  -6.734
  735   1HB   GLN  95          HB2       GLN  95  -9.639   5.685  -6.978
  736   2HB   GLN  95          HB1       GLN  95 -10.916   5.011  -7.952
  737   1HG   GLN  95          HG2       GLN  95 -10.198   7.916  -7.856
  738   2HG   GLN  95          HG1       GLN  95  -9.671   6.786  -9.099
  739    H    LEU  96           HN       LEU  96  -9.893   5.444  -4.605
  740    HA   LEU  96           HA       LEU  96 -10.426   2.795  -4.113
  741   1HB   LEU  96          HB2       LEU  96  -8.480   4.151  -3.294
  742   2HB   LEU  96          HB1       LEU  96  -9.525   4.810  -2.054
  743    HG   LEU  96           HG       LEU  96  -8.861   1.877  -2.327
  744   1HD1  LEU  96          1HD1      LEU  96  -7.036   2.156  -1.060
  745   2HD1  LEU  96          2HD1      LEU  96  -7.814   3.357  -0.031
  746   3HD1  LEU  96          3HD1      LEU  96  -7.115   3.840  -1.577
  747   1HD2  LEU  96          1HD2      LEU  96 -10.644   3.443  -0.586
  748   2HD2  LEU  96          2HD2      LEU  96  -9.606   2.284   0.243
  749   3HD2  LEU  96          3HD2      LEU  96 -10.698   1.737  -1.030
  750    H    VAL  97           HN       VAL  97 -12.037   5.633  -2.842
  751    HA   VAL  97           HA       VAL  97 -13.488   4.371  -0.775
  752    HB   VAL  97           HB       VAL  97 -14.279   6.827  -2.349
  753   1HG1  VAL  97          1HG1      VAL  97 -15.976   7.129  -0.925
  754   2HG1  VAL  97          2HG1      VAL  97 -15.000   6.678   0.474
  755   3HG1  VAL  97          3HG1      VAL  97 -15.763   5.429  -0.508
  756   1HG2  VAL  97          1HG2      VAL  97 -12.313   7.585  -1.527
  757   2HG2  VAL  97          2HG2      VAL  97 -12.251   6.368  -0.253
  758   3HG2  VAL  97          3HG2      VAL  97 -13.265   7.797  -0.058
  759    H    GLU  98           HN       GLU  98 -14.760   5.570  -3.891
  760    HA   GLU  98           HA       GLU  98 -17.155   4.047  -3.706
  761   1HB   GLU  98          HB2       GLU  98 -17.035   6.115  -5.000
  762   2HB   GLU  98          HB1       GLU  98 -15.868   5.382  -6.093
  763   1HG   GLU  98          HG2       GLU  98 -17.549   3.768  -6.815
  764   2HG   GLU  98          HG1       GLU  98 -18.720   4.495  -5.716
  765    H    PHE  99           HN       PHE  99 -14.235   3.623  -5.703
  766    HA   PHE  99           HA       PHE  99 -15.128   1.252  -6.929
  767   1HB   PHE  99          HB2       PHE  99 -12.386   2.440  -6.577
  768   2HB   PHE  99          HB1       PHE  99 -12.640   0.911  -7.406
  769    HD1  PHE  99           HD1      PHE  99 -12.091   1.376  -9.603
  770    HD2  PHE  99           HD2      PHE  99 -14.747   3.979  -7.533
  771    HE1  PHE  99           HE1      PHE  99 -12.559   2.566 -11.704
  772    HE2  PHE  99           HE2      PHE  99 -15.220   5.171  -9.629
  773    HZ   PHE  99           HZ       PHE  99 -14.127   4.465 -11.719
  774    H    HIS 100           HN       HIS 100 -14.201   1.753  -3.715
  775    HA   HIS 100           HA       HIS 100 -12.712  -0.384  -2.921
  776   1HB   HIS 100          HB2       HIS 100 -13.723  -0.232  -0.780
  777   2HB   HIS 100          HB1       HIS 100 -13.817   1.391  -1.450
  778    HD1  HIS 100           HD1      HIS 100 -16.328   1.496  -2.970
  779    HD2  HIS 100           HD2      HIS 100 -16.019  -0.718   0.531
  780    HE1  HIS 100           HE1      HIS 100 -18.684   1.230  -2.134
  781    HE2  HIS 100           HE2      HIS 100 -18.480  -0.187  -0.061
  782    H    GLN 101           HN       GLN 101 -16.037  -0.371  -3.948
  783    HA   GLN 101           HA       GLN 101 -16.709  -3.014  -3.230
  784   1HB   GLN 101          HB2       GLN 101 -18.550  -2.687  -4.937
  785   2HB   GLN 101          HB1       GLN 101 -18.479  -1.492  -3.650
  786   1HG   GLN 101          HG2       GLN 101 -17.120  -0.082  -5.304
  787   2HG   GLN 101          HG1       GLN 101 -17.713  -1.194  -6.528
  788    H    LEU 102           HN       LEU 102 -15.729  -1.631  -6.377
  789    HA   LEU 102           HA       LEU 102 -14.610  -4.243  -7.081
  790   1HB   LEU 102          HB2       LEU 102 -16.539  -2.668  -8.779
  791   2HB   LEU 102          HB1       LEU 102 -15.520  -3.942  -9.418
  792    HG   LEU 102           HG       LEU 102 -17.686  -4.862  -9.055
  793   1HD1  LEU 102          1HD1      LEU 102 -16.489  -5.966  -6.619
  794   2HD1  LEU 102          2HD1      LEU 102 -15.429  -5.952  -8.028
  795   3HD1  LEU 102          3HD1      LEU 102 -16.991  -6.767  -8.108
  796   1HD2  LEU 102          1HD2      LEU 102 -17.864  -4.570  -6.171
  797   2HD2  LEU 102          2HD2      LEU 102 -19.077  -4.280  -7.418
  798   3HD2  LEU 102          3HD2      LEU 102 -17.909  -3.023  -7.015
  799    H    ASN 103           HN       ASN 103 -12.734  -2.786  -6.405
  800    HA   ASN 103           HA       ASN 103 -11.910  -0.984  -8.566
  801   1HB   ASN 103          HB2       ASN 103 -10.294  -0.065  -7.082
  802   2HB   ASN 103          HB1       ASN 103 -11.779  -0.229  -6.166
  803   1HD2  ASN 103          1HD2      ASN 103 -11.011  -3.294  -6.167
  804   2HD2  ASN 103          2HD2      ASN 103  -9.927  -3.377  -4.833
  805    H    ARG 104           HN       ARG 104  -9.170  -1.101  -8.324
  806    HA   ARG 104           HA       ARG 104  -8.625  -3.723  -9.509
  807   1HB   ARG 104          HB2       ARG 104  -7.122  -1.104  -9.634
  808   2HB   ARG 104          HB1       ARG 104  -6.510  -2.607 -10.310
  809   1HG   ARG 104          HG2       ARG 104  -7.501  -1.252 -12.042
  810   2HG   ARG 104          HG1       ARG 104  -8.452  -2.717 -11.803
  811   1HD   ARG 104          HD2       ARG 104 -10.104  -1.502 -10.545
  812   2HD   ARG 104          HD1       ARG 104  -9.119  -0.040 -10.585
  813    HE   ARG 104           HE       ARG 104 -10.927  -0.911 -12.572
  814   1HH1  ARG 104          HH11      ARG 104  -7.817   0.630 -12.192
  815   2HH1  ARG 104          HH12      ARG 104  -7.889   1.432 -13.725
  816   1HH2  ARG 104          HH21      ARG 104 -11.024   0.149 -14.584
  817   2HH2  ARG 104          HH22      ARG 104  -9.709   1.161 -15.081
  818    H    GLY 105           HN       GLY 105  -8.730  -4.513  -7.205
  819   1HA   GLY 105          HA2       GLY 105  -7.037  -3.923  -5.147
  820   2HA   GLY 105          HA1       GLY 105  -7.558  -5.558  -5.513
  821    H    ILE 106           HN       ILE 106  -5.915  -6.949  -5.627
  822    HA   ILE 106           HA       ILE 106  -3.220  -5.982  -6.047
  823    HB   ILE 106           HB       ILE 106  -2.427  -8.077  -5.375
  824   1HG1  ILE 106          2HG1      ILE 106  -3.679  -9.482  -6.933
  825   2HG1  ILE 106          1HG1      ILE 106  -3.774 -10.133  -5.302
  826   1HG2  ILE 106          1HG2      ILE 106  -4.798  -7.110  -3.935
  827   2HG2  ILE 106          2HG2      ILE 106  -3.159  -7.414  -3.359
  828   3HG2  ILE 106          3HG2      ILE 106  -4.292  -8.750  -3.541
  829   1HD1  ILE 106          1HD1      ILE 106  -5.997  -8.809  -5.194
  830   2HD1  ILE 106          2HD1      ILE 106  -5.928 -10.354  -6.038
  831   3HD1  ILE 106          3HD1      ILE 106  -5.887  -8.847  -6.953
  832    H    LEU 107           HN       LEU 107  -1.728  -7.259  -7.508
  833    HA   LEU 107           HA       LEU 107  -2.009  -6.827 -10.088
  834   1HB   LEU 107          HB2       LEU 107  -0.669  -8.987  -8.633
  835   2HB   LEU 107          HB1       LEU 107  -0.908  -9.290 -10.345
  836    HG   LEU 107           HG       LEU 107   0.533  -6.925  -9.145
  837   1HD1  LEU 107          1HD1      LEU 107   2.350  -8.192 -10.654
  838   2HD1  LEU 107          2HD1      LEU 107   1.377  -9.572 -10.148
  839   3HD1  LEU 107          3HD1      LEU 107   2.119  -8.525  -8.938
  840   1HD2  LEU 107          1HD2      LEU 107  -0.767  -7.101 -11.605
  841   2HD2  LEU 107          2HD2      LEU 107   0.934  -7.396 -11.967
  842   3HD2  LEU 107          3HD2      LEU 107   0.455  -5.920 -11.130
  843    HA   PRO 108           HA       PRO 108  -4.720 -10.276 -11.591
  844   1HB   PRO 108          HB2       PRO 108  -4.247 -12.836 -10.886
  845   2HB   PRO 108          HB1       PRO 108  -3.143 -11.902 -11.900
  846   1HG   PRO 108          HG2       PRO 108  -2.756 -12.855  -9.178
  847   2HG   PRO 108          HG1       PRO 108  -1.575 -12.125 -10.276
  848   1HD   PRO 108          HD2       PRO 108  -3.166 -10.873  -8.129
  849   2HD   PRO 108          HD1       PRO 108  -1.668 -10.319  -8.891
  850    H    CYS 109           HN       CYS 109  -4.572 -12.221  -8.618
  851    HA   CYS 109           HA       CYS 109  -7.083 -13.159  -8.507
  852   1HB   CYS 109          HB2       CYS 109  -5.525 -12.266  -6.081
  853   2HB   CYS 109          HB1       CYS 109  -6.804 -13.473  -6.116
  854    HG   CYS 109           HG       CYS 109  -3.571 -13.791  -6.842
  855    H    LEU 110           HN       LEU 110  -8.458 -12.581  -6.282
  856    HA   LEU 110           HA       LEU 110 -10.439 -10.940  -6.829
  857   1HB   LEU 110          HB2       LEU 110  -9.100 -11.216  -4.149
  858   2HB   LEU 110          HB1       LEU 110 -10.572 -10.296  -4.355
  859    HG   LEU 110           HG       LEU 110 -11.067 -12.506  -3.498
  860   1HD1  LEU 110          1HD1      LEU 110 -11.911 -12.280  -6.384
  861   2HD1  LEU 110          2HD1      LEU 110 -12.661 -11.428  -5.035
  862   3HD1  LEU 110          3HD1      LEU 110 -12.728 -13.189  -5.114
  863   1HD2  LEU 110          1HD2      LEU 110 -10.476 -14.515  -4.520
  864   2HD2  LEU 110          2HD2      LEU 110  -9.010 -13.540  -4.628
  865   3HD2  LEU 110          3HD2      LEU 110 -10.050 -13.729  -6.040
  866    H    LEU 111           HN       LEU 111 -10.883  -8.864  -7.197
  867    HA   LEU 111           HA       LEU 111  -8.772  -6.910  -6.599
  868   1HB   LEU 111          HB2       LEU 111  -9.722  -5.570  -8.484
  869   2HB   LEU 111          HB1       LEU 111  -8.951  -7.068  -8.944
  870    HG   LEU 111           HG       LEU 111 -11.013  -6.571 -10.224
  871   1HD1  LEU 111          1HD1      LEU 111 -11.278  -8.753 -10.516
  872   2HD1  LEU 111          2HD1      LEU 111 -11.918  -8.968  -8.887
  873   3HD1  LEU 111          3HD1      LEU 111 -10.176  -8.987  -9.159
  874   1HD2  LEU 111          1HD2      LEU 111 -12.478  -7.112  -7.651
  875   2HD2  LEU 111          2HD2      LEU 111 -13.174  -6.708  -9.219
  876   3HD2  LEU 111          3HD2      LEU 111 -12.236  -5.504  -8.335
  877    H    ARG 112           HN       ARG 112 -10.823  -7.695  -4.759
  878    HA   ARG 112           HA       ARG 112 -12.224  -5.118  -4.460
  879   1HB   ARG 112          HB2       ARG 112 -13.231  -7.841  -3.607
  880   2HB   ARG 112          HB1       ARG 112 -14.058  -6.312  -3.344
  881   1HG   ARG 112          HG2       ARG 112 -14.279  -6.016  -5.760
  882   2HG   ARG 112          HG1       ARG 112 -13.449  -7.552  -6.019
  883   1HD   ARG 112          HD2       ARG 112 -15.866  -7.822  -6.196
  884   2HD   ARG 112          HD1       ARG 112 -15.225  -8.721  -4.821
  885    HE   ARG 112           HE       ARG 112 -16.040  -6.195  -3.930
  886   1HH1  ARG 112          HH11      ARG 112 -17.426  -9.146  -5.176
  887   2HH1  ARG 112          HH12      ARG 112 -18.927  -8.942  -4.338
  888   1HH2  ARG 112          HH21      ARG 112 -18.013  -5.926  -2.826
  889   2HH2  ARG 112          HH22      ARG 112 -19.261  -7.115  -3.004
  890    H    HIS 113           HN       HIS 113 -12.308  -4.248  -2.354
  891    HA   HIS 113           HA       HIS 113 -11.067  -5.738  -0.194
  892   1HB   HIS 113          HB2       HIS 113  -9.413  -3.968   0.287
  893   2HB   HIS 113          HB1       HIS 113  -9.135  -4.738  -1.275
  894    HD1  HIS 113           HD1      HIS 113  -7.746  -2.353  -1.458
  895    HD2  HIS 113           HD2      HIS 113 -11.886  -2.221  -1.758
  896    HE1  HIS 113           HE1      HIS 113  -8.271  -0.140  -2.529
  897    HE2  HIS 113           HE2      HIS 113 -10.777  -0.119  -2.777
  898    H    CYS 114           HN       CYS 114 -11.128  -4.548   1.894
  899    HA   CYS 114           HA       CYS 114 -13.179  -2.463   2.000
  900   1HB   CYS 114          HB2       CYS 114 -14.386  -4.556   2.327
  901   2HB   CYS 114          HB1       CYS 114 -13.272  -5.023   3.611
  902    HG   CYS 114           HG       CYS 114 -14.651  -3.994   5.506
  903    H    CYS 115           HN       CYS 115 -11.686  -4.440   4.558
  904    HA   CYS 115           HA       CYS 115 -10.279  -2.034   5.506
  905   1HB   CYS 115          HB2       CYS 115 -11.794  -4.002   7.236
  906   2HB   CYS 115          HB1       CYS 115 -10.858  -2.632   7.821
  907    HG   CYS 115           HG       CYS 115 -12.540  -0.691   7.024
  908    H    THR 116           HN       THR 116  -9.047  -3.133   7.734
  909    HA   THR 116           HA       THR 116  -7.284  -5.152   6.505
  910    HB   THR 116           HB       THR 116  -6.611  -3.179   8.698
  911    HG1  THR 116           HG1      THR 116  -6.112  -3.105   5.913
  912   1HG2  THR 116          1HG2      THR 116  -5.205  -5.209   8.668
  913   2HG2  THR 116          2HG2      THR 116  -4.316  -3.732   8.298
  914   3HG2  THR 116          3HG2      THR 116  -4.765  -4.839   7.001
  915    H    ARG 117           HN       ARG 117  -6.323  -6.758   7.947
  916    HA   ARG 117           HA       ARG 117  -8.032  -7.304  10.288
  917   1HB   ARG 117          HB2       ARG 117  -8.412  -8.915   8.480
  918   2HB   ARG 117          HB1       ARG 117  -6.696  -9.289   8.441
  919   1HG   ARG 117          HG2       ARG 117  -7.952 -11.004   9.621
  920   2HG   ARG 117          HG1       ARG 117  -6.823 -10.186  10.701
  921   1HD   ARG 117          HD2       ARG 117  -8.981 -10.523  11.782
  922   2HD   ARG 117          HD1       ARG 117  -8.641  -8.807  11.567
  923    HE   ARG 117           HE       ARG 117 -10.126  -9.695   9.369
  924   1HH1  ARG 117          HH11      ARG 117 -10.518  -9.188  12.799
  925   2HH1  ARG 117          HH12      ARG 117 -12.216  -8.867  12.684
  926   1HH2  ARG 117          HH21      ARG 117 -12.358  -9.272   9.216
  927   2HH2  ARG 117          HH22      ARG 117 -13.261  -8.915  10.650
  928    H    VAL 118           HN       VAL 118  -6.315  -5.871  11.282
  929    HA   VAL 118           HA       VAL 118  -4.320  -7.589  12.499
  930    HB   VAL 118           HB       VAL 118  -2.557  -5.746  12.174
  931   1HG1  VAL 118          1HG1      VAL 118  -2.959  -6.975   9.541
  932   2HG1  VAL 118          2HG1      VAL 118  -3.043  -8.100  10.896
  933   3HG1  VAL 118          3HG1      VAL 118  -1.603  -7.108  10.661
  934   1HG2  VAL 118          1HG2      VAL 118  -3.208  -4.940   9.603
  935   2HG2  VAL 118          2HG2      VAL 118  -3.233  -3.939  11.054
  936   3HG2  VAL 118          3HG2      VAL 118  -4.707  -4.735  10.507
  937    H    ALA 119           HN       ALA 119  -4.833  -4.051  12.337
  938    HA   ALA 119           HA       ALA 119  -4.519  -3.804  15.171
  939   1HB   ALA 119          HB1       ALA 119  -5.625  -1.632  13.434
  940   2HB   ALA 119          HB2       ALA 119  -3.928  -2.098  13.316
  941   3HB   ALA 119          HB3       ALA 119  -4.577  -1.510  14.846
  942    H    LEU 120           HN       LEU 120  -6.408  -1.884  15.846
  943    HA   LEU 120           HA       LEU 120  -8.551  -3.420  16.730
  944   1HB   LEU 120          HB2       LEU 120  -8.467  -0.431  16.311
  945   2HB   LEU 120          HB1       LEU 120  -9.630  -1.288  17.304
  946    HG   LEU 120           HG       LEU 120  -6.659  -1.116  17.814
  947   1HD1  LEU 120          1HD1      LEU 120  -7.470   0.953  18.432
  948   2HD1  LEU 120          2HD1      LEU 120  -7.627   0.037  19.930
  949   3HD1  LEU 120          3HD1      LEU 120  -9.041   0.312  18.913
  950   1HD2  LEU 120          1HD2      LEU 120  -7.657  -2.057  20.097
  951   2HD2  LEU 120          2HD2      LEU 120  -7.102  -3.113  18.797
  952   3HD2  LEU 120          3HD2      LEU 120  -8.822  -2.769  18.980
  953    HA   PRO1135           HA       PRO1135  16.339  -7.305 -14.461
  954   1HB   PRO1135          HB2       PRO1135  16.107  -4.574 -13.291
  955   2HB   PRO1135          HB1       PRO1135  17.280  -5.204 -14.452
  956   1HG   PRO1135          HG2       PRO1135  15.303  -3.611 -15.252
  957   2HG   PRO1135          HG1       PRO1135  15.824  -4.986 -16.244
  958   1HD   PRO1135          HD2       PRO1135  13.398  -4.692 -14.531
  959   2HD   PRO1135          HD1       PRO1135  13.595  -5.544 -16.077
  960    H    GLN1136           HN       GLN1136  14.279  -5.707 -12.039
  961    HA   GLN1136           HA       GLN1136  14.773  -7.596 -10.026
  962   1HB   GLN1136          HB2       GLN1136  17.039  -6.645 -10.039
  963   2HB   GLN1136          HB1       GLN1136  16.372  -5.043  -9.752
  964   1HG   GLN1136          HG2       GLN1136  17.266  -5.986  -7.710
  965   2HG   GLN1136          HG1       GLN1136  15.520  -5.778  -7.588
  966    HA   PRO1137           HA       PRO1137  11.261  -4.539  -9.497
  967   1HB   PRO1137          HB2       PRO1137   9.338  -6.452  -9.219
  968   2HB   PRO1137          HB1       PRO1137   9.811  -5.770 -10.779
  969   1HG   PRO1137          HG2       PRO1137  10.652  -8.345  -9.503
  970   2HG   PRO1137          HG1       PRO1137  10.204  -8.026 -11.189
  971   1HD   PRO1137          HD2       PRO1137  12.776  -8.236 -10.406
  972   2HD   PRO1137          HD1       PRO1137  12.272  -7.133 -11.702
  973    H    GLU1138           HN       GLU1138  10.156  -4.059  -7.569
  974    HA   GLU1138           HA       GLU1138  10.368  -5.892  -5.344
  975   1HB   GLU1138          HB2       GLU1138  11.471  -4.195  -3.880
  976   2HB   GLU1138          HB1       GLU1138  12.504  -4.858  -5.137
  977   1HG   GLU1138          HG2       GLU1138  12.110  -2.845  -6.488
  978   2HG   GLU1138          HG1       GLU1138  11.141  -2.177  -5.175
  979   2HN   PTR1139          HN        PTR1139   9.498  -2.516  -6.243
  980   2HN   PTR1139          HN        PTR1139   9.498  -2.516  -6.243
  981    HA   PTR1139           HA       PTR1139   7.418  -2.621  -4.244
  982    HA   PTR1139           HA       PTR1139   7.418  -2.621  -4.244
  983   1HB   PTR1139          HB1       PTR1139   7.086  -0.186  -5.416
  984   1HB   PTR1139          HB1       PTR1139   7.086  -0.186  -5.416
  985   2HB   PTR1139          HB2       PTR1139   8.817  -0.468  -5.603
  986   2HB   PTR1139          HB2       PTR1139   8.817  -0.468  -5.603
  987    HD1  PTR1139           HD1      PTR1139   6.079  -0.273  -3.074
  988    HD1  PTR1139           HD1      PTR1139   6.079  -0.273  -3.074
  989    HD2  PTR1139           HD2      PTR1139  10.281  -0.277  -3.737
  990    HD2  PTR1139           HD2      PTR1139  10.281  -0.277  -3.737
  991    HE1  PTR1139           HE1      PTR1139   6.445   0.398  -0.764
  992    HE1  PTR1139           HE1      PTR1139   6.445   0.398  -0.764
  993    HE2  PTR1139           HE2      PTR1139  10.639   0.427  -1.387
  994    HE2  PTR1139           HE2      PTR1139  10.639   0.427  -1.387
  995    H    VAL1140           HN       VAL1140   6.969  -0.928  -7.300
  996    HA   VAL1140           HA       VAL1140   5.216  -2.861  -8.407
  997    HB   VAL1140           HB       VAL1140   3.205  -1.073  -8.105
  998   1HG1  VAL1140          1HG1      VAL1140   3.266  -2.944  -5.872
  999   2HG1  VAL1140          2HG1      VAL1140   3.626  -3.689  -7.426
 1000   3HG1  VAL1140          3HG1      VAL1140   2.116  -2.805  -7.206
 1001   1HG2  VAL1140          1HG2      VAL1140   3.132  -0.054  -6.081
 1002   2HG2  VAL1140          2HG2      VAL1140   4.840   0.090  -6.495
 1003   3HG2  VAL1140          3HG2      VAL1140   4.312  -1.154  -5.362
 1004    H    ASN1141           HN       ASN1141   4.470   0.623  -8.372
 1005    HA   ASN1141           HA       ASN1141   4.084   0.937 -11.017
 1006   1HB   ASN1141          HB2       ASN1141   5.930   2.897  -9.647
 1007   2HB   ASN1141          HB1       ASN1141   4.720   3.193 -10.882
 1008   1HD2  ASN1141          1HD2      ASN1141   5.265   2.701  -7.502
 1009   2HD2  ASN1141          2HD2      ASN1141   3.725   3.251  -6.958
 1010    H    GLN1142           HN       GLN1142   7.043   0.485  -9.256
 1011    HA   GLN1142           HA       GLN1142   8.303  -0.941 -11.310
 1012   1HB   GLN1142          HB2       GLN1142   9.688   1.592 -10.439
 1013   2HB   GLN1142          HB1       GLN1142  10.225   0.475 -11.672
 1014   1HG   GLN1142          HG2       GLN1142   9.494   2.189 -12.972
 1015   2HG   GLN1142          HG1       GLN1142   8.031   1.218 -12.889
 1016    HA   PRO1143           HA       PRO1143  10.620  -2.164  -7.680
 1017   1HB   PRO1143          HB2       PRO1143  13.324  -1.737  -8.603
 1018   2HB   PRO1143          HB1       PRO1143  12.443  -3.261  -8.496
 1019   1HG   PRO1143          HG2       PRO1143  13.195  -2.062 -10.857
 1020   2HG   PRO1143          HG1       PRO1143  11.863  -3.217 -10.700
 1021   1HD   PRO1143          HD2       PRO1143  11.783  -0.240 -10.885
 1022   2HD   PRO1143          HD1       PRO1143  10.663  -1.446 -11.558
 1023    H    ASP1144           HN       ASP1144   9.811   0.472  -7.877
 1024    HA   ASP1144           HA       ASP1144   9.929   2.509  -7.050
 1025   1HB   ASP1144          HB2       ASP1144  10.891   2.803  -4.862
 1026   2HB   ASP1144          HB1       ASP1144  10.186   1.196  -4.934
  Start of MODEL    7
    1   1H    GLY   1          HT1       GLY   1  24.785   3.139  -3.304
    2   2H    GLY   1          HT2       GLY   1  25.383   4.338  -2.270
    3   3H    GLY   1          HT3       GLY   1  23.825   4.478  -2.916
    4   1HA   GLY   1          HA1       GLY   1  23.486   2.178  -1.729
    5   2HA   GLY   1          HA2       GLY   1  24.795   2.789  -0.728
    6    H    SER   2           HN       SER   2  21.928   4.279  -2.239
    7    HA   SER   2           HA       SER   2  21.472   5.974  -0.002
    8   1HB   SER   2          HB2       SER   2  20.788   6.654  -2.242
    9   2HB   SER   2          HB1       SER   2  19.668   5.297  -2.337
   10    HG   SER   2           HG       SER   2  18.877   7.504  -1.652
   11    HA   PRO   3           HA       PRO   3  17.830   2.978   0.978
   12   1HB   PRO   3          HB2       PRO   3  17.793   0.546  -0.191
   13   2HB   PRO   3          HB1       PRO   3  17.065   1.968  -0.947
   14   1HG   PRO   3          HG2       PRO   3  19.722   0.693  -1.475
   15   2HG   PRO   3          HG1       PRO   3  18.529   1.311  -2.632
   16   1HD   PRO   3          HD2       PRO   3  20.741   2.706  -1.895
   17   2HD   PRO   3          HD1       PRO   3  19.222   3.486  -2.377
   18    H    ALA   4           HN       ALA   4  18.258   2.330   2.986
   19    HA   ALA   4           HA       ALA   4  19.956   0.013   3.434
   20   1HB   ALA   4          HB1       ALA   4  21.548   1.005   4.776
   21   2HB   ALA   4          HB2       ALA   4  20.543   2.414   5.111
   22   3HB   ALA   4          HB3       ALA   4  21.314   2.235   3.534
   23    H    SER   5           HN       SER   5  20.053  -0.323   5.983
   24    HA   SER   5           HA       SER   5  17.579   0.462   7.288
   25   1HB   SER   5          HB2       SER   5  16.927  -1.871   7.779
   26   2HB   SER   5          HB1       SER   5  16.905  -1.539   6.048
   27    HG   SER   5           HG       SER   5  17.941  -3.500   6.434
   28    H    GLY   6           HN       GLY   6  17.728   0.483   9.490
   29   1HA   GLY   6          HA2       GLY   6  19.429  -1.025  11.088
   30   2HA   GLY   6          HA1       GLY   6  20.316   0.426  10.646
   31    H    THR   7           HN       THR   7  19.137   2.517  11.054
   32    HA   THR   7           HA       THR   7  18.468   2.719  13.764
   33    HB   THR   7           HB       THR   7  17.871   4.645  11.511
   34    HG1  THR   7           HG1      THR   7  19.897   5.118  11.622
   35   1HG2  THR   7          1HG2      THR   7  17.794   4.993  14.482
   36   2HG2  THR   7          2HG2      THR   7  16.590   5.454  13.278
   37   3HG2  THR   7          3HG2      THR   7  18.108   6.345  13.394
   38    H    SER   8           HN       SER   8  16.425   3.539  14.676
   39    HA   SER   8           HA       SER   8  14.085   2.424  13.273
   40   1HB   SER   8          HB2       SER   8  14.630   2.432  16.252
   41   2HB   SER   8          HB1       SER   8  13.154   1.843  15.486
   42    HG   SER   8           HG       SER   8  15.396   0.517  15.920
   43    H    LEU   9           HN       LEU   9  12.014   3.406  13.855
   44    HA   LEU   9           HA       LEU   9  12.109   6.041  15.075
   45   1HB   LEU   9          HB2       LEU   9  12.683   6.388  12.678
   46   2HB   LEU   9          HB1       LEU   9  11.148   5.669  12.236
   47    HG   LEU   9           HG       LEU   9  11.145   8.143  12.122
   48   1HD1  LEU   9          1HD1      LEU   9   9.155   6.543  12.911
   49   2HD1  LEU   9          2HD1      LEU   9   8.980   8.291  12.755
   50   3HD1  LEU   9          3HD1      LEU   9   9.278   7.572  14.338
   51   1HD2  LEU   9          1HD2      LEU   9  11.436   9.513  13.972
   52   2HD2  LEU   9          2HD2      LEU   9  12.687   8.289  14.184
   53   3HD2  LEU   9          3HD2      LEU   9  11.192   8.191  15.114
   54    H    SER  10           HN       SER  10  10.419   6.167  16.384
   55    HA   SER  10           HA       SER  10   8.087   4.472  15.868
   56   1HB   SER  10          HB2       SER  10   9.129   4.237  18.072
   57   2HB   SER  10          HB1       SER  10   8.914   5.961  18.372
   58    HG   SER  10           HG       SER  10   7.183   5.058  19.318
   59    H    ALA  11           HN       ALA  11   6.030   5.274  15.671
   60    HA   ALA  11           HA       ALA  11   5.562   8.132  15.967
   61   1HB   ALA  11          HB1       ALA  11   6.050   8.431  13.778
   62   2HB   ALA  11          HB2       ALA  11   4.391   7.872  13.572
   63   3HB   ALA  11          HB3       ALA  11   5.733   6.748  13.362
   64    H    ALA  12           HN       ALA  12   3.307   8.702  15.930
   65    HA   ALA  12           HA       ALA  12   1.405   6.484  16.013
   66   1HB   ALA  12          HB1       ALA  12   0.478   7.729  18.154
   67   2HB   ALA  12          HB2       ALA  12   2.172   8.188  18.324
   68   3HB   ALA  12          HB3       ALA  12   1.720   6.483  18.272
   69    H    ILE  13           HN       ILE  13   0.976   7.674  13.943
   70    HA   ILE  13           HA       ILE  13  -0.280  10.259  14.127
   71    HB   ILE  13           HB       ILE  13   0.986   9.651  12.124
   72   1HG1  ILE  13          2HG1      ILE  13  -1.974  10.006  11.590
   73   2HG1  ILE  13          1HG1      ILE  13  -0.825  11.298  11.927
   74   1HG2  ILE  13          1HG2      ILE  13  -0.138   7.193  12.366
   75   2HG2  ILE  13          2HG2      ILE  13   0.680   7.781  10.920
   76   3HG2  ILE  13          3HG2      ILE  13  -1.077   7.870  11.036
   77   1HD1  ILE  13          1HD1      ILE  13  -0.207  11.405   9.804
   78   2HD1  ILE  13          2HD1      ILE  13  -1.563  10.337   9.444
   79   3HD1  ILE  13          3HD1      ILE  13   0.043   9.661   9.713
   80    H    HIS  14           HN       HIS  14  -1.303   6.994  14.404
   81    HA   HIS  14           HA       HIS  14  -3.990   7.313  13.537
   82   1HB   HIS  14          HB2       HIS  14  -2.750   5.274  15.394
   83   2HB   HIS  14          HB1       HIS  14  -4.391   5.182  14.765
   84    HD1  HIS  14           HD1      HIS  14  -0.876   5.462  13.305
   85    HD2  HIS  14           HD2      HIS  14  -4.544   3.663  12.554
   86    HE1  HIS  14           HE1      HIS  14  -0.529   4.061  11.247
   87    HE2  HIS  14           HE2      HIS  14  -2.740   2.918  10.857
   88    H    ARG  15           HN       ARG  15  -5.483   8.532  14.480
   89    HA   ARG  15           HA       ARG  15  -5.599   8.563  17.399
   90   1HB   ARG  15          HB2       ARG  15  -6.175  10.972  17.370
   91   2HB   ARG  15          HB1       ARG  15  -4.538  10.646  16.807
   92   1HG   ARG  15          HG2       ARG  15  -5.202  10.942  14.516
   93   2HG   ARG  15          HG1       ARG  15  -6.898  11.062  14.974
   94   1HD   ARG  15          HD2       ARG  15  -4.692  13.046  15.564
   95   2HD   ARG  15          HD1       ARG  15  -6.086  13.264  14.511
   96    HE   ARG  15           HE       ARG  15  -7.056  12.686  17.052
   97   1HH1  ARG  15          HH11      ARG  15  -5.245  15.206  15.453
   98   2HH1  ARG  15          HH12      ARG  15  -5.812  16.456  16.510
   99   1HH2  ARG  15          HH21      ARG  15  -7.801  14.330  18.443
  100   2HH2  ARG  15          HH22      ARG  15  -7.262  15.959  18.207
  101    H    THR  16           HN       THR  16  -7.094   7.606  14.836
  102    HA   THR  16           HA       THR  16  -9.724   7.902  16.049
  103    HB   THR  16           HB       THR  16 -10.758   8.342  13.821
  104    HG1  THR  16           HG1      THR  16  -8.079   8.819  13.034
  105   1HG2  THR  16          1HG2      THR  16  -8.845  10.342  14.964
  106   2HG2  THR  16          2HG2      THR  16 -10.602  10.276  15.105
  107   3HG2  THR  16          3HG2      THR  16  -9.857  10.713  13.568
  108    H    GLN  17           HN       GLN  17  -9.417   6.669  12.795
  109    HA   GLN  17           HA       GLN  17  -9.113   3.936  13.708
  110   1HB   GLN  17          HB2       GLN  17 -11.220   3.210  12.571
  111   2HB   GLN  17          HB1       GLN  17 -11.462   4.161  14.027
  112   1HG   GLN  17          HG2       GLN  17 -13.031   4.859  12.363
  113   2HG   GLN  17          HG1       GLN  17 -11.860   6.150  12.621
  114    H    LEU  18           HN       LEU  18  -7.845   5.956  11.785
  115    HA   LEU  18           HA       LEU  18  -8.223   4.764   9.190
  116   1HB   LEU  18          HB2       LEU  18  -6.237   6.784  10.214
  117   2HB   LEU  18          HB1       LEU  18  -6.247   6.207   8.560
  118    HG   LEU  18           HG       LEU  18  -7.351   8.323   8.620
  119   1HD1  LEU  18          1HD1      LEU  18  -9.403   6.126   8.416
  120   2HD1  LEU  18          2HD1      LEU  18  -8.320   6.656   7.129
  121   3HD1  LEU  18          3HD1      LEU  18  -9.554   7.752   7.751
  122   1HD2  LEU  18          1HD2      LEU  18  -9.231   8.821  10.026
  123   2HD2  LEU  18          2HD2      LEU  18  -7.890   8.275  11.034
  124   3HD2  LEU  18          3HD2      LEU  18  -9.230   7.183  10.679
  125    H    TRP  19           HN       TRP  19  -6.034   4.263   7.967
  126    HA   TRP  19           HA       TRP  19  -4.374   2.511   9.646
  127   1HB   TRP  19          HB2       TRP  19  -5.434   1.767   6.910
  128   2HB   TRP  19          HB1       TRP  19  -4.396   0.779   7.930
  129    HD1  TRP  19           HD1      TRP  19  -5.611  -0.953   9.370
  130    HE1  TRP  19           HE1      TRP  19  -8.039  -1.335  10.133
  131    HE3  TRP  19           HE3      TRP  19  -7.724   3.320   7.525
  132    HZ2  TRP  19           HZ2      TRP  19 -10.521  -0.004   9.971
  133    HZ3  TRP  19           HZ3      TRP  19 -10.132   3.687   7.867
  134    HH2  TRP  19           HH2      TRP  19 -11.501   2.059   9.064
  135    H    PHE  20           HN       PHE  20  -3.336   4.850   9.220
  136    HA   PHE  20           HA       PHE  20  -1.579   4.551   6.876
  137   1HB   PHE  20          HB2       PHE  20  -3.017   6.517   6.660
  138   2HB   PHE  20          HB1       PHE  20  -2.479   7.104   8.230
  139    HD1  PHE  20           HD1      PHE  20  -1.338   9.071   7.832
  140    HD2  PHE  20           HD2      PHE  20  -0.536   5.676   5.395
  141    HE1  PHE  20           HE1      PHE  20   0.504  10.289   6.746
  142    HE2  PHE  20           HE2      PHE  20   1.308   6.887   4.307
  143    HZ   PHE  20           HZ       PHE  20   1.830   9.197   4.982
  144    H    HIS  21           HN       HIS  21   0.406   4.001   7.378
  145    HA   HIS  21           HA       HIS  21   1.704   5.192   9.731
  146   1HB   HIS  21          HB2       HIS  21   0.739   2.904  10.248
  147   2HB   HIS  21          HB1       HIS  21   1.870   2.240   9.078
  148    HD1  HIS  21           HD1      HIS  21   2.756   0.873  11.213
  149    HD2  HIS  21           HD2      HIS  21   3.422   4.972  11.298
  150    HE1  HIS  21           HE1      HIS  21   4.484   1.236  13.002
  151    HE2  HIS  21           HE2      HIS  21   4.826   3.729  13.077
  152    H    GLY  22           HN       GLY  22   4.128   5.081   9.592
  153   1HA   GLY  22          HA2       GLY  22   4.979   5.109   6.795
  154   2HA   GLY  22          HA1       GLY  22   5.806   5.877   8.135
  155    H    ARG  23           HN       ARG  23   7.468   4.880   9.003
  156    HA   ARG  23           HA       ARG  23   8.901   2.916   7.927
  157   1HB   ARG  23          HB2       ARG  23   9.613   4.267   9.854
  158   2HB   ARG  23          HB1       ARG  23   8.605   3.285  10.904
  159   1HG   ARG  23          HG2       ARG  23   9.961   1.404  10.656
  160   2HG   ARG  23          HG1       ARG  23  10.751   2.053   9.218
  161   1HD   ARG  23          HD2       ARG  23  11.883   3.722  10.542
  162   2HD   ARG  23          HD1       ARG  23  11.012   3.213  11.990
  163    HE   ARG  23           HE       ARG  23  12.587   1.597  12.268
  164   1HH1  ARG  23          HH11      ARG  23  12.562   2.496   8.895
  165   2HH1  ARG  23          HH12      ARG  23  13.848   1.419   8.470
  166   1HH2  ARG  23          HH21      ARG  23  14.283   0.184  11.710
  167   2HH2  ARG  23          HH22      ARG  23  14.826   0.108  10.068
  168    H    ILE  24           HN       ILE  24   7.866   1.202   7.074
  169    HA   ILE  24           HA       ILE  24   7.214  -0.925   8.945
  170    HB   ILE  24           HB       ILE  24   5.301   0.137   6.890
  171   1HG1  ILE  24          2HG1      ILE  24   5.108  -0.699   9.785
  172   2HG1  ILE  24          1HG1      ILE  24   5.030   0.938   9.146
  173   1HG2  ILE  24          1HG2      ILE  24   5.524  -2.688   7.872
  174   2HG2  ILE  24          2HG2      ILE  24   5.303  -2.099   6.224
  175   3HG2  ILE  24          3HG2      ILE  24   3.974  -2.006   7.377
  176   1HD1  ILE  24          1HD1      ILE  24   3.004  -0.978   8.166
  177   2HD1  ILE  24          2HD1      ILE  24   2.865   0.739   8.534
  178   3HD1  ILE  24          3HD1      ILE  24   2.874  -0.445   9.838
  179    H    SER  25           HN       SER  25   9.166  -1.790   8.327
  180    HA   SER  25           HA       SER  25  10.305  -2.153   5.900
  181   1HB   SER  25          HB2       SER  25  10.177  -4.212   8.112
  182   2HB   SER  25          HB1       SER  25  11.342  -4.214   6.789
  183    HG   SER  25           HG       SER  25  11.505  -2.933   9.096
  184    H    ARG  26           HN       ARG  26   8.993  -2.500   4.158
  185    HA   ARG  26           HA       ARG  26   6.874  -4.243   3.941
  186   1HB   ARG  26          HB2       ARG  26   7.602  -4.345   1.426
  187   2HB   ARG  26          HB1       ARG  26   7.016  -2.839   2.116
  188   1HG   ARG  26          HG2       ARG  26   8.840  -2.176   0.909
  189   2HG   ARG  26          HG1       ARG  26   9.502  -2.329   2.526
  190   1HD   ARG  26          HD2       ARG  26  10.533  -4.418   1.956
  191   2HD   ARG  26          HD1       ARG  26   9.713  -4.444   0.394
  192    HE   ARG  26           HE       ARG  26  11.409  -3.149  -0.401
  193   1HH1  ARG  26          HH11      ARG  26  11.222  -2.692   3.059
  194   2HH1  ARG  26          HH12      ARG  26  12.397  -1.421   3.084
  195   1HH2  ARG  26          HH21      ARG  26  12.943  -1.452  -0.362
  196   2HH2  ARG  26          HH22      ARG  26  13.373  -0.721   1.150
  197    H    GLU  27           HN       GLU  27  10.310  -4.969   3.630
  198    HA   GLU  27           HA       GLU  27  10.073  -7.545   2.563
  199   1HB   GLU  27          HB2       GLU  27  12.325  -7.948   3.471
  200   2HB   GLU  27          HB1       GLU  27  12.213  -6.398   2.653
  201   1HG   GLU  27          HG2       GLU  27  11.973  -5.302   4.857
  202   2HG   GLU  27          HG1       GLU  27  12.212  -6.871   5.624
  203    H    GLU  28           HN       GLU  28  10.355  -6.545   5.973
  204    HA   GLU  28           HA       GLU  28   9.809  -9.217   6.902
  205   1HB   GLU  28          HB2       GLU  28  11.321  -7.756   8.156
  206   2HB   GLU  28          HB1       GLU  28  10.016  -6.605   8.410
  207   1HG   GLU  28          HG2       GLU  28   8.798  -8.268   9.716
  208   2HG   GLU  28          HG1       GLU  28  10.103  -9.426   9.458
  209    H    SER  29           HN       SER  29   7.954  -6.497   5.984
  210    HA   SER  29           HA       SER  29   5.734  -6.817   7.698
  211   1HB   SER  29          HB2       SER  29   6.083  -4.764   6.422
  212   2HB   SER  29          HB1       SER  29   5.878  -5.648   4.911
  213    HG   SER  29           HG       SER  29   3.731  -6.123   5.595
  214    H    GLN  30           HN       GLN  30   6.680  -8.349   4.700
  215    HA   GLN  30           HA       GLN  30   4.245  -9.487   3.964
  216   1HB   GLN  30          HB2       GLN  30   6.786 -11.043   3.631
  217   2HB   GLN  30          HB1       GLN  30   5.427 -10.890   2.527
  218   1HG   GLN  30          HG2       GLN  30   7.481  -8.771   3.113
  219   2HG   GLN  30          HG1       GLN  30   7.404  -9.778   1.675
  220    H    ARG  31           HN       ARG  31   6.513 -10.347   6.453
  221    HA   ARG  31           HA       ARG  31   5.449 -12.950   6.956
  222   1HB   ARG  31          HB2       ARG  31   7.762 -12.325   7.543
  223   2HB   ARG  31          HB1       ARG  31   7.145 -11.175   8.719
  224   1HG   ARG  31          HG2       ARG  31   7.813 -13.086   9.927
  225   2HG   ARG  31          HG1       ARG  31   6.050 -13.114   9.885
  226   1HD   ARG  31          HD2       ARG  31   7.818 -14.653   7.988
  227   2HD   ARG  31          HD1       ARG  31   7.136 -15.325   9.467
  228    HE   ARG  31           HE       ARG  31   5.817 -15.021   6.984
  229   1HH1  ARG  31          HH11      ARG  31   5.269 -14.813  10.425
  230   2HH1  ARG  31          HH12      ARG  31   3.574 -15.142  10.300
  231   1HH2  ARG  31          HH21      ARG  31   3.589 -15.460   6.820
  232   2HH2  ARG  31          HH22      ARG  31   2.621 -15.513   8.254
  233    H    LEU  32           HN       LEU  32   5.066  -9.755   8.468
  234    HA   LEU  32           HA       LEU  32   3.256 -10.720  10.469
  235   1HB   LEU  32          HB2       LEU  32   3.915  -7.933   9.530
  236   2HB   LEU  32          HB1       LEU  32   2.807  -8.271  10.846
  237    HG   LEU  32           HG       LEU  32   4.656  -9.378  12.077
  238   1HD1  LEU  32          1HD1      LEU  32   6.261  -8.445   9.714
  239   2HD1  LEU  32          2HD1      LEU  32   6.097 -10.088  10.332
  240   3HD1  LEU  32          3HD1      LEU  32   6.978  -8.878  11.265
  241   1HD2  LEU  32          1HD2      LEU  32   4.053  -6.972  12.371
  242   2HD2  LEU  32          2HD2      LEU  32   5.352  -6.568  11.249
  243   3HD2  LEU  32          3HD2      LEU  32   5.724  -7.361  12.779
  244    H    ILE  33           HN       ILE  33   2.760  -8.572   7.666
  245    HA   ILE  33           HA       ILE  33  -0.089  -8.757   7.828
  246    HB   ILE  33           HB       ILE  33   1.719  -7.693   5.651
  247   1HG1  ILE  33          2HG1      ILE  33   0.883  -5.494   6.464
  248   2HG1  ILE  33          1HG1      ILE  33   0.024  -6.328   7.754
  249   1HG2  ILE  33          1HG2      ILE  33  -1.279  -7.720   5.847
  250   2HG2  ILE  33          2HG2      ILE  33  -0.262  -8.290   4.524
  251   3HG2  ILE  33          3HG2      ILE  33  -0.401  -6.563   4.846
  252   1HD1  ILE  33          1HD1      ILE  33   1.990  -6.892   8.856
  253   2HD1  ILE  33          2HD1      ILE  33   2.280  -5.250   8.283
  254   3HD1  ILE  33          3HD1      ILE  33   2.982  -6.621   7.424
  255    H    GLY  34           HN       GLY  34   2.157 -11.006   6.830
  256   1HA   GLY  34          HA2       GLY  34   0.465 -12.044   4.677
  257   2HA   GLY  34          HA1       GLY  34   2.074 -12.619   5.090
  258    H    GLN  35           HN       GLN  35  -0.131 -12.022   7.622
  259    HA   GLN  35           HA       GLN  35  -0.404 -14.888   8.109
  260   1HB   GLN  35          HB2       GLN  35  -1.046 -14.296  10.363
  261   2HB   GLN  35          HB1       GLN  35   0.426 -13.424   9.963
  262   1HG   GLN  35          HG2       GLN  35  -0.926 -11.421   9.481
  263   2HG   GLN  35          HG1       GLN  35  -2.368 -12.306   9.972
  264    H    GLN  36           HN       GLN  36  -2.016 -12.152   6.842
  265    HA   GLN  36           HA       GLN  36  -4.672 -13.022   7.500
  266   1HB   GLN  36          HB2       GLN  36  -3.572 -10.853   5.747
  267   2HB   GLN  36          HB1       GLN  36  -5.278 -11.280   5.677
  268   1HG   GLN  36          HG2       GLN  36  -5.636  -9.943   7.395
  269   2HG   GLN  36          HG1       GLN  36  -4.667 -11.021   8.393
  270    H    GLY  37           HN       GLY  37  -5.644 -14.696   6.562
  271   1HA   GLY  37          HA2       GLY  37  -4.714 -15.561   3.914
  272   2HA   GLY  37          HA1       GLY  37  -5.617 -16.545   5.060
  273    H    LEU  38           HN       LEU  38  -6.705 -13.316   4.528
  274    HA   LEU  38           HA       LEU  38  -9.184 -14.299   3.439
  275   1HB   LEU  38          HB2       LEU  38  -8.223 -11.498   4.019
  276   2HB   LEU  38          HB1       LEU  38  -9.838 -11.893   3.465
  277    HG   LEU  38           HG       LEU  38  -9.866 -11.514   5.849
  278   1HD1  LEU  38          1HD1      LEU  38 -10.104 -14.475   5.372
  279   2HD1  LEU  38          2HD1      LEU  38 -11.302 -13.295   4.840
  280   3HD1  LEU  38          3HD1      LEU  38 -10.967 -13.499   6.560
  281   1HD2  LEU  38          1HD2      LEU  38  -8.508 -12.582   7.401
  282   2HD2  LEU  38          2HD2      LEU  38  -7.402 -12.243   6.070
  283   3HD2  LEU  38          3HD2      LEU  38  -8.061 -13.865   6.277
  284    H    VAL  39           HN       VAL  39 -10.088 -12.610   1.627
  285    HA   VAL  39           HA       VAL  39  -8.644 -13.286  -0.716
  286    HB   VAL  39           HB       VAL  39 -10.355 -12.032  -1.938
  287   1HG1  VAL  39          1HG1      VAL  39 -10.699 -14.383  -0.924
  288   2HG1  VAL  39          2HG1      VAL  39 -12.102 -13.511  -1.542
  289   3HG1  VAL  39          3HG1      VAL  39 -11.793 -13.567   0.193
  290   1HG2  VAL  39          1HG2      VAL  39 -10.847 -10.927   0.752
  291   2HG2  VAL  39          2HG2      VAL  39 -12.280 -11.282  -0.212
  292   3HG2  VAL  39          3HG2      VAL  39 -11.048 -10.186  -0.836
  293    H    ASP  40           HN       ASP  40  -8.327 -11.567  -2.461
  294    HA   ASP  40           HA       ASP  40  -6.272  -9.825  -1.556
  295   1HB   ASP  40          HB2       ASP  40  -7.647  -9.453  -4.202
  296   2HB   ASP  40          HB1       ASP  40  -5.944  -9.261  -3.804
  297    H    GLY  41           HN       GLY  41  -8.149  -9.200   0.062
  298   1HA   GLY  41          HA2       GLY  41  -9.100  -6.553  -0.896
  299   2HA   GLY  41          HA1       GLY  41 -10.200  -7.634  -0.051
  300    H    LEU  42           HN       LEU  42  -7.397  -8.218   1.453
  301    HA   LEU  42           HA       LEU  42  -8.037  -6.216   3.484
  302   1HB   LEU  42          HB2       LEU  42  -6.430  -8.765   3.626
  303   2HB   LEU  42          HB1       LEU  42  -6.565  -7.633   4.955
  304    HG   LEU  42           HG       LEU  42  -8.065  -9.576   5.195
  305   1HD1  LEU  42          1HD1      LEU  42  -8.588  -7.145   5.957
  306   2HD1  LEU  42          2HD1      LEU  42  -9.842  -8.382   6.041
  307   3HD1  LEU  42          3HD1      LEU  42  -9.834  -7.223   4.711
  308   1HD2  LEU  42          1HD2      LEU  42  -9.560  -8.480   2.825
  309   2HD2  LEU  42          2HD2      LEU  42  -9.902  -9.951   3.734
  310   3HD2  LEU  42          3HD2      LEU  42  -8.453  -9.850   2.734
  311    H    PHE  43           HN       PHE  43  -7.063  -4.407   2.876
  312    HA   PHE  43           HA       PHE  43  -4.131  -4.553   2.656
  313   1HB   PHE  43          HB2       PHE  43  -4.066  -2.999   0.828
  314   2HB   PHE  43          HB1       PHE  43  -5.127  -4.332   0.402
  315    HD1  PHE  43           HD1      PHE  43  -7.168  -2.621   2.508
  316    HD2  PHE  43           HD2      PHE  43  -5.265  -2.099  -1.260
  317    HE1  PHE  43           HE1      PHE  43  -8.878  -0.980   1.876
  318    HE2  PHE  43           HE2      PHE  43  -6.979  -0.461  -1.901
  319    HZ   PHE  43           HZ       PHE  43  -8.787   0.103  -0.332
  320    H    LEU  44           HN       LEU  44  -2.923  -2.814   3.377
  321    HA   LEU  44           HA       LEU  44  -4.392  -0.721   4.833
  322   1HB   LEU  44          HB2       LEU  44  -3.582  -1.558   6.740
  323   2HB   LEU  44          HB1       LEU  44  -2.568  -2.696   5.883
  324    HG   LEU  44           HG       LEU  44  -1.746   0.176   6.434
  325   1HD1  LEU  44          1HD1      LEU  44  -2.162  -1.419   8.447
  326   2HD1  LEU  44          2HD1      LEU  44  -0.658  -0.502   8.354
  327   3HD1  LEU  44          3HD1      LEU  44  -0.682  -2.206   7.899
  328   1HD2  LEU  44          1HD2      LEU  44  -0.239  -0.391   4.861
  329   2HD2  LEU  44          2HD2      LEU  44  -0.583  -2.114   5.002
  330   3HD2  LEU  44          3HD2      LEU  44   0.504  -1.335   6.152
  331    H    VAL  45           HN       VAL  45  -3.446   1.339   4.836
  332    HA   VAL  45           HA       VAL  45  -1.497   1.702   2.675
  333    HB   VAL  45           HB       VAL  45  -3.172   3.811   4.043
  334   1HG1  VAL  45          1HG1      VAL  45  -1.035   4.499   2.877
  335   2HG1  VAL  45          2HG1      VAL  45  -2.513   5.275   2.307
  336   3HG1  VAL  45          3HG1      VAL  45  -1.789   3.964   1.374
  337   1HG2  VAL  45          1HG2      VAL  45  -4.852   3.502   2.550
  338   2HG2  VAL  45          2HG2      VAL  45  -4.242   1.848   2.579
  339   3HG2  VAL  45          3HG2      VAL  45  -3.769   2.940   1.277
  340    H    ARG  46           HN       ARG  46   0.441   1.306   3.651
  341    HA   ARG  46           HA       ARG  46   1.216   3.244   5.721
  342   1HB   ARG  46          HB2       ARG  46   2.114   1.676   7.055
  343   2HB   ARG  46          HB1       ARG  46   1.114   0.547   6.165
  344   1HG   ARG  46          HG2       ARG  46   3.995   1.182   5.582
  345   2HG   ARG  46          HG1       ARG  46   3.400  -0.253   6.408
  346   1HD   ARG  46          HD2       ARG  46   2.130  -0.853   4.379
  347   2HD   ARG  46          HD1       ARG  46   2.839   0.531   3.553
  348    HE   ARG  46           HE       ARG  46   4.034  -1.976   3.891
  349   1HH1  ARG  46          HH11      ARG  46   4.832   1.402   4.028
  350   2HH1  ARG  46          HH12      ARG  46   6.514   1.146   3.729
  351   1HH2  ARG  46          HH21      ARG  46   6.232  -2.321   3.487
  352   2HH2  ARG  46          HH22      ARG  46   7.314  -0.974   3.412
  353    H    GLU  47           HN       GLU  47   3.744   3.484   5.711
  354    HA   GLU  47           HA       GLU  47   4.696   3.192   2.967
  355   1HB   GLU  47          HB2       GLU  47   5.304   5.537   2.793
  356   2HB   GLU  47          HB1       GLU  47   3.592   5.404   3.118
  357   1HG   GLU  47          HG2       GLU  47   3.996   5.950   5.452
  358   2HG   GLU  47          HG1       GLU  47   5.723   6.080   5.120
  359    H    SER  48           HN       SER  48   6.983   4.842   3.373
  360    HA   SER  48           HA       SER  48   8.313   3.406   5.550
  361   1HB   SER  48          HB2       SER  48  10.316   3.153   4.090
  362   2HB   SER  48          HB1       SER  48   8.929   2.225   3.531
  363    HG   SER  48           HG       SER  48   9.535   4.812   2.556
  364    H    GLN  49           HN       GLN  49   9.897   4.481   6.576
  365    HA   GLN  49           HA       GLN  49  10.022   7.348   6.014
  366   1HB   GLN  49          HB2       GLN  49  10.744   7.625   8.293
  367   2HB   GLN  49          HB1       GLN  49   9.360   6.530   8.311
  368   1HG   GLN  49          HG2       GLN  49  10.938   5.664   9.831
  369   2HG   GLN  49          HG1       GLN  49  10.997   4.630   8.405
  370    H    ARG  50           HN       ARG  50  11.402   4.853   4.822
  371    HA   ARG  50           HA       ARG  50  14.201   5.667   5.068
  372   1HB   ARG  50          HB2       ARG  50  13.702   3.289   5.474
  373   2HB   ARG  50          HB1       ARG  50  12.981   3.167   3.875
  374   1HG   ARG  50          HG2       ARG  50  15.146   2.230   3.731
  375   2HG   ARG  50          HG1       ARG  50  15.213   3.796   2.923
  376   1HD   ARG  50          HD2       ARG  50  16.054   3.332   5.781
  377   2HD   ARG  50          HD1       ARG  50  17.163   3.294   4.411
  378    HE   ARG  50           HE       ARG  50  16.184   5.598   5.730
  379   1HH1  ARG  50          HH11      ARG  50  17.028   4.402   2.560
  380   2HH1  ARG  50          HH12      ARG  50  17.373   5.974   1.923
  381   1HH2  ARG  50          HH21      ARG  50  16.642   7.664   4.894
  382   2HH2  ARG  50          HH22      ARG  50  17.158   7.826   3.247
  383    H    ASN  51           HN       ASN  51  11.710   4.858   2.585
  384    HA   ASN  51           HA       ASN  51  13.388   5.947   0.503
  385   1HB   ASN  51          HB2       ASN  51  10.465   5.187   0.381
  386   2HB   ASN  51          HB1       ASN  51  11.558   5.404  -0.984
  387   1HD2  ASN  51          1HD2      ASN  51  13.492   4.026   1.214
  388   2HD2  ASN  51          2HD2      ASN  51  13.220   2.363   0.868
  389    HA   PRO  52           HA       PRO  52  12.451  10.286   1.212
  390   1HB   PRO  52          HB2       PRO  52  12.505  10.218  -1.785
  391   2HB   PRO  52          HB1       PRO  52  13.245  11.382  -0.678
  392   1HG   PRO  52          HG2       PRO  52  14.704   9.467  -1.837
  393   2HG   PRO  52          HG1       PRO  52  15.014   9.979  -0.169
  394   1HD   PRO  52          HD2       PRO  52  13.807   7.471  -1.177
  395   2HD   PRO  52          HD1       PRO  52  14.657   7.783   0.347
  396    H    GLN  53           HN       GLN  53  10.949   8.803  -1.633
  397    HA   GLN  53           HA       GLN  53   8.342   9.927  -0.829
  398   1HB   GLN  53          HB2       GLN  53   9.278   9.092  -3.589
  399   2HB   GLN  53          HB1       GLN  53   7.707   9.772  -3.195
  400   1HG   GLN  53          HG2       GLN  53   8.771  11.859  -2.516
  401   2HG   GLN  53          HG1       GLN  53  10.349  11.179  -2.901
  402    H    GLY  54           HN       GLY  54   8.551   7.977   0.637
  403   1HA   GLY  54          HA2       GLY  54   8.032   5.466  -0.772
  404   2HA   GLY  54          HA1       GLY  54   8.580   5.617   0.879
  405    H    PHE  55           HN       PHE  55   5.703   6.603  -1.034
  406    HA   PHE  55           HA       PHE  55   4.017   5.853   1.244
  407   1HB   PHE  55          HB2       PHE  55   3.364   7.371  -1.301
  408   2HB   PHE  55          HB1       PHE  55   2.198   6.983  -0.041
  409    HD1  PHE  55           HD1      PHE  55   5.641   8.451  -0.134
  410    HD2  PHE  55           HD2      PHE  55   1.629   8.775   1.247
  411    HE1  PHE  55           HE1      PHE  55   6.221  10.526   1.049
  412    HE2  PHE  55           HE2      PHE  55   2.201  10.855   2.430
  413    HZ   PHE  55           HZ       PHE  55   4.500  11.733   2.332
  414    H    VAL  56           HN       VAL  56   3.155   3.921   1.267
  415    HA   VAL  56           HA       VAL  56   2.632   2.524  -1.259
  416    HB   VAL  56           HB       VAL  56   4.146   0.960  -0.769
  417   1HG1  VAL  56          1HG1      VAL  56   5.759   1.267   0.810
  418   2HG1  VAL  56          2HG1      VAL  56   4.604   1.708   2.060
  419   3HG1  VAL  56          3HG1      VAL  56   5.046   2.878   0.818
  420   1HG2  VAL  56          1HG2      VAL  56   2.447   0.494   1.668
  421   2HG2  VAL  56          2HG2      VAL  56   3.839  -0.505   1.267
  422   3HG2  VAL  56          3HG2      VAL  56   2.472  -0.419   0.161
  423    H    LEU  57           HN       LEU  57   1.285   0.659  -1.094
  424    HA   LEU  57           HA       LEU  57  -0.736   0.742   1.028
  425   1HB   LEU  57          HB2       LEU  57  -1.447   1.747  -1.276
  426   2HB   LEU  57          HB1       LEU  57  -1.434   0.082  -1.826
  427    HG   LEU  57           HG       LEU  57  -3.200   1.307   0.283
  428   1HD1  LEU  57          1HD1      LEU  57  -4.972   0.880  -1.163
  429   2HD1  LEU  57          2HD1      LEU  57  -4.033  -0.254  -2.134
  430   3HD1  LEU  57          3HD1      LEU  57  -3.697   1.476  -2.225
  431   1HD2  LEU  57          1HD2      LEU  57  -2.911  -1.605  -0.442
  432   2HD2  LEU  57          2HD2      LEU  57  -4.147  -0.922   0.613
  433   3HD2  LEU  57          3HD2      LEU  57  -2.452  -0.860   1.089
  434    H    SER  58           HN       SER  58  -0.752  -1.226   1.998
  435    HA   SER  58           HA       SER  58   0.572  -3.435   0.612
  436   1HB   SER  58          HB2       SER  58  -0.295  -3.346   3.503
  437   2HB   SER  58          HB1       SER  58   0.896  -4.417   2.764
  438    HG   SER  58           HG       SER  58   1.174  -1.601   2.837
  439    H    LEU  59           HN       LEU  59  -0.476  -5.129  -0.152
  440    HA   LEU  59           HA       LEU  59  -3.342  -5.347   0.391
  441   1HB   LEU  59          HB2       LEU  59  -1.657  -6.618  -1.764
  442   2HB   LEU  59          HB1       LEU  59  -3.395  -6.790  -1.604
  443    HG   LEU  59           HG       LEU  59  -1.927  -4.214  -2.170
  444   1HD1  LEU  59          1HD1      LEU  59  -2.002  -5.905  -4.015
  445   2HD1  LEU  59          2HD1      LEU  59  -2.787  -4.369  -4.379
  446   3HD1  LEU  59          3HD1      LEU  59  -3.759  -5.781  -3.968
  447   1HD2  LEU  59          1HD2      LEU  59  -4.456  -3.647  -2.741
  448   2HD2  LEU  59          2HD2      LEU  59  -3.782  -3.411  -1.129
  449   3HD2  LEU  59          3HD2      LEU  59  -4.740  -4.849  -1.483
  450    H    CYS  60           HN       CYS  60  -4.203  -7.626   0.299
  451    HA   CYS  60           HA       CYS  60  -2.490  -9.626   1.496
  452   1HB   CYS  60          HB2       CYS  60  -5.082  -8.682   2.733
  453   2HB   CYS  60          HB1       CYS  60  -4.306 -10.202   3.144
  454    HG   CYS  60           HG       CYS  60  -2.718  -9.258   4.922
  455    H    HIS  61           HN       HIS  61  -2.606 -10.450  -0.476
  456    HA   HIS  61           HA       HIS  61  -5.140 -11.106  -1.618
  457   1HB   HIS  61          HB2       HIS  61  -3.791 -10.356  -3.222
  458   2HB   HIS  61          HB1       HIS  61  -2.330 -10.861  -2.428
  459    HD1  HIS  61           HD1      HIS  61  -1.993 -11.188  -5.181
  460    HD2  HIS  61           HD2      HIS  61  -4.229 -14.049  -3.185
  461    HE1  HIS  61           HE1      HIS  61  -2.070 -13.175  -6.710
  462    HE2  HIS  61           HE2      HIS  61  -3.579 -14.814  -5.550
  463    H    LEU  62           HN       LEU  62  -5.499 -13.415  -2.357
  464    HA   LEU  62           HA       LEU  62  -4.796 -15.101  -0.070
  465   1HB   LEU  62          HB2       LEU  62  -6.559 -16.651  -0.893
  466   2HB   LEU  62          HB1       LEU  62  -7.135 -15.058  -0.459
  467    HG   LEU  62           HG       LEU  62  -8.170 -16.068  -2.514
  468   1HD1  LEU  62          1HD1      LEU  62  -7.142 -13.735  -3.762
  469   2HD1  LEU  62          2HD1      LEU  62  -7.316 -13.414  -2.037
  470   3HD1  LEU  62          3HD1      LEU  62  -8.700 -13.975  -2.974
  471   1HD2  LEU  62          1HD2      LEU  62  -6.106 -17.077  -3.414
  472   2HD2  LEU  62          2HD2      LEU  62  -5.502 -15.458  -3.771
  473   3HD2  LEU  62          3HD2      LEU  62  -6.944 -16.060  -4.585
  474    H    GLN  63           HN       GLN  63  -2.839 -14.609  -1.631
  475    HA   GLN  63           HA       GLN  63  -1.971 -17.231  -2.012
  476   1HB   GLN  63          HB2       GLN  63  -1.754 -15.338  -4.359
  477   2HB   GLN  63          HB1       GLN  63  -0.956 -16.898  -4.250
  478   1HG   GLN  63          HG2       GLN  63  -3.152 -17.995  -4.138
  479   2HG   GLN  63          HG1       GLN  63  -3.926 -16.425  -4.322
  480    H    LYS  64           HN       LYS  64  -1.461 -13.791  -2.019
  481    HA   LYS  64           HA       LYS  64   0.953 -14.183  -0.497
  482   1HB   LYS  64          HB2       LYS  64   2.301 -12.677  -1.966
  483   2HB   LYS  64          HB1       LYS  64   1.911 -14.230  -2.690
  484   1HG   LYS  64          HG2       LYS  64   0.113 -13.186  -3.970
  485   2HG   LYS  64          HG1       LYS  64   0.501 -11.626  -3.243
  486   1HD   LYS  64          HD2       LYS  64   2.712 -11.684  -4.239
  487   2HD   LYS  64          HD1       LYS  64   2.391 -13.281  -4.911
  488   1HE   LYS  64          HE2       LYS  64   0.884 -10.762  -5.590
  489   2HE   LYS  64          HE1       LYS  64   2.148 -11.488  -6.578
  490   1HZ   LYS  64          HZ1       LYS  64   0.062 -13.334  -5.893
  491   2HZ   LYS  64          HZ2       LYS  64   0.729 -12.970  -7.404
  492   3HZ   LYS  64          HZ3       LYS  64  -0.506 -12.005  -6.772
  493    H    VAL  65           HN       VAL  65   1.981 -11.813  -0.239
  494    HA   VAL  65           HA       VAL  65  -0.089  -9.787   0.129
  495    HB   VAL  65           HB       VAL  65   0.648  -9.259   2.393
  496   1HG1  VAL  65          1HG1      VAL  65   0.115 -12.196   2.464
  497   2HG1  VAL  65          2HG1      VAL  65  -1.093 -11.099   1.797
  498   3HG1  VAL  65          3HG1      VAL  65  -0.558 -10.909   3.467
  499   1HG2  VAL  65          1HG2      VAL  65   2.067 -11.554   3.188
  500   2HG2  VAL  65          2HG2      VAL  65   2.659  -9.897   3.091
  501   3HG2  VAL  65          3HG2      VAL  65   2.844 -10.979   1.713
  502    H    LYS  66           HN       LYS  66   0.695  -7.753  -0.454
  503    HA   LYS  66           HA       LYS  66   3.625  -7.473  -0.575
  504   1HB   LYS  66          HB2       LYS  66   3.623  -6.761  -2.859
  505   2HB   LYS  66          HB1       LYS  66   2.772  -8.295  -2.765
  506   1HG   LYS  66          HG2       LYS  66   0.628  -7.026  -2.753
  507   2HG   LYS  66          HG1       LYS  66   1.563  -5.560  -3.054
  508   1HD   LYS  66          HD2       LYS  66   0.708  -6.404  -5.146
  509   2HD   LYS  66          HD1       LYS  66   2.460  -6.602  -5.110
  510   1HE   LYS  66          HE2       LYS  66   1.311  -8.584  -6.010
  511   2HE   LYS  66          HE1       LYS  66   2.217  -8.943  -4.540
  512   1HZ   LYS  66          HZ1       LYS  66   0.369  -9.599  -3.529
  513   2HZ   LYS  66          HZ2       LYS  66  -0.434  -9.491  -5.013
  514   3HZ   LYS  66          HZ3       LYS  66  -0.461  -8.183  -3.943
  515    H    HIS  67           HN       HIS  67   3.797  -5.105  -1.973
  516    HA   HIS  67           HA       HIS  67   2.248  -3.114  -0.475
  517   1HB   HIS  67          HB2       HIS  67   5.264  -3.095  -0.734
  518   2HB   HIS  67          HB1       HIS  67   4.283  -1.886   0.085
  519    HD1  HIS  67           HD1      HIS  67   3.080  -2.704   2.323
  520    HD2  HIS  67           HD2      HIS  67   5.948  -5.263   0.767
  521    HE1  HIS  67           HE1      HIS  67   3.592  -4.334   4.167
  522    HE2  HIS  67           HE2      HIS  67   5.200  -5.977   3.136
  523    H    TYR  68           HN       TYR  68   2.112  -1.064  -1.513
  524    HA   TYR  68           HA       TYR  68   3.167  -0.950  -4.263
  525   1HB   TYR  68          HB2       TYR  68   0.424  -0.081  -3.316
  526   2HB   TYR  68          HB1       TYR  68   1.069   0.237  -4.918
  527    HD1  TYR  68           HD1      TYR  68   0.136  -1.055  -6.540
  528    HD2  TYR  68           HD2      TYR  68   0.756  -2.788  -2.710
  529    HE1  TYR  68           HE1      TYR  68  -0.811  -3.170  -7.355
  530    HE2  TYR  68           HE2      TYR  68  -0.190  -4.910  -3.512
  531    HH   TYR  68           HH       TYR  68  -0.565  -5.675  -6.679
  532    H    LEU  69           HN       LEU  69   4.854   0.465  -3.791
  533    HA   LEU  69           HA       LEU  69   3.969   3.202  -3.196
  534   1HB   LEU  69          HB2       LEU  69   4.732   2.889  -1.095
  535   2HB   LEU  69          HB1       LEU  69   5.865   1.660  -1.554
  536    HG   LEU  69           HG       LEU  69   6.743   3.942  -0.655
  537   1HD1  LEU  69          1HD1      LEU  69   8.550   2.792  -1.295
  538   2HD1  LEU  69          2HD1      LEU  69   8.495   3.816  -2.730
  539   3HD1  LEU  69          3HD1      LEU  69   7.774   2.213  -2.767
  540   1HD2  LEU  69          1HD2      LEU  69   6.928   4.916  -3.402
  541   2HD2  LEU  69          2HD2      LEU  69   6.604   5.789  -1.920
  542   3HD2  LEU  69          3HD2      LEU  69   5.296   4.962  -2.749
  543    H    ILE  70           HN       ILE  70   4.609   4.350  -4.924
  544    HA   ILE  70           HA       ILE  70   7.493   4.186  -5.358
  545    HB   ILE  70           HB       ILE  70   5.580   3.644  -7.571
  546   1HG1  ILE  70          2HG1      ILE  70   7.361   1.845  -7.985
  547   2HG1  ILE  70          1HG1      ILE  70   8.027   2.311  -6.438
  548   1HG2  ILE  70          1HG2      ILE  70   7.378   5.504  -8.021
  549   2HG2  ILE  70          2HG2      ILE  70   7.058   4.252  -9.214
  550   3HG2  ILE  70          3HG2      ILE  70   8.453   4.119  -8.148
  551   1HD1  ILE  70          1HD1      ILE  70   6.648   0.977  -5.408
  552   2HD1  ILE  70          2HD1      ILE  70   6.036   0.450  -6.964
  553   3HD1  ILE  70          3HD1      ILE  70   5.262   1.788  -6.123
  554    H    LEU  71           HN       LEU  71   4.511   5.747  -6.019
  555    HA   LEU  71           HA       LEU  71   5.980   8.292  -5.949
  556   1HB   LEU  71          HB2       LEU  71   3.898   7.624  -8.007
  557   2HB   LEU  71          HB1       LEU  71   4.763   9.139  -7.872
  558    HG   LEU  71           HG       LEU  71   5.929   6.464  -8.635
  559   1HD1  LEU  71          1HD1      LEU  71   4.594   7.479 -10.391
  560   2HD1  LEU  71          2HD1      LEU  71   6.308   7.531 -10.801
  561   3HD1  LEU  71          3HD1      LEU  71   5.495   8.985 -10.225
  562   1HD2  LEU  71          1HD2      LEU  71   7.286   8.413  -7.318
  563   2HD2  LEU  71          2HD2      LEU  71   7.538   8.891  -8.995
  564   3HD2  LEU  71          3HD2      LEU  71   8.013   7.279  -8.456
  565    HA   PRO  72           HA       PRO  72   2.362   9.258  -3.471
  566   1HB   PRO  72          HB2       PRO  72   3.486  11.177  -2.009
  567   2HB   PRO  72          HB1       PRO  72   3.981   9.494  -1.808
  568   1HG   PRO  72          HG2       PRO  72   5.387  11.730  -3.168
  569   2HG   PRO  72          HG1       PRO  72   6.058  10.345  -2.292
  570   1HD   PRO  72          HD2       PRO  72   5.748  10.616  -5.105
  571   2HD   PRO  72          HD1       PRO  72   6.251   9.165  -4.216
  572    H    SER  73           HN       SER  73   1.857  11.867  -2.671
  573    HA   SER  73           HA       SER  73   0.596  12.999  -4.888
  574   1HB   SER  73          HB2       SER  73  -0.103  13.487  -2.600
  575   2HB   SER  73          HB1       SER  73   1.421  14.325  -2.296
  576    HG   SER  73           HG       SER  73   0.135  15.951  -2.855
  577    H    GLU  74           HN       GLU  74   1.315  14.205  -6.539
  578    HA   GLU  74           HA       GLU  74   3.850  15.665  -6.191
  579   1HB   GLU  74          HB2       GLU  74   3.064  14.012  -8.593
  580   2HB   GLU  74          HB1       GLU  74   4.509  15.010  -8.472
  581   1HG   GLU  74          HG2       GLU  74   5.432  13.639  -6.788
  582   2HG   GLU  74          HG1       GLU  74   3.913  12.781  -6.559
  583    H    GLU  75           HN       GLU  75   4.152  16.981  -8.469
  584    HA   GLU  75           HA       GLU  75   1.796  18.715  -8.506
  585   1HB   GLU  75          HB2       GLU  75   3.215  20.430  -9.435
  586   2HB   GLU  75          HB1       GLU  75   4.013  19.731  -8.035
  587   1HG   GLU  75          HG2       GLU  75   4.630  18.858 -10.839
  588   2HG   GLU  75          HG1       GLU  75   5.445  20.214 -10.067
  589    H    GLU  76           HN       GLU  76   2.471  16.111 -10.034
  590    HA   GLU  76           HA       GLU  76   1.767  17.071 -12.715
  591   1HB   GLU  76          HB2       GLU  76   2.864  14.398 -11.803
  592   2HB   GLU  76          HB1       GLU  76   2.331  14.736 -13.442
  593   1HG   GLU  76          HG2       GLU  76   4.675  14.908 -13.440
  594   2HG   GLU  76          HG1       GLU  76   4.052  16.554 -13.523
  595    H    GLY  77           HN       GLY  77   0.597  15.800  -9.841
  596   1HA   GLY  77          HA2       GLY  77  -2.073  15.669 -10.607
  597   2HA   GLY  77          HA1       GLY  77  -1.430  14.036 -10.728
  598    H    ARG  78           HN       ARG  78  -1.681  12.845  -8.959
  599    HA   ARG  78           HA       ARG  78  -1.281  14.108  -6.377
  600   1HB   ARG  78          HB2       ARG  78  -3.330  12.927  -5.479
  601   2HB   ARG  78          HB1       ARG  78  -3.617  14.325  -6.502
  602   1HG   ARG  78          HG2       ARG  78  -3.528  11.845  -8.001
  603   2HG   ARG  78          HG1       ARG  78  -4.761  11.856  -6.748
  604   1HD   ARG  78          HD2       ARG  78  -5.887  12.734  -8.574
  605   2HD   ARG  78          HD1       ARG  78  -5.385  14.174  -7.693
  606    HE   ARG  78           HE       ARG  78  -3.414  13.547  -9.577
  607   1HH1  ARG  78          HH11      ARG  78  -6.702  14.703  -9.425
  608   2HH1  ARG  78          HH12      ARG  78  -6.620  15.522 -10.948
  609   1HH2  ARG  78          HH21      ARG  78  -3.314  14.608 -11.603
  610   2HH2  ARG  78          HH22      ARG  78  -4.698  15.472 -12.180
  611    H    LEU  79           HN       LEU  79  -2.800  11.022  -6.126
  612    HA   LEU  79           HA       LEU  79  -0.318   9.888  -5.226
  613   1HB   LEU  79          HB2       LEU  79  -3.038   8.640  -5.620
  614   2HB   LEU  79          HB1       LEU  79  -1.666   7.802  -4.933
  615    HG   LEU  79           HG       LEU  79  -3.158   8.550  -3.177
  616   1HD1  LEU  79          1HD1      LEU  79  -0.524   8.738  -3.099
  617   2HD1  LEU  79          2HD1      LEU  79  -1.534   9.276  -1.756
  618   3HD1  LEU  79          3HD1      LEU  79  -0.895  10.451  -2.905
  619   1HD2  LEU  79          1HD2      LEU  79  -3.835  10.753  -2.842
  620   2HD2  LEU  79          2HD2      LEU  79  -3.970  10.540  -4.587
  621   3HD2  LEU  79          3HD2      LEU  79  -2.588  11.399  -3.909
  622    H    TYR  80           HN       TYR  80   1.204   9.138  -6.572
  623    HA   TYR  80           HA       TYR  80   0.391   8.322  -9.237
  624   1HB   TYR  80          HB2       TYR  80   2.864   9.433  -8.097
  625   2HB   TYR  80          HB1       TYR  80   3.046   8.336  -9.465
  626    HD1  TYR  80           HD1      TYR  80   3.642   9.728 -11.234
  627    HD2  TYR  80           HD2      TYR  80   0.329  10.782  -8.784
  628    HE1  TYR  80           HE1      TYR  80   3.062  11.529 -12.804
  629    HE2  TYR  80           HE2      TYR  80  -0.258  12.586 -10.344
  630    HH   TYR  80           HH       TYR  80   1.159  12.855 -13.449
  631    H    PHE  81           HN       PHE  81   0.292   6.375  -9.930
  632    HA   PHE  81           HA       PHE  81   1.924   4.257  -8.827
  633   1HB   PHE  81          HB2       PHE  81  -1.065   4.171  -9.125
  634   2HB   PHE  81          HB1       PHE  81  -0.081   2.724  -8.957
  635    HD1  PHE  81           HD1      PHE  81  -0.539   6.014  -7.238
  636    HD2  PHE  81           HD2      PHE  81   0.094   1.822  -6.864
  637    HE1  PHE  81           HE1      PHE  81  -0.631   6.218  -4.787
  638    HE2  PHE  81           HE2      PHE  81  -0.006   2.022  -4.414
  639    HZ   PHE  81           HZ       PHE  81  -0.369   4.222  -3.374
  640    H    SER  82           HN       SER  82   2.534   2.664 -10.218
  641    HA   SER  82           HA       SER  82   1.488   2.652 -12.928
  642   1HB   SER  82          HB2       SER  82   3.261   4.369 -12.904
  643   2HB   SER  82          HB1       SER  82   4.416   3.149 -12.388
  644    HG   SER  82           HG       SER  82   4.336   3.561 -14.704
  645    H    MET  83           HN       MET  83   1.636   0.817 -10.641
  646    HA   MET  83           HA       MET  83   3.443  -1.175 -10.621
  647   1HB   MET  83          HB2       MET  83   0.474  -1.718 -10.720
  648   2HB   MET  83          HB1       MET  83   1.707  -2.739  -9.995
  649   1HG   MET  83          HG2       MET  83   1.074  -1.750  -8.104
  650   2HG   MET  83          HG1       MET  83   2.121  -0.443  -8.651
  651   1HE   MET  83          HE1       MET  83  -2.340  -0.567  -9.614
  652   2HE   MET  83          HE2       MET  83  -1.890  -1.342  -8.095
  653   3HE   MET  83          HE3       MET  83  -1.194  -1.908  -9.613
  654    H    ASP  84           HN       ASP  84   3.152  -3.482 -11.498
  655    HA   ASP  84           HA       ASP  84   3.917  -3.712 -14.060
  656   1HB   ASP  84          HB2       ASP  84   2.132  -5.651 -12.596
  657   2HB   ASP  84          HB1       ASP  84   3.028  -6.030 -14.061
  658    H    ASP  85           HN       ASP  85   0.544  -3.663 -13.005
  659    HA   ASP  85           HA       ASP  85  -0.225  -2.865 -15.712
  660   1HB   ASP  85          HB2       ASP  85  -1.634  -5.041 -14.148
  661   2HB   ASP  85          HB1       ASP  85  -2.161  -4.381 -15.692
  662    H    GLY  86           HN       GLY  86   0.109  -1.455 -13.181
  663   1HA   GLY  86          HA2       GLY  86  -2.650  -0.453 -12.920
  664   2HA   GLY  86          HA1       GLY  86  -1.672  -0.753 -11.494
  665    H    GLN  87           HN       GLN  87  -2.225   1.324 -14.210
  666    HA   GLN  87           HA       GLN  87  -0.246   3.244 -13.182
  667   1HB   GLN  87          HB2       GLN  87  -0.425   4.313 -15.421
  668   2HB   GLN  87          HB1       GLN  87   0.164   2.658 -15.496
  669   1HG   GLN  87          HG2       GLN  87  -2.059   1.890 -16.139
  670   2HG   GLN  87          HG1       GLN  87  -2.658   3.545 -16.056
  671    H    THR  88           HN       THR  88  -2.194   3.345 -11.561
  672    HA   THR  88           HA       THR  88  -4.265   5.122 -12.560
  673    HB   THR  88           HB       THR  88  -5.352   4.689 -10.361
  674    HG1  THR  88           HG1      THR  88  -3.322   2.749 -10.036
  675   1HG2  THR  88          1HG2      THR  88  -5.239   1.991 -10.911
  676   2HG2  THR  88          2HG2      THR  88  -4.909   2.758 -12.465
  677   3HG2  THR  88          3HG2      THR  88  -6.384   3.152 -11.580
  678    H    ARG  89           HN       ARG  89  -1.449   5.944 -11.880
  679    HA   ARG  89           HA       ARG  89  -1.051   7.418  -9.692
  680   1HB   ARG  89          HB2       ARG  89   0.235   9.020 -11.049
  681   2HB   ARG  89          HB1       ARG  89   0.543   7.357 -11.523
  682   1HG   ARG  89          HG2       ARG  89  -0.648   7.582 -13.514
  683   2HG   ARG  89          HG1       ARG  89  -1.477   9.035 -12.961
  684   1HD   ARG  89          HD2       ARG  89   0.570  10.309 -13.079
  685   2HD   ARG  89          HD1       ARG  89   1.489   8.859 -13.484
  686    HE   ARG  89           HE       ARG  89   0.069  10.511 -15.283
  687   1HH1  ARG  89          HH11      ARG  89   0.826   7.158 -14.665
  688   2HH1  ARG  89          HH12      ARG  89   0.613   6.679 -16.315
  689   1HH2  ARG  89          HH21      ARG  89  -0.204   9.879 -17.453
  690   2HH2  ARG  89          HH22      ARG  89   0.032   8.222 -17.898
  691    H    PHE  90           HN       PHE  90  -3.527   7.833  -9.287
  692    HA   PHE  90           HA       PHE  90  -3.890  10.698  -9.675
  693   1HB   PHE  90          HB2       PHE  90  -6.322  10.372 -10.174
  694   2HB   PHE  90          HB1       PHE  90  -5.242   9.840 -11.452
  695    HD1  PHE  90           HD1      PHE  90  -6.629   8.247  -8.350
  696    HD2  PHE  90           HD2      PHE  90  -6.039   8.023 -12.560
  697    HE1  PHE  90           HE1      PHE  90  -7.726   6.051  -8.383
  698    HE2  PHE  90           HE2      PHE  90  -7.143   5.825 -12.598
  699    HZ   PHE  90           HZ       PHE  90  -7.989   4.837 -10.508
  700    H    THR  91           HN       THR  91  -6.446  10.836  -8.423
  701    HA   THR  91           HA       THR  91  -5.616  10.454  -5.688
  702    HB   THR  91           HB       THR  91  -8.110  11.613  -6.921
  703    HG1  THR  91           HG1      THR  91  -5.995  12.814  -5.476
  704   1HG2  THR  91          1HG2      THR  91  -8.248  12.580  -4.457
  705   2HG2  THR  91          2HG2      THR  91  -7.534  11.009  -4.088
  706   3HG2  THR  91          3HG2      THR  91  -9.075  11.099  -4.943
  707    H    ASP  92           HN       ASP  92  -5.521   8.210  -5.456
  708    HA   ASP  92           HA       ASP  92  -7.608   6.443  -6.119
  709   1HB   ASP  92          HB2       ASP  92  -5.301   5.699  -5.692
  710   2HB   ASP  92          HB1       ASP  92  -5.468   6.149  -3.998
  711    H    LEU  93           HN       LEU  93  -6.948   8.353  -3.249
  712    HA   LEU  93           HA       LEU  93  -8.453   7.281  -1.291
  713   1HB   LEU  93          HB2       LEU  93  -7.203   9.430  -1.186
  714   2HB   LEU  93          HB1       LEU  93  -8.529  10.208  -2.024
  715    HG   LEU  93           HG       LEU  93  -8.790   8.868   0.669
  716   1HD1  LEU  93          1HD1      LEU  93  -8.080  11.652  -0.122
  717   2HD1  LEU  93          2HD1      LEU  93  -7.464  10.663   1.202
  718   3HD1  LEU  93          3HD1      LEU  93  -9.067  11.388   1.315
  719   1HD2  LEU  93          1HD2      LEU  93 -10.647  10.406  -1.097
  720   2HD2  LEU  93          2HD2      LEU  93 -10.845  10.461   0.653
  721   3HD2  LEU  93          3HD2      LEU  93 -10.933   8.918  -0.195
  722    H    LEU  94           HN       LEU  94  -9.973   9.849  -3.247
  723    HA   LEU  94           HA       LEU  94 -12.580   9.362  -2.558
  724   1HB   LEU  94          HB2       LEU  94 -11.732  11.284  -3.896
  725   2HB   LEU  94          HB1       LEU  94 -11.631  10.227  -5.289
  726    HG   LEU  94           HG       LEU  94 -13.633  11.674  -5.310
  727   1HD1  LEU  94          1HD1      LEU  94 -13.459   9.132  -6.115
  728   2HD1  LEU  94          2HD1      LEU  94 -14.918  10.104  -6.306
  729   3HD1  LEU  94          3HD1      LEU  94 -14.780   8.976  -4.957
  730   1HD2  LEU  94          1HD2      LEU  94 -13.782  11.199  -2.648
  731   2HD2  LEU  94          2HD2      LEU  94 -15.013  10.092  -3.257
  732   3HD2  LEU  94          3HD2      LEU  94 -15.114  11.814  -3.626
  733    H    GLN  95           HN       GLN  95 -10.738   7.839  -5.180
  734    HA   GLN  95           HA       GLN  95 -12.800   6.377  -6.318
  735   1HB   GLN  95          HB2       GLN  95  -9.866   5.694  -6.114
  736   2HB   GLN  95          HB1       GLN  95 -11.000   5.059  -7.275
  737   1HG   GLN  95          HG2       GLN  95 -10.187   7.933  -7.056
  738   2HG   GLN  95          HG1       GLN  95  -9.564   6.784  -8.231
  739    H    LEU  96           HN       LEU  96 -10.382   5.421  -3.889
  740    HA   LEU  96           HA       LEU  96 -11.079   2.823  -3.425
  741   1HB   LEU  96          HB2       LEU  96  -9.200   3.934  -2.336
  742   2HB   LEU  96          HB1       LEU  96 -10.301   4.910  -1.386
  743    HG   LEU  96           HG       LEU  96 -10.218   1.904  -1.166
  744   1HD1  LEU  96          1HD1      LEU  96  -8.934   2.503   1.000
  745   2HD1  LEU  96          2HD1      LEU  96  -8.525   3.992   0.149
  746   3HD1  LEU  96          3HD1      LEU  96  -8.053   2.433  -0.526
  747   1HD2  LEU  96          1HD2      LEU  96 -11.685   4.091   0.127
  748   2HD2  LEU  96          2HD2      LEU  96 -10.962   2.934   1.246
  749   3HD2  LEU  96          3HD2      LEU  96 -12.080   2.378   0.002
  750    H    VAL  97           HN       VAL  97 -12.786   5.707  -2.431
  751    HA   VAL  97           HA       VAL  97 -14.530   4.532  -0.556
  752    HB   VAL  97           HB       VAL  97 -15.071   6.921  -2.327
  753   1HG1  VAL  97          1HG1      VAL  97 -16.817   5.605  -0.669
  754   2HG1  VAL  97          2HG1      VAL  97 -16.951   7.288  -1.175
  755   3HG1  VAL  97          3HG1      VAL  97 -16.192   6.888   0.366
  756   1HG2  VAL  97          1HG2      VAL  97 -13.654   6.678   0.315
  757   2HG2  VAL  97          2HG2      VAL  97 -14.303   8.201  -0.290
  758   3HG2  VAL  97          3HG2      VAL  97 -13.042   7.360  -1.191
  759    H    GLU  98           HN       GLU  98 -15.428   5.667  -3.822
  760    HA   GLU  98           HA       GLU  98 -17.753   4.003  -3.884
  761   1HB   GLU  98          HB2       GLU  98 -17.685   6.118  -5.102
  762   2HB   GLU  98          HB1       GLU  98 -16.363   5.527  -6.099
  763   1HG   GLU  98          HG2       GLU  98 -17.832   3.814  -7.033
  764   2HG   GLU  98          HG1       GLU  98 -19.158   4.409  -6.035
  765    H    PHE  99           HN       PHE  99 -14.637   3.869  -5.604
  766    HA   PHE  99           HA       PHE  99 -15.205   1.481  -6.985
  767   1HB   PHE  99          HB2       PHE  99 -12.615   2.840  -6.270
  768   2HB   PHE  99          HB1       PHE  99 -12.652   1.317  -7.146
  769    HD1  PHE  99           HD1      PHE  99 -11.858   1.879  -9.248
  770    HD2  PHE  99           HD2      PHE  99 -14.946   4.228  -7.495
  771    HE1  PHE  99           HE1      PHE  99 -12.145   3.085 -11.373
  772    HE2  PHE  99           HE2      PHE  99 -15.236   5.435  -9.615
  773    HZ   PHE  99           HZ       PHE  99 -13.836   4.866 -11.558
  774    H    HIS 100           HN       HIS 100 -14.783   1.964  -3.691
  775    HA   HIS 100           HA       HIS 100 -13.260  -0.006  -2.651
  776   1HB   HIS 100          HB2       HIS 100 -14.805   1.576  -1.400
  777   2HB   HIS 100          HB1       HIS 100 -16.103   0.437  -1.732
  778    HD1  HIS 100           HD1      HIS 100 -15.880   0.678   1.086
  779    HD2  HIS 100           HD2      HIS 100 -13.177  -1.707  -0.974
  780    HE1  HIS 100           HE1      HIS 100 -14.905  -0.873   2.808
  781    HE2  HIS 100           HE2      HIS 100 -13.132  -2.163   1.568
  782    H    GLN 101           HN       GLN 101 -16.290  -0.373  -4.328
  783    HA   GLN 101           HA       GLN 101 -16.768  -3.093  -3.724
  784   1HB   GLN 101          HB2       GLN 101 -17.646  -2.018  -6.355
  785   2HB   GLN 101          HB1       GLN 101 -18.543  -2.960  -5.178
  786   1HG   GLN 101          HG2       GLN 101 -18.040  -0.008  -5.231
  787   2HG   GLN 101          HG1       GLN 101 -19.576  -0.867  -5.213
  788    H    LEU 102           HN       LEU 102 -15.683  -1.660  -6.809
  789    HA   LEU 102           HA       LEU 102 -13.943  -4.003  -7.199
  790   1HB   LEU 102          HB2       LEU 102 -15.577  -2.622  -9.331
  791   2HB   LEU 102          HB1       LEU 102 -14.444  -3.930  -9.603
  792    HG   LEU 102           HG       LEU 102 -16.628  -4.861  -9.670
  793   1HD1  LEU 102          1HD1      LEU 102 -16.334  -6.625  -8.258
  794   2HD1  LEU 102          2HD1      LEU 102 -15.885  -5.601  -6.893
  795   3HD1  LEU 102          3HD1      LEU 102 -14.723  -5.909  -8.184
  796   1HD2  LEU 102          1HD2      LEU 102 -17.416  -2.830  -8.097
  797   2HD2  LEU 102          2HD2      LEU 102 -17.387  -4.141  -6.918
  798   3HD2  LEU 102          3HD2      LEU 102 -18.374  -4.284  -8.371
  799    H    ASN 103           HN       ASN 103 -12.482  -2.311  -6.162
  800    HA   ASN 103           HA       ASN 103 -11.593  -0.223  -7.993
  801   1HB   ASN 103          HB2       ASN 103 -10.147   0.490  -6.133
  802   2HB   ASN 103          HB1       ASN 103 -11.825   0.343  -5.621
  803   1HD2  ASN 103          1HD2      ASN 103  -8.783  -0.221  -4.682
  804   2HD2  ASN 103          2HD2      ASN 103  -9.029  -1.554  -3.610
  805    H    ARG 104           HN       ARG 104  -8.995   0.026  -7.755
  806    HA   ARG 104           HA       ARG 104  -7.949  -2.238  -9.177
  807   1HB   ARG 104          HB2       ARG 104  -7.391   0.491  -9.078
  808   2HB   ARG 104          HB1       ARG 104  -5.972  -0.262  -8.367
  809   1HG   ARG 104          HG2       ARG 104  -5.643   0.053 -10.730
  810   2HG   ARG 104          HG1       ARG 104  -5.739  -1.670 -10.367
  811   1HD   ARG 104          HD2       ARG 104  -8.212  -0.198 -11.148
  812   2HD   ARG 104          HD1       ARG 104  -7.053  -0.651 -12.397
  813    HE   ARG 104           HE       ARG 104  -7.551  -2.919 -10.868
  814   1HH1  ARG 104          HH11      ARG 104  -9.314  -0.772 -12.979
  815   2HH1  ARG 104          HH12      ARG 104 -10.421  -1.996 -13.505
  816   1HH2  ARG 104          HH21      ARG 104  -9.004  -4.530 -11.557
  817   2HH2  ARG 104          HH22      ARG 104 -10.245  -4.129 -12.697
  818    H    GLY 105           HN       GLY 105  -8.487  -3.522  -7.072
  819   1HA   GLY 105          HA2       GLY 105  -6.910  -3.363  -4.787
  820   2HA   GLY 105          HA1       GLY 105  -7.662  -4.833  -5.383
  821    H    ILE 106           HN       ILE 106  -6.372  -6.436  -6.013
  822    HA   ILE 106           HA       ILE 106  -3.497  -5.960  -6.055
  823    HB   ILE 106           HB       ILE 106  -4.753  -7.863  -4.793
  824   1HG1  ILE 106          2HG1      ILE 106  -2.285  -7.600  -4.950
  825   2HG1  ILE 106          1HG1      ILE 106  -2.800  -9.280  -4.876
  826   1HG2  ILE 106          1HG2      ILE 106  -5.522  -9.665  -5.891
  827   2HG2  ILE 106          2HG2      ILE 106  -4.271  -9.585  -7.130
  828   3HG2  ILE 106          3HG2      ILE 106  -5.677  -8.526  -7.228
  829   1HD1  ILE 106          1HD1      ILE 106  -1.227  -7.941  -6.851
  830   2HD1  ILE 106          2HD1      ILE 106  -2.663  -8.650  -7.583
  831   3HD1  ILE 106          3HD1      ILE 106  -1.561  -9.661  -6.657
  832    H    LEU 107           HN       LEU 107  -2.146  -6.473  -7.794
  833    HA   LEU 107           HA       LEU 107  -2.626  -5.724 -10.260
  834   1HB   LEU 107          HB2       LEU 107  -0.750  -7.541  -9.097
  835   2HB   LEU 107          HB1       LEU 107  -1.166  -8.095 -10.706
  836    HG   LEU 107           HG       LEU 107  -0.121  -5.333 -10.052
  837   1HD1  LEU 107          1HD1      LEU 107   1.972  -6.036 -10.501
  838   2HD1  LEU 107          2HD1      LEU 107   1.437  -7.253 -11.661
  839   3HD1  LEU 107          3HD1      LEU 107   1.335  -7.578  -9.931
  840   1HD2  LEU 107          1HD2      LEU 107  -0.823  -4.769 -12.080
  841   2HD2  LEU 107          2HD2      LEU 107  -1.475  -6.387 -12.338
  842   3HD2  LEU 107          3HD2      LEU 107   0.197  -6.032 -12.767
  843    HA   PRO 108           HA       PRO 108  -4.722  -9.406 -12.180
  844   1HB   PRO 108          HB2       PRO 108  -4.031 -11.949 -11.468
  845   2HB   PRO 108          HB1       PRO 108  -3.054 -10.921 -12.517
  846   1HG   PRO 108          HG2       PRO 108  -2.446 -11.853  -9.858
  847   2HG   PRO 108          HG1       PRO 108  -1.433 -10.885 -10.940
  848   1HD   PRO 108          HD2       PRO 108  -3.184 -10.022  -8.716
  849   2HD   PRO 108          HD1       PRO 108  -1.758  -9.224  -9.401
  850    H    CYS 109           HN       CYS 109  -4.495 -11.418  -9.259
  851    HA   CYS 109           HA       CYS 109  -7.031 -12.438  -9.279
  852   1HB   CYS 109          HB2       CYS 109  -5.404 -11.794  -6.817
  853   2HB   CYS 109          HB1       CYS 109  -6.714 -12.965  -6.915
  854    HG   CYS 109           HG       CYS 109  -4.091 -13.385  -9.010
  855    H    LEU 110           HN       LEU 110  -8.355 -12.018  -6.956
  856    HA   LEU 110           HA       LEU 110 -10.281 -10.258  -7.329
  857   1HB   LEU 110          HB2       LEU 110  -8.921 -10.786  -4.695
  858   2HB   LEU 110          HB1       LEU 110 -10.383  -9.838  -4.822
  859    HG   LEU 110           HG       LEU 110 -10.953 -12.066  -4.142
  860   1HD1  LEU 110          1HD1      LEU 110 -12.569 -12.637  -5.817
  861   2HD1  LEU 110          2HD1      LEU 110 -11.668 -11.763  -7.055
  862   3HD1  LEU 110          3HD1      LEU 110 -12.441 -10.880  -5.738
  863   1HD2  LEU 110          1HD2      LEU 110  -9.901 -13.233  -6.683
  864   2HD2  LEU 110          2HD2      LEU 110 -10.271 -14.023  -5.151
  865   3HD2  LEU 110          3HD2      LEU 110  -8.829 -13.020  -5.299
  866    H    LEU 111           HN       LEU 111 -10.794  -8.109  -7.038
  867    HA   LEU 111           HA       LEU 111  -8.553  -6.304  -6.460
  868   1HB   LEU 111          HB2       LEU 111  -9.348  -4.794  -8.242
  869   2HB   LEU 111          HB1       LEU 111  -8.766  -6.327  -8.842
  870    HG   LEU 111           HG       LEU 111 -10.745  -5.560 -10.057
  871   1HD1  LEU 111          1HD1      LEU 111 -10.254  -8.080  -9.165
  872   2HD1  LEU 111          2HD1      LEU 111 -11.487  -7.645 -10.348
  873   3HD1  LEU 111          3HD1      LEU 111 -11.923  -7.835  -8.650
  874   1HD2  LEU 111          1HD2      LEU 111 -11.727  -4.399  -8.009
  875   2HD2  LEU 111          2HD2      LEU 111 -12.365  -5.982  -7.568
  876   3HD2  LEU 111          3HD2      LEU 111 -12.847  -5.231  -9.088
  877    H    ARG 112           HN       ARG 112 -11.043  -7.304  -5.015
  878    HA   ARG 112           HA       ARG 112 -12.284  -4.692  -4.436
  879   1HB   ARG 112          HB2       ARG 112 -13.351  -7.388  -3.602
  880   2HB   ARG 112          HB1       ARG 112 -14.213  -5.857  -3.682
  881   1HG   ARG 112          HG2       ARG 112 -14.062  -5.903  -6.125
  882   2HG   ARG 112          HG1       ARG 112 -13.201  -7.439  -6.038
  883   1HD   ARG 112          HD2       ARG 112 -15.560  -7.792  -6.534
  884   2HD   ARG 112          HD1       ARG 112 -15.136  -8.471  -4.963
  885    HE   ARG 112           HE       ARG 112 -16.084  -5.868  -4.575
  886   1HH1  ARG 112          HH11      ARG 112 -17.257  -8.993  -5.592
  887   2HH1  ARG 112          HH12      ARG 112 -18.871  -8.708  -5.033
  888   1HH2  ARG 112          HH21      ARG 112 -18.206  -5.491  -3.839
  889   2HH2  ARG 112          HH22      ARG 112 -19.411  -6.719  -4.039
  890    H    HIS 113           HN       HIS 113 -12.681  -4.181  -2.133
  891    HA   HIS 113           HA       HIS 113 -11.146  -5.811  -0.251
  892   1HB   HIS 113          HB2       HIS 113  -9.937  -3.884   0.661
  893   2HB   HIS 113          HB1       HIS 113  -9.526  -4.166  -1.031
  894    HD1  HIS 113           HD1      HIS 113 -10.746  -2.498  -2.769
  895    HD2  HIS 113           HD2      HIS 113 -10.795  -1.373   1.228
  896    HE1  HIS 113           HE1      HIS 113 -11.297  -0.046  -2.768
  897    HE2  HIS 113           HE2      HIS 113 -11.471   0.572  -0.334
  898    H    CYS 114           HN       CYS 114 -11.322  -4.930   2.019
  899    HA   CYS 114           HA       CYS 114 -13.868  -3.586   2.539
  900   1HB   CYS 114          HB2       CYS 114 -14.378  -5.977   2.604
  901   2HB   CYS 114          HB1       CYS 114 -13.064  -6.242   3.749
  902    HG   CYS 114           HG       CYS 114 -14.959  -3.962   5.060
  903    H    CYS 115           HN       CYS 115 -11.547  -5.350   4.581
  904    HA   CYS 115           HA       CYS 115 -10.664  -2.822   5.764
  905   1HB   CYS 115          HB2       CYS 115 -11.663  -5.174   7.388
  906   2HB   CYS 115          HB1       CYS 115 -10.975  -3.690   8.040
  907    HG   CYS 115           HG       CYS 115 -13.052  -2.062   7.428
  908    H    THR 116           HN       THR 116  -9.136  -3.935   7.831
  909    HA   THR 116           HA       THR 116  -7.284  -5.779   6.500
  910    HB   THR 116           HB       THR 116  -6.482  -3.228   7.916
  911    HG1  THR 116           HG1      THR 116  -6.232  -3.970   5.194
  912   1HG2  THR 116          1HG2      THR 116  -4.214  -3.745   7.090
  913   2HG2  THR 116          2HG2      THR 116  -4.789  -5.341   6.609
  914   3HG2  THR 116          3HG2      THR 116  -4.793  -4.879   8.311
  915    H    ARG 117           HN       ARG 117  -5.706  -6.766   8.066
  916    HA   ARG 117           HA       ARG 117  -6.765  -6.797  10.813
  917   1HB   ARG 117          HB2       ARG 117  -7.641  -8.763   9.647
  918   2HB   ARG 117          HB1       ARG 117  -6.010  -9.232   9.191
  919   1HG   ARG 117          HG2       ARG 117  -6.799 -10.552  11.063
  920   2HG   ARG 117          HG1       ARG 117  -5.434  -9.542  11.541
  921   1HD   ARG 117          HD2       ARG 117  -7.178  -9.526  13.246
  922   2HD   ARG 117          HD1       ARG 117  -6.970  -7.926  12.535
  923    HE   ARG 117           HE       ARG 117  -8.992  -9.259  11.136
  924   1HH1  ARG 117          HH11      ARG 117  -8.406  -7.927  14.308
  925   2HH1  ARG 117          HH12      ARG 117 -10.076  -7.579  14.607
  926   1HH2  ARG 117          HH21      ARG 117 -11.187  -8.802  11.526
  927   2HH2  ARG 117          HH22      ARG 117 -11.656  -8.077  13.027
  928    H    VAL 118           HN       VAL 118  -5.105  -5.690  11.734
  929    HA   VAL 118           HA       VAL 118  -2.581  -7.108  11.938
  930    HB   VAL 118           HB       VAL 118  -1.337  -4.880  11.607
  931   1HG1  VAL 118          1HG1      VAL 118  -1.082  -5.310   9.219
  932   2HG1  VAL 118          2HG1      VAL 118  -2.558  -6.274   9.224
  933   3HG1  VAL 118          3HG1      VAL 118  -1.143  -6.823  10.123
  934   1HG2  VAL 118          1HG2      VAL 118  -2.645  -3.116  11.192
  935   2HG2  VAL 118          2HG2      VAL 118  -4.037  -4.129  10.816
  936   3HG2  VAL 118          3HG2      VAL 118  -2.838  -3.783   9.571
  937    H    ALA 119           HN       ALA 119  -3.723  -3.821  12.763
  938    HA   ALA 119           HA       ALA 119  -2.631  -4.071  15.410
  939   1HB   ALA 119          HB1       ALA 119  -4.160  -1.866  14.048
  940   2HB   ALA 119          HB2       ALA 119  -2.427  -1.943  14.365
  941   3HB   ALA 119          HB3       ALA 119  -3.562  -1.764  15.704
  942    H    LEU 120           HN       LEU 120  -5.488  -2.300  15.583
  943    HA   LEU 120           HA       LEU 120  -6.621  -3.913  17.565
  944   1HB   LEU 120          HB2       LEU 120  -7.964  -1.845  15.823
  945   2HB   LEU 120          HB1       LEU 120  -8.623  -2.499  17.310
  946    HG   LEU 120           HG       LEU 120  -6.117  -0.831  17.067
  947   1HD1  LEU 120          1HD1      LEU 120  -8.568   0.138  16.870
  948   2HD1  LEU 120          2HD1      LEU 120  -7.309   0.974  17.779
  949   3HD1  LEU 120          3HD1      LEU 120  -8.505  -0.007  18.626
  950   1HD2  LEU 120          1HD2      LEU 120  -7.447  -2.119  19.443
  951   2HD2  LEU 120          2HD2      LEU 120  -6.257  -0.825  19.570
  952   3HD2  LEU 120          3HD2      LEU 120  -5.804  -2.372  18.855
  953    HA   PRO1135           HA       PRO1135  15.753  -7.874 -12.500
  954   1HB   PRO1135          HB2       PRO1135  14.396  -9.515 -10.818
  955   2HB   PRO1135          HB1       PRO1135  14.468  -9.778 -12.564
  956   1HG   PRO1135          HG2       PRO1135  16.055 -11.081 -10.385
  957   2HG   PRO1135          HG1       PRO1135  15.302 -11.816 -11.813
  958   1HD   PRO1135          HD2       PRO1135  17.946 -11.240 -11.692
  959   2HD   PRO1135          HD1       PRO1135  17.022 -11.176 -13.206
  960    H    GLN1136           HN       GLN1136  14.406  -7.305 -10.401
  961    HA   GLN1136           HA       GLN1136  15.647  -7.331  -7.884
  962   1HB   GLN1136          HB2       GLN1136  17.302  -5.884  -9.044
  963   2HB   GLN1136          HB1       GLN1136  16.017  -4.744  -9.410
  964   1HG   GLN1136          HG2       GLN1136  17.280  -3.956  -7.535
  965   2HG   GLN1136          HG1       GLN1136  15.662  -4.397  -7.008
  966    HA   PRO1137           HA       PRO1137  11.319  -5.616  -8.168
  967   1HB   PRO1137          HB2       PRO1137   9.854  -7.795  -7.733
  968   2HB   PRO1137          HB1       PRO1137  10.540  -7.471  -9.331
  969   1HG   PRO1137          HG2       PRO1137  11.471  -9.365  -7.216
  970   2HG   PRO1137          HG1       PRO1137  11.427  -9.581  -8.974
  971   1HD   PRO1137          HD2       PRO1137  13.669  -8.850  -7.487
  972   2HD   PRO1137          HD1       PRO1137  13.480  -8.638  -9.238
  973    H    GLU1138           HN       GLU1138  10.681  -4.609  -6.368
  974    HA   GLU1138           HA       GLU1138  10.625  -6.087  -3.836
  975   1HB   GLU1138          HB2       GLU1138  11.828  -3.350  -4.241
  976   2HB   GLU1138          HB1       GLU1138  11.360  -3.968  -2.671
  977   1HG   GLU1138          HG2       GLU1138  13.713  -4.233  -2.984
  978   2HG   GLU1138          HG1       GLU1138  12.941  -5.816  -2.936
  979   2HN   PTR1139          HN        PTR1139   9.752  -2.985  -5.373
  980   2HN   PTR1139          HN        PTR1139   9.752  -2.985  -5.373
  981    HA   PTR1139           HA       PTR1139   7.410  -2.881  -3.692
  982    HA   PTR1139           HA       PTR1139   7.410  -2.881  -3.692
  983   1HB   PTR1139          HB1       PTR1139   7.219  -0.576  -4.951
  984   1HB   PTR1139          HB1       PTR1139   7.219  -0.576  -4.951
  985   2HB   PTR1139          HB2       PTR1139   8.911  -0.889  -5.270
  986   2HB   PTR1139          HB2       PTR1139   8.911  -0.889  -5.270
  987    HD1  PTR1139           HD1      PTR1139   6.431  -0.055  -2.779
  988    HD1  PTR1139           HD1      PTR1139   6.431  -0.055  -2.779
  989    HD2  PTR1139           HD2      PTR1139  10.545  -0.931  -3.373
  990    HD2  PTR1139           HD2      PTR1139  10.545  -0.931  -3.373
  991    HE1  PTR1139           HE1      PTR1139   6.943   0.849  -0.559
  992    HE1  PTR1139           HE1      PTR1139   6.943   0.849  -0.559
  993    HE2  PTR1139           HE2      PTR1139  11.057   0.007  -1.111
  994    HE2  PTR1139           HE2      PTR1139  11.057   0.007  -1.111
  995    H    VAL1140           HN       VAL1140   6.499  -1.061  -6.212
  996    HA   VAL1140           HA       VAL1140   5.267  -3.312  -7.631
  997    HB   VAL1140           HB       VAL1140   3.114  -2.067  -7.853
  998   1HG1  VAL1140          1HG1      VAL1140   2.729  -2.464  -5.175
  999   2HG1  VAL1140          2HG1      VAL1140   4.111  -3.490  -5.544
 1000   3HG1  VAL1140          3HG1      VAL1140   2.601  -3.687  -6.437
 1001   1HG2  VAL1140          1HG2      VAL1140   2.658  -0.465  -5.921
 1002   2HG2  VAL1140          2HG2      VAL1140   3.512   0.138  -7.330
 1003   3HG2  VAL1140          3HG2      VAL1140   4.408  -0.271  -5.863
 1004    H    ASN1141           HN       ASN1141   4.781   0.262  -8.191
 1005    HA   ASN1141           HA       ASN1141   4.883   0.178 -10.924
 1006   1HB   ASN1141          HB2       ASN1141   6.757   2.077  -9.473
 1007   2HB   ASN1141          HB1       ASN1141   5.975   2.325 -11.016
 1008   1HD2  ASN1141          1HD2      ASN1141   4.806   1.551  -7.740
 1009   2HD2  ASN1141          2HD2      ASN1141   3.767   2.908  -7.580
 1010    H    GLN1142           HN       GLN1142   7.233  -0.027  -8.441
 1011    HA   GLN1142           HA       GLN1142   8.541  -2.228  -8.958
 1012   1HB   GLN1142          HB2       GLN1142  10.614  -1.728 -10.057
 1013   2HB   GLN1142          HB1       GLN1142   9.302  -1.296 -11.130
 1014   1HG   GLN1142          HG2       GLN1142  10.952   0.600  -9.476
 1015   2HG   GLN1142          HG1       GLN1142  11.047   0.378 -11.222
 1016    HA   PRO1143           HA       PRO1143  10.566  -0.955  -5.274
 1017   1HB   PRO1143          HB2       PRO1143  13.356  -0.763  -6.254
 1018   2HB   PRO1143          HB1       PRO1143  12.685  -1.804  -4.995
 1019   1HG   PRO1143          HG2       PRO1143  13.432  -2.758  -7.402
 1020   2HG   PRO1143          HG1       PRO1143  12.079  -3.442  -6.489
 1021   1HD   PRO1143          HD2       PRO1143  12.050  -1.631  -8.858
 1022   2HD   PRO1143          HD1       PRO1143  10.941  -2.952  -8.434
 1023    H    ASP1144           HN       ASP1144   9.471   1.054  -6.375
 1024    HA   ASP1144           HA       ASP1144   9.421   3.227  -6.967
 1025   1HB   ASP1144          HB2       ASP1144  10.179   4.679  -5.102
 1026   2HB   ASP1144          HB1       ASP1144   9.273   3.278  -4.540
  Start of MODEL    8
    1   1H    GLY   1          HT1       GLY   1  22.110   8.215  -6.794
    2   2H    GLY   1          HT2       GLY   1  23.485   7.241  -6.939
    3   3H    GLY   1          HT3       GLY   1  23.644   8.924  -6.881
    4   1HA   GLY   1          HA1       GLY   1  23.299   7.017  -4.730
    5   2HA   GLY   1          HA2       GLY   1  24.113   8.574  -4.728
    6    H    SER   2           HN       SER   2  21.188   6.877  -4.086
    7    HA   SER   2           HA       SER   2  20.168   9.186  -2.670
    8   1HB   SER   2          HB2       SER   2  19.143   9.593  -4.792
    9   2HB   SER   2          HB1       SER   2  18.635   7.916  -4.943
   10    HG   SER   2           HG       SER   2  17.679   9.873  -3.136
   11    HA   PRO   3           HA       PRO   3  17.452   5.359  -1.387
   12   1HB   PRO   3          HB2       PRO   3  18.283   2.961  -2.474
   13   2HB   PRO   3          HB1       PRO   3  16.923   3.916  -3.072
   14   1HG   PRO   3          HG2       PRO   3  19.740   3.796  -4.072
   15   2HG   PRO   3          HG1       PRO   3  18.225   3.847  -4.992
   16   1HD   PRO   3          HD2       PRO   3  19.732   6.031  -4.701
   17   2HD   PRO   3          HD1       PRO   3  17.960   6.132  -4.668
   18    H    ALA   4           HN       ALA   4  18.045   4.766   0.596
   19    HA   ALA   4           HA       ALA   4  20.528   3.320   1.029
   20   1HB   ALA   4          HB1       ALA   4  21.583   5.288   1.435
   21   2HB   ALA   4          HB2       ALA   4  20.870   5.048   3.030
   22   3HB   ALA   4          HB3       ALA   4  20.093   6.125   1.871
   23    H    SER   5           HN       SER   5  20.734   2.671   3.380
   24    HA   SER   5           HA       SER   5  18.234   2.595   4.857
   25   1HB   SER   5          HB2       SER   5  18.252   0.130   5.046
   26   2HB   SER   5          HB1       SER   5  18.018   0.658   3.381
   27    HG   SER   5           HG       SER   5  19.681  -0.535   2.943
   28    H    GLY   6           HN       GLY   6  18.681   2.927   6.930
   29   1HA   GLY   6          HA2       GLY   6  20.264   1.602   8.641
   30   2HA   GLY   6          HA1       GLY   6  21.418   2.676   7.866
   31    H    THR   7           HN       THR   7  18.104   2.978   9.156
   32    HA   THR   7           HA       THR   7  19.017   4.991  11.042
   33    HB   THR   7           HB       THR   7  16.930   5.605   8.939
   34    HG1  THR   7           HG1      THR   7  19.062   5.806   8.183
   35   1HG2  THR   7          1HG2      THR   7  16.223   6.730  10.885
   36   2HG2  THR   7          2HG2      THR   7  17.071   7.921   9.899
   37   3HG2  THR   7          3HG2      THR   7  17.871   7.203  11.297
   38    H    SER   8           HN       SER   8  17.259   5.652  12.543
   39    HA   SER   8           HA       SER   8  15.093   3.677  12.720
   40   1HB   SER   8          HB2       SER   8  16.923   4.478  14.997
   41   2HB   SER   8          HB1       SER   8  15.484   3.471  15.158
   42    HG   SER   8           HG       SER   8  16.582   2.095  13.516
   43    H    LEU   9           HN       LEU   9  13.283   4.824  12.581
   44    HA   LEU   9           HA       LEU   9  12.919   7.102  14.373
   45   1HB   LEU   9          HB2       LEU   9  12.339   7.213  11.412
   46   2HB   LEU   9          HB1       LEU   9  11.906   8.450  12.577
   47    HG   LEU   9           HG       LEU   9  14.715   7.631  11.832
   48   1HD1  LEU   9          1HD1      LEU   9  13.060   9.123  10.333
   49   2HD1  LEU   9          2HD1      LEU   9  14.804   9.377  10.407
   50   3HD1  LEU   9          3HD1      LEU   9  13.725  10.371  11.387
   51   1HD2  LEU   9          1HD2      LEU   9  13.730   8.902  14.173
   52   2HD2  LEU   9          2HD2      LEU   9  14.589  10.108  13.216
   53   3HD2  LEU   9          3HD2      LEU   9  15.404   8.620  13.694
   54    H    SER  10           HN       SER  10  10.561   7.839  14.316
   55    HA   SER  10           HA       SER  10   8.673   5.767  13.556
   56   1HB   SER  10          HB2       SER  10   9.385   5.040  15.784
   57   2HB   SER  10          HB1       SER  10   9.004   6.632  16.439
   58    HG   SER  10           HG       SER  10   7.361   4.532  15.950
   59    H    ALA  11           HN       ALA  11   6.503   6.473  13.512
   60    HA   ALA  11           HA       ALA  11   5.922   9.235  14.210
   61   1HB   ALA  11          HB1       ALA  11   6.543   9.856  12.111
   62   2HB   ALA  11          HB2       ALA  11   4.881   9.375  11.771
   63   3HB   ALA  11          HB3       ALA  11   6.209   8.269  11.421
   64    H    ALA  12           HN       ALA  12   3.715   9.671  14.427
   65    HA   ALA  12           HA       ALA  12   1.793   7.589  13.781
   66   1HB   ALA  12          HB1       ALA  12   1.987   8.538  16.628
   67   2HB   ALA  12          HB2       ALA  12   2.767   7.064  16.055
   68   3HB   ALA  12          HB3       ALA  12   1.011   7.220  15.979
   69    H    ILE  13           HN       ILE  13   1.366   9.527  12.365
   70    HA   ILE  13           HA       ILE  13   0.137  11.817  13.609
   71    HB   ILE  13           HB       ILE  13   1.395  12.046  11.507
   72   1HG1  ILE  13          2HG1      ILE  13  -1.546  12.714  11.240
   73   2HG1  ILE  13          1HG1      ILE  13  -0.341  13.692  12.068
   74   1HG2  ILE  13          1HG2      ILE  13  -0.782  10.927   9.865
   75   2HG2  ILE  13          2HG2      ILE  13   0.231   9.759  10.713
   76   3HG2  ILE  13          3HG2      ILE  13   0.962  10.919   9.603
   77   1HD1  ILE  13          1HD1      ILE  13   0.401  14.590  10.165
   78   2HD1  ILE  13          2HD1      ILE  13  -1.129  14.026   9.495
   79   3HD1  ILE  13          3HD1      ILE  13   0.331  13.057   9.296
   80    H    HIS  14           HN       HIS  14  -1.345  10.100  14.735
   81    HA   HIS  14           HA       HIS  14  -3.786   9.792  13.105
   82   1HB   HIS  14          HB2       HIS  14  -2.892   8.106  15.453
   83   2HB   HIS  14          HB1       HIS  14  -4.376   7.883  14.533
   84    HD1  HIS  14           HD1      HIS  14  -0.718   8.194  13.526
   85    HD2  HIS  14           HD2      HIS  14  -4.031   5.777  12.888
   86    HE1  HIS  14           HE1      HIS  14   0.052   6.416  11.934
   87    HE2  HIS  14           HE2      HIS  14  -1.929   4.881  11.677
   88    H    ARG  15           HN       ARG  15  -5.677  10.612  13.884
   89    HA   ARG  15           HA       ARG  15  -5.602  11.765  16.577
   90   1HB   ARG  15          HB2       ARG  15  -7.076  13.585  15.758
   91   2HB   ARG  15          HB1       ARG  15  -5.485  13.580  15.002
   92   1HG   ARG  15          HG2       ARG  15  -6.384  12.562  13.004
   93   2HG   ARG  15          HG1       ARG  15  -7.964  12.384  13.764
   94   1HD   ARG  15          HD2       ARG  15  -6.589  14.955  12.960
   95   2HD   ARG  15          HD1       ARG  15  -8.056  14.256  12.284
   96    HE   ARG  15           HE       ARG  15  -8.509  14.667  14.998
   97   1HH1  ARG  15          HH11      ARG  15  -7.901  16.559  12.129
   98   2HH1  ARG  15          HH12      ARG  15  -8.793  17.931  12.693
   99   1HH2  ARG  15          HH21      ARG  15  -9.683  16.472  15.742
  100   2HH2  ARG  15          HH22      ARG  15  -9.806  17.882  14.744
  101    H    THR  16           HN       THR  16  -6.901   9.452  14.834
  102    HA   THR  16           HA       THR  16  -9.244   9.272  16.557
  103    HB   THR  16           HB       THR  16 -10.685   8.579  14.670
  104    HG1  THR  16           HG1      THR  16  -8.558   9.474  13.026
  105   1HG2  THR  16          1HG2      THR  16  -9.577  11.231  13.874
  106   2HG2  THR  16          2HG2      THR  16 -10.413  11.038  15.415
  107   3HG2  THR  16          3HG2      THR  16 -11.249  10.674  13.906
  108    H    GLN  17           HN       GLN  17  -8.823   7.226  13.770
  109    HA   GLN  17           HA       GLN  17  -7.400   5.180  15.244
  110   1HB   GLN  17          HB2       GLN  17  -9.167   3.469  14.729
  111   2HB   GLN  17          HB1       GLN  17  -9.621   4.649  15.950
  112   1HG   GLN  17          HG2       GLN  17 -11.483   4.257  14.498
  113   2HG   GLN  17          HG1       GLN  17 -10.883   5.892  14.234
  114    H    LEU  18           HN       LEU  18  -6.938   6.836  12.913
  115    HA   LEU  18           HA       LEU  18  -7.362   5.673  10.460
  116   1HB   LEU  18          HB2       LEU  18  -4.764   6.973  11.255
  117   2HB   LEU  18          HB1       LEU  18  -5.480   6.908   9.657
  118    HG   LEU  18           HG       LEU  18  -6.480   8.501  12.015
  119   1HD1  LEU  18          1HD1      LEU  18  -6.093  10.357  10.264
  120   2HD1  LEU  18          2HD1      LEU  18  -5.051   9.173   9.477
  121   3HD1  LEU  18          3HD1      LEU  18  -4.707   9.692  11.127
  122   1HD2  LEU  18          1HD2      LEU  18  -7.643   8.553   9.251
  123   2HD2  LEU  18          2HD2      LEU  18  -8.312   9.203  10.749
  124   3HD2  LEU  18          3HD2      LEU  18  -8.251   7.459  10.495
  125    H    TRP  19           HN       TRP  19  -5.931   4.470   9.056
  126    HA   TRP  19           HA       TRP  19  -4.379   2.443  10.521
  127   1HB   TRP  19          HB2       TRP  19  -4.842   1.179   8.211
  128   2HB   TRP  19          HB1       TRP  19  -5.955   1.104   9.568
  129    HD1  TRP  19           HD1      TRP  19  -8.298   1.104   8.606
  130    HE1  TRP  19           HE1      TRP  19  -9.585   2.453   6.837
  131    HE3  TRP  19           HE3      TRP  19  -4.480   4.040   6.858
  132    HZ2  TRP  19           HZ2      TRP  19  -9.062   4.483   4.958
  133    HZ3  TRP  19           HZ3      TRP  19  -4.964   5.655   5.075
  134    HH2  TRP  19           HH2      TRP  19  -7.209   5.872   4.143
  135    H    PHE  20           HN       PHE  20  -3.037   4.666  10.050
  136    HA   PHE  20           HA       PHE  20  -1.438   4.170   7.636
  137   1HB   PHE  20          HB2       PHE  20  -2.432   6.368   7.613
  138   2HB   PHE  20          HB1       PHE  20  -1.853   6.697   9.242
  139    HD1  PHE  20           HD1      PHE  20  -0.240   5.440   6.112
  140    HD2  PHE  20           HD2      PHE  20  -0.244   8.317   9.244
  141    HE1  PHE  20           HE1      PHE  20   1.803   6.445   5.183
  142    HE2  PHE  20           HE2      PHE  20   1.799   9.331   8.320
  143    HZ   PHE  20           HZ       PHE  20   2.824   8.395   6.286
  144    H    HIS  21           HN       HIS  21   0.703   3.849   7.752
  145    HA   HIS  21           HA       HIS  21   2.086   4.176  10.312
  146   1HB   HIS  21          HB2       HIS  21   1.363   1.866  10.352
  147   2HB   HIS  21          HB1       HIS  21   1.962   1.599   8.724
  148    HD1  HIS  21           HD1      HIS  21   4.671   1.740   8.500
  149    HD2  HIS  21           HD2      HIS  21   3.122   1.266  12.326
  150    HE1  HIS  21           HE1      HIS  21   6.591   0.931   9.907
  151    HE2  HIS  21           HE2      HIS  21   5.653   0.750  12.239
  152    H    GLY  22           HN       GLY  22   4.581   3.762   9.919
  153   1HA   GLY  22          HA2       GLY  22   5.222   5.198   7.456
  154   2HA   GLY  22          HA1       GLY  22   6.253   5.060   8.872
  155    H    ARG  23           HN       ARG  23   8.052   3.982   8.346
  156    HA   ARG  23           HA       ARG  23   8.112   2.146   6.161
  157   1HB   ARG  23          HB2       ARG  23  10.046   3.512   6.629
  158   2HB   ARG  23          HB1       ARG  23  10.210   2.801   8.225
  159   1HG   ARG  23          HG2       ARG  23  10.656   0.619   7.172
  160   2HG   ARG  23          HG1       ARG  23  10.560   1.389   5.588
  161   1HD   ARG  23          HD2       ARG  23  12.878   1.129   6.313
  162   2HD   ARG  23          HD1       ARG  23  12.438   2.830   6.162
  163    HE   ARG  23           HE       ARG  23  12.005   2.051   8.808
  164   1HH1  ARG  23          HH11      ARG  23  14.663   2.500   6.593
  165   2HH1  ARG  23          HH12      ARG  23  15.799   2.892   7.841
  166   1HH2  ARG  23          HH21      ARG  23  13.493   2.567  10.447
  167   2HH2  ARG  23          HH22      ARG  23  15.134   2.931  10.029
  168    H    ILE  24           HN       ILE  24   6.906   0.365   6.501
  169    HA   ILE  24           HA       ILE  24   7.709  -1.362   8.757
  170    HB   ILE  24           HB       ILE  24   5.272  -0.841   8.705
  171   1HG1  ILE  24          2HG1      ILE  24   5.979  -3.719   8.085
  172   2HG1  ILE  24          1HG1      ILE  24   6.073  -2.954   9.668
  173   1HG2  ILE  24          1HG2      ILE  24   5.180  -2.432   6.153
  174   2HG2  ILE  24          2HG2      ILE  24   5.170  -0.670   6.204
  175   3HG2  ILE  24          3HG2      ILE  24   3.857  -1.579   6.950
  176   1HD1  ILE  24          1HD1      ILE  24   4.040  -3.804   9.983
  177   2HD1  ILE  24          2HD1      ILE  24   3.785  -4.075   8.259
  178   3HD1  ILE  24          3HD1      ILE  24   3.481  -2.483   8.956
  179    H    SER  25           HN       SER  25   9.081  -2.916   8.161
  180    HA   SER  25           HA       SER  25  10.207  -3.431   5.814
  181   1HB   SER  25          HB2       SER  25  10.810  -4.611   7.885
  182   2HB   SER  25          HB1       SER  25   9.371  -5.618   7.729
  183    HG   SER  25           HG       SER  25  11.387  -5.463   5.745
  184    H    ARG  26           HN       ARG  26   8.669  -3.018   4.148
  185    HA   ARG  26           HA       ARG  26   6.337  -4.346   3.619
  186   1HB   ARG  26          HB2       ARG  26   6.675  -3.815   1.243
  187   2HB   ARG  26          HB1       ARG  26   7.084  -2.449   2.263
  188   1HG   ARG  26          HG2       ARG  26   9.092  -4.348   1.064
  189   2HG   ARG  26          HG1       ARG  26   8.628  -2.798   0.368
  190   1HD   ARG  26          HD2       ARG  26   9.280  -1.830   2.668
  191   2HD   ARG  26          HD1       ARG  26  10.130  -3.357   2.895
  192    HE   ARG  26           HE       ARG  26  10.899  -2.320   0.425
  193   1HH1  ARG  26          HH11      ARG  26  11.190  -1.545   3.819
  194   2HH1  ARG  26          HH12      ARG  26  12.666  -0.661   3.618
  195   1HH2  ARG  26          HH21      ARG  26  12.832  -1.144   0.162
  196   2HH2  ARG  26          HH22      ARG  26  13.597  -0.433   1.545
  197    H    GLU  27           HN       GLU  27   9.601  -5.374   2.640
  198    HA   GLU  27           HA       GLU  27   8.838  -7.704   1.290
  199   1HB   GLU  27          HB2       GLU  27  11.164  -8.439   1.611
  200   2HB   GLU  27          HB1       GLU  27  11.067  -6.768   1.071
  201   1HG   GLU  27          HG2       GLU  27  11.435  -6.012   3.370
  202   2HG   GLU  27          HG1       GLU  27  11.557  -7.692   3.892
  203    H    GLU  28           HN       GLU  28   9.757  -7.245   4.701
  204    HA   GLU  28           HA       GLU  28   9.354 -10.019   5.331
  205   1HB   GLU  28          HB2       GLU  28   9.675  -7.638   7.163
  206   2HB   GLU  28          HB1       GLU  28   9.721  -9.321   7.663
  207   1HG   GLU  28          HG2       GLU  28  11.666  -7.971   5.806
  208   2HG   GLU  28          HG1       GLU  28  11.955  -8.399   7.492
  209    H    SER  29           HN       SER  29   7.355  -7.216   5.187
  210    HA   SER  29           HA       SER  29   5.381  -7.942   7.058
  211   1HB   SER  29          HB2       SER  29   5.500  -5.681   6.174
  212   2HB   SER  29          HB1       SER  29   5.172  -6.270   4.545
  213    HG   SER  29           HG       SER  29   3.118  -6.951   5.298
  214    H    GLN  30           HN       GLN  30   5.975  -8.873   3.750
  215    HA   GLN  30           HA       GLN  30   3.488  -9.979   3.125
  216   1HB   GLN  30          HB2       GLN  30   6.162 -10.988   2.164
  217   2HB   GLN  30          HB1       GLN  30   4.609 -11.169   1.360
  218   1HG   GLN  30          HG2       GLN  30   4.493  -8.755   1.032
  219   2HG   GLN  30          HG1       GLN  30   6.062  -8.579   1.814
  220    H    ARG  31           HN       ARG  31   6.114 -11.207   5.050
  221    HA   ARG  31           HA       ARG  31   5.132 -13.902   5.119
  222   1HB   ARG  31          HB2       ARG  31   7.506 -13.425   5.462
  223   2HB   ARG  31          HB1       ARG  31   7.125 -12.476   6.890
  224   1HG   ARG  31          HG2       ARG  31   7.948 -14.616   7.572
  225   2HG   ARG  31          HG1       ARG  31   6.231 -14.519   7.960
  226   1HD   ARG  31          HD2       ARG  31   7.288 -15.808   5.453
  227   2HD   ARG  31          HD1       ARG  31   7.014 -16.695   6.951
  228    HE   ARG  31           HE       ARG  31   4.658 -15.353   6.343
  229   1HH1  ARG  31          HH11      ARG  31   6.643 -17.869   4.965
  230   2HH1  ARG  31          HH12      ARG  31   5.313 -18.672   4.200
  231   1HH2  ARG  31          HH21      ARG  31   2.908 -16.407   5.339
  232   2HH2  ARG  31          HH22      ARG  31   3.192 -17.842   4.412
  233    H    LEU  32           HN       LEU  32   4.897 -11.048   7.181
  234    HA   LEU  32           HA       LEU  32   3.505 -12.399   9.291
  235   1HB   LEU  32          HB2       LEU  32   3.762  -9.454   8.700
  236   2HB   LEU  32          HB1       LEU  32   3.225 -10.157  10.215
  237    HG   LEU  32           HG       LEU  32   5.920 -10.903   9.174
  238   1HD1  LEU  32          1HD1      LEU  32   6.848  -8.944  10.410
  239   2HD1  LEU  32          2HD1      LEU  32   5.211  -8.289  10.485
  240   3HD1  LEU  32          3HD1      LEU  32   5.990  -8.542   8.921
  241   1HD2  LEU  32          1HD2      LEU  32   5.242 -12.063  11.117
  242   2HD2  LEU  32          2HD2      LEU  32   4.628 -10.592  11.873
  243   3HD2  LEU  32          3HD2      LEU  32   6.365 -10.818  11.665
  244    H    ILE  33           HN       ILE  33   2.440  -9.745   7.153
  245    HA   ILE  33           HA       ILE  33  -0.320 -10.198   7.723
  246    HB   ILE  33           HB       ILE  33   0.992  -8.512   5.581
  247   1HG1  ILE  33          2HG1      ILE  33   0.270  -6.636   7.079
  248   2HG1  ILE  33          1HG1      ILE  33  -0.211  -7.833   8.275
  249   1HG2  ILE  33          1HG2      ILE  33  -1.830  -9.143   6.102
  250   2HG2  ILE  33          2HG2      ILE  33  -1.050  -8.548   4.638
  251   3HG2  ILE  33          3HG2      ILE  33  -1.470  -7.426   5.931
  252   1HD1  ILE  33          1HD1      ILE  33   2.066  -6.685   8.516
  253   2HD1  ILE  33          2HD1      ILE  33   2.583  -7.758   7.217
  254   3HD1  ILE  33          3HD1      ILE  33   1.981  -8.433   8.731
  255    H    GLY  34           HN       GLY  34   1.795 -11.920   5.784
  256   1HA   GLY  34          HA2       GLY  34  -0.259 -12.559   3.793
  257   2HA   GLY  34          HA1       GLY  34   1.428 -13.050   3.727
  258    H    GLN  35           HN       GLN  35  -0.243 -13.319   6.687
  259    HA   GLN  35           HA       GLN  35  -0.319 -16.232   6.420
  260   1HB   GLN  35          HB2       GLN  35  -0.335 -16.334   8.828
  261   2HB   GLN  35          HB1       GLN  35   0.962 -15.251   8.345
  262   1HG   GLN  35          HG2       GLN  35  -0.041 -14.184  10.151
  263   2HG   GLN  35          HG1       GLN  35  -0.704 -13.360   8.740
  264    H    GLN  36           HN       GLN  36  -2.193 -13.406   6.314
  265    HA   GLN  36           HA       GLN  36  -4.579 -14.234   7.521
  266   1HB   GLN  36          HB2       GLN  36  -3.755 -12.112   5.701
  267   2HB   GLN  36          HB1       GLN  36  -5.405 -12.655   5.410
  268   1HG   GLN  36          HG2       GLN  36  -6.163 -11.723   7.284
  269   2HG   GLN  36          HG1       GLN  36  -4.798 -12.310   8.232
  270    H    GLY  37           HN       GLY  37  -6.659 -14.415   5.966
  271   1HA   GLY  37          HA2       GLY  37  -6.035 -16.460   3.926
  272   2HA   GLY  37          HA1       GLY  37  -7.310 -16.713   5.114
  273    H    LEU  38           HN       LEU  38  -7.259 -13.482   4.314
  274    HA   LEU  38           HA       LEU  38  -9.682 -13.746   2.790
  275   1HB   LEU  38          HB2       LEU  38  -8.115 -11.311   3.620
  276   2HB   LEU  38          HB1       LEU  38  -9.665 -11.267   2.804
  277    HG   LEU  38           HG       LEU  38  -9.975 -10.868   5.167
  278   1HD1  LEU  38          1HD1      LEU  38 -11.449 -12.543   3.697
  279   2HD1  LEU  38          2HD1      LEU  38 -11.821 -12.153   5.377
  280   3HD1  LEU  38          3HD1      LEU  38 -10.966 -13.645   4.986
  281   1HD2  LEU  38          1HD2      LEU  38  -9.272 -12.308   6.877
  282   2HD2  LEU  38          2HD2      LEU  38  -7.881 -12.175   5.802
  283   3HD2  LEU  38          3HD2      LEU  38  -8.902 -13.612   5.748
  284    H    VAL  39           HN       VAL  39  -9.985 -12.301   0.854
  285    HA   VAL  39           HA       VAL  39  -8.084 -13.049  -1.164
  286    HB   VAL  39           HB       VAL  39  -9.674 -11.997  -2.729
  287   1HG1  VAL  39          1HG1      VAL  39 -10.306 -14.168  -2.542
  288   2HG1  VAL  39          2HG1      VAL  39 -11.731 -13.436  -1.803
  289   3HG1  VAL  39          3HG1      VAL  39 -10.447 -14.090  -0.786
  290   1HG2  VAL  39          1HG2      VAL  39 -10.900 -10.307  -1.937
  291   2HG2  VAL  39          2HG2      VAL  39 -10.596 -10.777  -0.261
  292   3HG2  VAL  39          3HG2      VAL  39 -11.919 -11.522  -1.163
  293    H    ASP  40           HN       ASP  40  -7.907 -11.224  -2.992
  294    HA   ASP  40           HA       ASP  40  -6.033  -9.345  -2.005
  295   1HB   ASP  40          HB2       ASP  40  -7.524  -9.245  -4.636
  296   2HB   ASP  40          HB1       ASP  40  -5.984  -8.480  -4.266
  297    H    GLY  41           HN       GLY  41  -8.054  -8.950  -0.388
  298   1HA   GLY  41          HA2       GLY  41  -9.130  -6.326  -1.274
  299   2HA   GLY  41          HA1       GLY  41 -10.178  -7.500  -0.489
  300    H    LEU  42           HN       LEU  42  -7.409  -7.994   1.064
  301    HA   LEU  42           HA       LEU  42  -8.162  -6.096   3.149
  302   1HB   LEU  42          HB2       LEU  42  -6.537  -8.634   3.209
  303   2HB   LEU  42          HB1       LEU  42  -6.671  -7.559   4.584
  304    HG   LEU  42           HG       LEU  42  -8.193  -9.617   4.531
  305   1HD1  LEU  42          1HD1      LEU  42  -9.978  -7.303   4.809
  306   2HD1  LEU  42          2HD1      LEU  42  -8.467  -7.198   5.711
  307   3HD1  LEU  42          3HD1      LEU  42  -9.554  -8.561   5.970
  308   1HD2  LEU  42          1HD2      LEU  42 -10.230  -9.467   3.271
  309   2HD2  LEU  42          2HD2      LEU  42  -8.863  -9.356   2.162
  310   3HD2  LEU  42          3HD2      LEU  42  -9.755  -7.902   2.612
  311    H    PHE  43           HN       PHE  43  -7.266  -4.267   2.580
  312    HA   PHE  43           HA       PHE  43  -4.360  -4.209   2.072
  313   1HB   PHE  43          HB2       PHE  43  -4.733  -2.194   0.795
  314   2HB   PHE  43          HB1       PHE  43  -5.873  -3.420   0.241
  315    HD1  PHE  43           HD1      PHE  43  -5.585  -0.508   2.539
  316    HD2  PHE  43           HD2      PHE  43  -8.137  -2.937   0.158
  317    HE1  PHE  43           HE1      PHE  43  -7.450   1.032   2.978
  318    HE2  PHE  43           HE2      PHE  43 -10.009  -1.398   0.594
  319    HZ   PHE  43           HZ       PHE  43  -9.667   0.589   2.002
  320    H    LEU  44           HN       LEU  44  -3.236  -2.231   2.728
  321    HA   LEU  44           HA       LEU  44  -4.347  -0.807   5.028
  322   1HB   LEU  44          HB2       LEU  44  -3.011  -2.717   5.912
  323   2HB   LEU  44          HB1       LEU  44  -1.617  -2.110   5.042
  324    HG   LEU  44           HG       LEU  44  -1.740  -0.016   6.406
  325   1HD1  LEU  44          1HD1      LEU  44  -3.127   0.093   8.336
  326   2HD1  LEU  44          2HD1      LEU  44  -3.702  -1.556   8.091
  327   3HD1  LEU  44          3HD1      LEU  44  -4.163  -0.283   6.960
  328   1HD2  LEU  44          1HD2      LEU  44  -1.162  -1.325   8.618
  329   2HD2  LEU  44          2HD2      LEU  44  -0.102  -1.397   7.210
  330   3HD2  LEU  44          3HD2      LEU  44  -1.221  -2.720   7.539
  331    H    VAL  45           HN       VAL  45  -2.991   1.199   5.504
  332    HA   VAL  45           HA       VAL  45  -1.554   2.032   3.056
  333    HB   VAL  45           HB       VAL  45  -3.416   3.737   4.717
  334   1HG1  VAL  45          1HG1      VAL  45  -2.827   5.192   2.491
  335   2HG1  VAL  45          2HG1      VAL  45  -1.278   4.414   2.819
  336   3HG1  VAL  45          3HG1      VAL  45  -2.049   5.401   4.059
  337   1HG2  VAL  45          1HG2      VAL  45  -4.670   3.896   2.569
  338   2HG2  VAL  45          2HG2      VAL  45  -4.643   2.274   3.263
  339   3HG2  VAL  45          3HG2      VAL  45  -3.591   2.669   1.902
  340    H    ARG  46           HN       ARG  46   0.484   1.938   3.655
  341    HA   ARG  46           HA       ARG  46   1.327   3.783   5.736
  342   1HB   ARG  46          HB2       ARG  46   2.294   2.290   7.107
  343   2HB   ARG  46          HB1       ARG  46   1.237   1.118   6.343
  344   1HG   ARG  46          HG2       ARG  46   4.088   1.692   5.583
  345   2HG   ARG  46          HG1       ARG  46   3.514   0.316   6.516
  346   1HD   ARG  46          HD2       ARG  46   2.163  -0.403   4.581
  347   2HD   ARG  46          HD1       ARG  46   2.825   0.938   3.646
  348    HE   ARG  46           HE       ARG  46   4.058  -1.539   4.070
  349   1HH1  ARG  46          HH11      ARG  46   4.801   1.847   3.958
  350   2HH1  ARG  46          HH12      ARG  46   6.487   1.602   3.690
  351   1HH2  ARG  46          HH21      ARG  46   6.284  -1.880   3.694
  352   2HH2  ARG  46          HH22      ARG  46   7.333  -0.518   3.525
  353    H    GLU  47           HN       GLU  47   3.871   4.029   5.548
  354    HA   GLU  47           HA       GLU  47   4.562   3.623   2.746
  355   1HB   GLU  47          HB2       GLU  47   5.187   5.987   2.513
  356   2HB   GLU  47          HB1       GLU  47   3.475   5.746   2.766
  357   1HG   GLU  47          HG2       GLU  47   4.041   7.590   4.080
  358   2HG   GLU  47          HG1       GLU  47   3.907   6.242   5.205
  359    H    SER  48           HN       SER  48   6.789   5.379   2.713
  360    HA   SER  48           HA       SER  48   8.595   3.785   4.405
  361   1HB   SER  48          HB2       SER  48   8.855   3.505   1.936
  362   2HB   SER  48          HB1       SER  48   9.244   5.216   1.818
  363    HG   SER  48           HG       SER  48  10.678   3.452   3.496
  364    H    GLN  49           HN       GLN  49   9.768   4.781   5.883
  365    HA   GLN  49           HA       GLN  49   9.825   7.705   5.878
  366   1HB   GLN  49          HB2       GLN  49  10.270   7.606   8.227
  367   2HB   GLN  49          HB1       GLN  49   8.984   6.442   7.927
  368   1HG   GLN  49          HG2       GLN  49  10.472   5.430   9.438
  369   2HG   GLN  49          HG1       GLN  49  10.753   4.668   7.880
  370    H    ARG  50           HN       ARG  50  11.434   5.352   4.541
  371    HA   ARG  50           HA       ARG  50  14.122   6.411   5.058
  372   1HB   ARG  50          HB2       ARG  50  13.910   4.013   5.534
  373   2HB   ARG  50          HB1       ARG  50  13.279   3.736   3.918
  374   1HG   ARG  50          HG2       ARG  50  15.577   3.060   4.000
  375   2HG   ARG  50          HG1       ARG  50  15.436   4.494   2.983
  376   1HD   ARG  50          HD2       ARG  50  16.207   4.600   5.892
  377   2HD   ARG  50          HD1       ARG  50  17.384   4.460   4.589
  378    HE   ARG  50           HE       ARG  50  15.764   6.641   4.007
  379   1HH1  ARG  50          HH11      ARG  50  18.049   5.688   6.465
  380   2HH1  ARG  50          HH12      ARG  50  18.555   7.310   6.798
  381   1HH2  ARG  50          HH21      ARG  50  16.427   8.774   4.444
  382   2HH2  ARG  50          HH22      ARG  50  17.635   9.061   5.652
  383    H    ASN  51           HN       ASN  51  11.745   5.524   2.576
  384    HA   ASN  51           HA       ASN  51  13.461   6.424   0.436
  385   1HB   ASN  51          HB2       ASN  51  10.509   5.776   0.382
  386   2HB   ASN  51          HB1       ASN  51  11.579   5.916  -1.011
  387   1HD2  ASN  51          1HD2      ASN  51  13.519   4.557   1.192
  388   2HD2  ASN  51          2HD2      ASN  51  13.196   2.890   0.907
  389    HA   PRO  52           HA       PRO  52  12.801  10.826   1.169
  390   1HB   PRO  52          HB2       PRO  52  13.109  10.684  -1.810
  391   2HB   PRO  52          HB1       PRO  52  13.795  11.844  -0.670
  392   1HG   PRO  52          HG2       PRO  52  15.248   9.808  -1.632
  393   2HG   PRO  52          HG1       PRO  52  15.442  10.387   0.031
  394   1HD   PRO  52          HD2       PRO  52  14.254   7.874  -0.949
  395   2HD   PRO  52          HD1       PRO  52  14.902   8.265   0.655
  396    H    GLN  53           HN       GLN  53  11.167   8.941  -1.312
  397    HA   GLN  53           HA       GLN  53   8.749  10.573  -0.901
  398   1HB   GLN  53          HB2       GLN  53   9.469   9.132  -3.462
  399   2HB   GLN  53          HB1       GLN  53   8.081  10.163  -3.183
  400   1HG   GLN  53          HG2       GLN  53   9.544  11.481  -4.412
  401   2HG   GLN  53          HG1       GLN  53   9.736  12.034  -2.753
  402    H    GLY  54           HN       GLY  54   8.451   8.990   0.858
  403   1HA   GLY  54          HA2       GLY  54   7.821   6.283  -0.052
  404   2HA   GLY  54          HA1       GLY  54   8.064   6.781   1.609
  405    H    PHE  55           HN       PHE  55   5.842   6.219  -0.874
  406    HA   PHE  55           HA       PHE  55   3.580   6.496   0.933
  407   1HB   PHE  55          HB2       PHE  55   3.674   7.685  -1.862
  408   2HB   PHE  55          HB1       PHE  55   2.197   7.463  -0.933
  409    HD1  PHE  55           HD1      PHE  55   5.573   9.012  -0.539
  410    HD2  PHE  55           HD2      PHE  55   1.395   9.263   0.227
  411    HE1  PHE  55           HE1      PHE  55   5.904  11.207   0.519
  412    HE2  PHE  55           HE2      PHE  55   1.717  11.462   1.281
  413    HZ   PHE  55           HZ       PHE  55   3.974  12.438   1.429
  414    H    VAL  56           HN       VAL  56   2.855   4.454   1.046
  415    HA   VAL  56           HA       VAL  56   2.556   2.932  -1.442
  416    HB   VAL  56           HB       VAL  56   4.152   1.476  -0.864
  417   1HG1  VAL  56          1HG1      VAL  56   5.617   1.822   0.818
  418   2HG1  VAL  56          2HG1      VAL  56   4.351   2.013   2.027
  419   3HG1  VAL  56          3HG1      VAL  56   4.758   3.354   0.953
  420   1HG2  VAL  56          1HG2      VAL  56   2.400   0.835   1.502
  421   2HG2  VAL  56          2HG2      VAL  56   3.689  -0.183   0.870
  422   3HG2  VAL  56          3HG2      VAL  56   2.264   0.140  -0.114
  423    H    LEU  57           HN       LEU  57   1.070   1.299  -1.466
  424    HA   LEU  57           HA       LEU  57  -0.966   1.376   0.653
  425   1HB   LEU  57          HB2       LEU  57  -1.640   2.260  -1.657
  426   2HB   LEU  57          HB1       LEU  57  -1.446   0.616  -2.231
  427    HG   LEU  57           HG       LEU  57  -3.434   1.596  -0.186
  428   1HD1  LEU  57          1HD1      LEU  57  -3.512   1.057  -3.057
  429   2HD1  LEU  57          2HD1      LEU  57  -4.588   2.023  -2.050
  430   3HD1  LEU  57          3HD1      LEU  57  -4.799   0.275  -2.140
  431   1HD2  LEU  57          1HD2      LEU  57  -2.613  -1.173  -0.970
  432   2HD2  LEU  57          2HD2      LEU  57  -4.257  -0.835  -0.430
  433   3HD2  LEU  57          3HD2      LEU  57  -2.891  -0.504   0.638
  434    H    SER  58           HN       SER  58  -1.175  -0.544   1.689
  435    HA   SER  58           HA       SER  58   0.294  -2.821   0.585
  436   1HB   SER  58          HB2       SER  58  -0.876  -2.543   3.357
  437   2HB   SER  58          HB1       SER  58   0.340  -3.702   2.818
  438    HG   SER  58           HG       SER  58   0.733  -0.901   2.720
  439    H    LEU  59           HN       LEU  59  -0.628  -4.762   0.144
  440    HA   LEU  59           HA       LEU  59  -3.556  -4.897   0.383
  441   1HB   LEU  59          HB2       LEU  59  -1.786  -5.820  -1.876
  442   2HB   LEU  59          HB1       LEU  59  -3.506  -6.163  -1.764
  443    HG   LEU  59           HG       LEU  59  -2.598  -3.321  -1.605
  444   1HD1  LEU  59          1HD1      LEU  59  -1.823  -4.889  -3.750
  445   2HD1  LEU  59          2HD1      LEU  59  -1.935  -3.130  -3.708
  446   3HD1  LEU  59          3HD1      LEU  59  -3.290  -4.083  -4.306
  447   1HD2  LEU  59          1HD2      LEU  59  -4.816  -3.182  -1.411
  448   2HD2  LEU  59          2HD2      LEU  59  -5.070  -4.812  -2.032
  449   3HD2  LEU  59          3HD2      LEU  59  -4.845  -3.467  -3.151
  450    H    CYS  60           HN       CYS  60  -4.290  -7.326  -0.028
  451    HA   CYS  60           HA       CYS  60  -2.506  -9.215   1.227
  452   1HB   CYS  60          HB2       CYS  60  -3.865  -8.160   3.080
  453   2HB   CYS  60          HB1       CYS  60  -5.303  -8.787   2.282
  454    HG   CYS  60           HG       CYS  60  -3.890 -10.232   4.621
  455    H    HIS  61           HN       HIS  61  -2.431 -10.157  -0.687
  456    HA   HIS  61           HA       HIS  61  -4.850 -10.825  -2.061
  457   1HB   HIS  61          HB2       HIS  61  -3.350 -10.175  -3.555
  458   2HB   HIS  61          HB1       HIS  61  -1.989 -10.617  -2.570
  459    HD1  HIS  61           HD1      HIS  61  -4.604 -12.453  -4.680
  460    HD2  HIS  61           HD2      HIS  61  -0.568 -12.607  -3.739
  461    HE1  HIS  61           HE1      HIS  61  -3.664 -14.308  -6.082
  462    HE2  HIS  61           HE2      HIS  61  -1.198 -14.303  -5.584
  463    H    LEU  62           HN       LEU  62  -4.887 -13.254  -2.983
  464    HA   LEU  62           HA       LEU  62  -4.688 -14.861  -0.548
  465   1HB   LEU  62          HB2       LEU  62  -6.122 -16.518  -1.672
  466   2HB   LEU  62          HB1       LEU  62  -6.860 -14.940  -1.533
  467    HG   LEU  62           HG       LEU  62  -7.298 -16.150  -3.684
  468   1HD1  LEU  62          1HD1      LEU  62  -5.990 -13.806  -4.736
  469   2HD1  LEU  62          2HD1      LEU  62  -6.831 -13.460  -3.221
  470   3HD1  LEU  62          3HD1      LEU  62  -7.708 -14.173  -4.572
  471   1HD2  LEU  62          1HD2      LEU  62  -5.051 -17.113  -3.972
  472   2HD2  LEU  62          2HD2      LEU  62  -4.425 -15.496  -4.292
  473   3HD2  LEU  62          3HD2      LEU  62  -5.600 -16.218  -5.388
  474    H    GLN  63           HN       GLN  63  -2.430 -14.303  -1.534
  475    HA   GLN  63           HA       GLN  63  -1.402 -16.892  -1.630
  476   1HB   GLN  63          HB2       GLN  63  -0.563 -14.996  -3.833
  477   2HB   GLN  63          HB1       GLN  63   0.148 -16.566  -3.519
  478   1HG   GLN  63          HG2       GLN  63  -2.703 -16.100  -4.343
  479   2HG   GLN  63          HG1       GLN  63  -1.400 -16.573  -5.423
  480    H    LYS  64           HN       LYS  64  -0.938 -13.426  -1.704
  481    HA   LYS  64           HA       LYS  64   0.872 -13.668   0.528
  482   1HB   LYS  64          HB2       LYS  64   2.716 -12.430  -0.522
  483   2HB   LYS  64          HB1       LYS  64   2.400 -13.935  -1.370
  484   1HG   LYS  64          HG2       LYS  64   1.230 -12.765  -3.117
  485   2HG   LYS  64          HG1       LYS  64   1.385 -11.240  -2.245
  486   1HD   LYS  64          HD2       LYS  64   3.028 -11.412  -4.043
  487   2HD   LYS  64          HD1       LYS  64   3.812 -11.356  -2.463
  488   1HE   LYS  64          HE2       LYS  64   4.064 -13.793  -2.510
  489   2HE   LYS  64          HE1       LYS  64   3.285 -13.842  -4.090
  490   1HZ   LYS  64          HZ1       LYS  64   5.411 -13.771  -4.789
  491   2HZ   LYS  64          HZ2       LYS  64   5.985 -13.036  -3.377
  492   3HZ   LYS  64          HZ3       LYS  64   5.230 -12.102  -4.568
  493    H    VAL  65           HN       VAL  65   1.939 -11.059   0.327
  494    HA   VAL  65           HA       VAL  65  -0.352  -9.257   0.165
  495    HB   VAL  65           HB       VAL  65  -0.176  -8.353   2.253
  496   1HG1  VAL  65          1HG1      VAL  65   0.039 -11.147   2.306
  497   2HG1  VAL  65          2HG1      VAL  65  -0.653 -10.082   3.523
  498   3HG1  VAL  65          3HG1      VAL  65   1.047 -10.536   3.613
  499   1HG2  VAL  65          1HG2      VAL  65   2.080  -8.732   3.608
  500   2HG2  VAL  65          2HG2      VAL  65   1.863  -7.402   2.472
  501   3HG2  VAL  65          3HG2      VAL  65   2.724  -8.856   1.971
  502    H    LYS  66           HN       LYS  66   0.381  -7.046  -0.368
  503    HA   LYS  66           HA       LYS  66   3.233  -6.919  -1.028
  504   1HB   LYS  66          HB2       LYS  66   2.441  -5.837  -3.272
  505   2HB   LYS  66          HB1       LYS  66   2.534  -7.584  -3.100
  506   1HG   LYS  66          HG2       LYS  66   0.157  -7.718  -2.723
  507   2HG   LYS  66          HG1       LYS  66   0.023  -5.962  -2.759
  508   1HD   LYS  66          HD2       LYS  66  -0.686  -6.792  -4.884
  509   2HD   LYS  66          HD1       LYS  66   0.888  -6.028  -5.106
  510   1HE   LYS  66          HE2       LYS  66   0.524  -8.989  -4.695
  511   2HE   LYS  66          HE1       LYS  66   0.559  -8.230  -6.285
  512   1HZ   LYS  66          HZ1       LYS  66   2.724  -8.881  -4.532
  513   2HZ   LYS  66          HZ2       LYS  66   2.787  -7.270  -5.044
  514   3HZ   LYS  66          HZ3       LYS  66   2.746  -8.518  -6.184
  515    H    HIS  67           HN       HIS  67   3.736  -4.703  -2.076
  516    HA   HIS  67           HA       HIS  67   2.315  -2.547  -0.677
  517   1HB   HIS  67          HB2       HIS  67   5.307  -3.013  -0.679
  518   2HB   HIS  67          HB1       HIS  67   4.506  -1.594  -0.011
  519    HD1  HIS  67           HD1      HIS  67   3.380  -1.840   2.273
  520    HD2  HIS  67           HD2      HIS  67   4.939  -5.399   0.807
  521    HE1  HIS  67           HE1      HIS  67   3.224  -3.479   4.175
  522    HE2  HIS  67           HE2      HIS  67   3.991  -5.666   3.194
  523    H    TYR  68           HN       TYR  68   2.170  -0.648  -1.812
  524    HA   TYR  68           HA       TYR  68   3.545  -0.554  -4.418
  525   1HB   TYR  68          HB2       TYR  68   0.740   0.358  -3.761
  526   2HB   TYR  68          HB1       TYR  68   1.541   0.606  -5.305
  527    HD1  TYR  68           HD1      TYR  68   0.632  -0.704  -6.927
  528    HD2  TYR  68           HD2      TYR  68   1.093  -2.378  -3.053
  529    HE1  TYR  68           HE1      TYR  68  -0.298  -2.828  -7.745
  530    HE2  TYR  68           HE2      TYR  68   0.185  -4.509  -3.865
  531    HH   TYR  68           HH       TYR  68   0.027  -5.455  -6.837
  532    H    LEU  69           HN       LEU  69   5.211   0.801  -3.384
  533    HA   LEU  69           HA       LEU  69   4.284   3.581  -3.147
  534   1HB   LEU  69          HB2       LEU  69   4.891   3.340  -0.976
  535   2HB   LEU  69          HB1       LEU  69   6.065   2.105  -1.309
  536    HG   LEU  69           HG       LEU  69   6.769   4.504  -0.437
  537   1HD1  LEU  69          1HD1      LEU  69   8.597   3.223  -0.639
  538   2HD1  LEU  69          2HD1      LEU  69   8.861   4.180  -2.095
  539   3HD1  LEU  69          3HD1      LEU  69   8.119   2.587  -2.210
  540   1HD2  LEU  69          1HD2      LEU  69   5.671   5.316  -2.791
  541   2HD2  LEU  69          2HD2      LEU  69   7.369   5.156  -3.234
  542   3HD2  LEU  69          3HD2      LEU  69   6.905   6.199  -1.900
  543    H    ILE  70           HN       ILE  70   4.979   4.620  -4.832
  544    HA   ILE  70           HA       ILE  70   7.858   4.365  -5.342
  545    HB   ILE  70           HB       ILE  70   5.826   3.896  -7.503
  546   1HG1  ILE  70          2HG1      ILE  70   6.596   2.021  -5.990
  547   2HG1  ILE  70          1HG1      ILE  70   6.884   1.756  -7.696
  548   1HG2  ILE  70          1HG2      ILE  70   8.803   4.199  -7.844
  549   2HG2  ILE  70          2HG2      ILE  70   7.633   5.457  -8.243
  550   3HG2  ILE  70          3HG2      ILE  70   7.602   3.920  -9.101
  551   1HD1  ILE  70          1HD1      ILE  70   8.773   1.014  -6.637
  552   2HD1  ILE  70          2HD1      ILE  70   8.833   2.401  -5.548
  553   3HD1  ILE  70          3HD1      ILE  70   9.223   2.605  -7.261
  554    H    LEU  71           HN       LEU  71   4.947   6.103  -5.638
  555    HA   LEU  71           HA       LEU  71   6.554   8.536  -5.922
  556   1HB   LEU  71          HB2       LEU  71   4.099   8.097  -7.580
  557   2HB   LEU  71          HB1       LEU  71   5.172   9.475  -7.641
  558    HG   LEU  71           HG       LEU  71   6.951   7.639  -8.294
  559   1HD1  LEU  71          1HD1      LEU  71   5.405   5.756  -7.947
  560   2HD1  LEU  71          2HD1      LEU  71   6.003   5.837  -9.602
  561   3HD1  LEU  71          3HD1      LEU  71   4.370   6.388  -9.225
  562   1HD2  LEU  71          1HD2      LEU  71   6.069   9.593  -9.638
  563   2HD2  LEU  71          2HD2      LEU  71   4.905   8.468 -10.335
  564   3HD2  LEU  71          3HD2      LEU  71   6.635   8.202 -10.563
  565    HA   PRO  72           HA       PRO  72   3.689   9.940  -2.833
  566   1HB   PRO  72          HB2       PRO  72   4.799  12.304  -2.339
  567   2HB   PRO  72          HB1       PRO  72   5.682  10.815  -1.987
  568   1HG   PRO  72          HG2       PRO  72   5.968  12.683  -4.302
  569   2HG   PRO  72          HG1       PRO  72   7.227  11.864  -3.364
  570   1HD   PRO  72          HD2       PRO  72   6.227  11.003  -5.813
  571   2HD   PRO  72          HD1       PRO  72   7.103   9.986  -4.656
  572    H    SER  73           HN       SER  73   2.981  12.583  -2.460
  573    HA   SER  73           HA       SER  73   1.011  12.927  -4.517
  574   1HB   SER  73          HB2       SER  73   0.357  13.326  -2.221
  575   2HB   SER  73          HB1       SER  73   1.614  14.554  -2.042
  576    HG   SER  73           HG       SER  73  -0.846  14.936  -2.811
  577    H    GLU  74           HN       GLU  74   1.434  13.897  -6.366
  578    HA   GLU  74           HA       GLU  74   3.536  15.946  -6.462
  579   1HB   GLU  74          HB2       GLU  74   2.244  14.224  -8.554
  580   2HB   GLU  74          HB1       GLU  74   3.137  15.665  -9.006
  581   1HG   GLU  74          HG2       GLU  74   4.517  13.683  -9.191
  582   2HG   GLU  74          HG1       GLU  74   5.140  14.773  -7.955
  583    H    GLU  75           HN       GLU  75   3.051  17.665  -8.278
  584    HA   GLU  75           HA       GLU  75   0.519  18.905  -7.490
  585   1HB   GLU  75          HB2       GLU  75   2.901  20.074  -8.944
  586   2HB   GLU  75          HB1       GLU  75   1.477  20.972  -8.439
  587   1HG   GLU  75          HG2       GLU  75   3.398  19.568  -6.595
  588   2HG   GLU  75          HG1       GLU  75   3.374  21.298  -6.929
  589    H    GLU  76           HN       GLU  76   1.114  16.750  -9.567
  590    HA   GLU  76           HA       GLU  76  -0.321  18.001 -11.800
  591   1HB   GLU  76          HB2       GLU  76   1.845  17.149 -12.521
  592   2HB   GLU  76          HB1       GLU  76   1.510  15.588 -11.791
  593   1HG   GLU  76          HG2       GLU  76   1.229  15.498 -14.193
  594   2HG   GLU  76          HG1       GLU  76  -0.309  15.228 -13.375
  595    H    GLY  77           HN       GLY  77  -0.489  15.948  -9.136
  596   1HA   GLY  77          HA2       GLY  77  -3.181  15.184  -9.734
  597   2HA   GLY  77          HA1       GLY  77  -2.074  13.819  -9.821
  598    H    ARG  78           HN       ARG  78  -2.302  12.656  -8.026
  599    HA   ARG  78           HA       ARG  78  -1.947  14.006  -5.475
  600   1HB   ARG  78          HB2       ARG  78  -3.784  12.372  -4.570
  601   2HB   ARG  78          HB1       ARG  78  -4.227  13.918  -5.273
  602   1HG   ARG  78          HG2       ARG  78  -4.230  11.334  -6.787
  603   2HG   ARG  78          HG1       ARG  78  -5.634  11.987  -5.950
  604   1HD   ARG  78          HD2       ARG  78  -4.209  13.054  -8.364
  605   2HD   ARG  78          HD1       ARG  78  -5.912  12.667  -8.169
  606    HE   ARG  78           HE       ARG  78  -4.697  15.154  -7.664
  607   1HH1  ARG  78          HH11      ARG  78  -7.142  13.021  -6.376
  608   2HH1  ARG  78          HH12      ARG  78  -8.021  14.296  -5.603
  609   1HH2  ARG  78          HH21      ARG  78  -5.857  16.828  -6.652
  610   2HH2  ARG  78          HH22      ARG  78  -7.295  16.455  -5.761
  611    H    LEU  79           HN       LEU  79  -3.033  10.664  -5.424
  612    HA   LEU  79           HA       LEU  79  -0.408   9.916  -4.451
  613   1HB   LEU  79          HB2       LEU  79  -2.891   8.260  -4.926
  614   2HB   LEU  79          HB1       LEU  79  -1.412   7.643  -4.217
  615    HG   LEU  79           HG       LEU  79  -1.678   9.287  -2.360
  616   1HD1  LEU  79          1HD1      LEU  79  -4.172   9.913  -3.888
  617   2HD1  LEU  79          2HD1      LEU  79  -2.987  11.011  -3.181
  618   3HD1  LEU  79          3HD1      LEU  79  -4.106  10.132  -2.140
  619   1HD2  LEU  79          1HD2      LEU  79  -4.062   8.054  -1.744
  620   2HD2  LEU  79          2HD2      LEU  79  -2.449   7.404  -1.450
  621   3HD2  LEU  79          3HD2      LEU  79  -3.326   6.956  -2.912
  622    H    TYR  80           HN       TYR  80   1.234   9.121  -5.680
  623    HA   TYR  80           HA       TYR  80   0.493   8.453  -8.425
  624   1HB   TYR  80          HB2       TYR  80   2.957   9.653  -7.260
  625   2HB   TYR  80          HB1       TYR  80   3.036   8.817  -8.808
  626    HD1  TYR  80           HD1      TYR  80   0.392  11.025  -7.380
  627    HD2  TYR  80           HD2      TYR  80   3.289  10.437 -10.433
  628    HE1  TYR  80           HE1      TYR  80  -0.422  13.037  -8.533
  629    HE2  TYR  80           HE2      TYR  80   2.484  12.448 -11.594
  630    HH   TYR  80           HH       TYR  80   0.017  13.725 -11.554
  631    H    PHE  81           HN       PHE  81  -0.058   6.297  -8.109
  632    HA   PHE  81           HA       PHE  81   2.199   4.596  -8.347
  633   1HB   PHE  81          HB2       PHE  81   1.269   2.915  -6.666
  634   2HB   PHE  81          HB1       PHE  81   2.081   4.332  -6.009
  635    HD1  PHE  81           HD1      PHE  81  -1.401   3.895  -7.292
  636    HD2  PHE  81           HD2      PHE  81   1.115   4.764  -3.971
  637    HE1  PHE  81           HE1      PHE  81  -3.382   4.402  -5.929
  638    HE2  PHE  81           HE2      PHE  81  -0.865   5.272  -2.601
  639    HZ   PHE  81           HZ       PHE  81  -3.117   5.090  -3.580
  640    H    SER  82           HN       SER  82   1.513   2.256  -8.609
  641    HA   SER  82           HA       SER  82  -0.998   1.997 -10.050
  642   1HB   SER  82          HB2       SER  82   0.098   1.161 -12.043
  643   2HB   SER  82          HB1       SER  82   0.659   2.795 -11.696
  644    HG   SER  82           HG       SER  82   2.593   2.044 -11.158
  645    H    MET  83           HN       MET  83   1.138  -0.322 -11.040
  646    HA   MET  83           HA       MET  83   0.966  -2.075  -8.784
  647   1HB   MET  83          HB2       MET  83  -0.198  -3.871 -10.075
  648   2HB   MET  83          HB1       MET  83  -1.220  -2.491  -9.709
  649   1HG   MET  83          HG2       MET  83  -0.902  -1.647 -11.971
  650   2HG   MET  83          HG1       MET  83   0.134  -3.021 -12.341
  651   1HE   MET  83          HE1       MET  83  -1.372  -3.585 -14.478
  652   2HE   MET  83          HE2       MET  83  -2.380  -2.188 -14.097
  653   3HE   MET  83          HE3       MET  83  -3.125  -3.757 -14.403
  654    H    ASP  84           HN       ASP  84   1.589  -4.460 -10.100
  655    HA   ASP  84           HA       ASP  84   4.323  -4.119 -10.607
  656   1HB   ASP  84          HB2       ASP  84   2.514  -6.395 -11.450
  657   2HB   ASP  84          HB1       ASP  84   4.274  -6.442 -11.460
  658    H    ASP  85           HN       ASP  85   1.507  -4.085 -12.699
  659    HA   ASP  85           HA       ASP  85   3.228  -3.097 -14.861
  660   1HB   ASP  85          HB2       ASP  85   2.058  -4.496 -16.519
  661   2HB   ASP  85          HB1       ASP  85   2.926  -5.464 -15.332
  662    H    GLY  86           HN       GLY  86   1.751  -1.328 -13.391
  663   1HA   GLY  86          HA2       GLY  86  -0.316  -0.574 -15.345
  664   2HA   GLY  86          HA1       GLY  86  -0.734  -0.618 -13.640
  665    H    GLN  87           HN       GLN  87  -1.164   1.699 -14.835
  666    HA   GLN  87           HA       GLN  87   0.871   3.438 -13.666
  667   1HB   GLN  87          HB2       GLN  87   0.725   4.961 -15.644
  668   2HB   GLN  87          HB1       GLN  87   1.505   3.423 -15.982
  669   1HG   GLN  87          HG2       GLN  87  -0.573   2.595 -16.978
  670   2HG   GLN  87          HG1       GLN  87  -1.338   4.150 -16.659
  671    H    THR  88           HN       THR  88  -0.898   3.513 -12.019
  672    HA   THR  88           HA       THR  88  -3.084   5.248 -12.896
  673    HB   THR  88           HB       THR  88  -4.358   4.373 -10.954
  674    HG1  THR  88           HG1      THR  88  -2.944   3.579  -9.552
  675   1HG2  THR  88          1HG2      THR  88  -3.643   2.885 -13.316
  676   2HG2  THR  88          2HG2      THR  88  -5.201   3.034 -12.502
  677   3HG2  THR  88          3HG2      THR  88  -4.038   1.818 -11.969
  678    H    ARG  89           HN       ARG  89  -0.332   5.871 -11.686
  679    HA   ARG  89           HA       ARG  89  -0.325   6.943  -9.248
  680   1HB   ARG  89          HB2       ARG  89   1.121   8.803 -10.215
  681   2HB   ARG  89          HB1       ARG  89   1.634   7.150 -10.494
  682   1HG   ARG  89          HG2       ARG  89   1.949   8.368 -12.507
  683   2HG   ARG  89          HG1       ARG  89   0.584   7.280 -12.750
  684   1HD   ARG  89          HD2       ARG  89  -0.973   9.094 -12.448
  685   2HD   ARG  89          HD1       ARG  89   0.335  10.202 -12.027
  686    HE   ARG  89           HE       ARG  89   0.840   9.137 -14.570
  687   1HH1  ARG  89          HH11      ARG  89  -1.427  11.267 -12.986
  688   2HH1  ARG  89          HH12      ARG  89  -1.751  12.190 -14.414
  689   1HH2  ARG  89          HH21      ARG  89   0.415  10.350 -16.451
  690   2HH2  ARG  89          HH22      ARG  89  -0.706  11.669 -16.381
  691    H    PHE  90           HN       PHE  90  -2.761   7.390  -9.080
  692    HA   PHE  90           HA       PHE  90  -3.091  10.285  -9.169
  693   1HB   PHE  90          HB2       PHE  90  -5.438  10.041 -10.019
  694   2HB   PHE  90          HB1       PHE  90  -4.196   9.640 -11.193
  695    HD1  PHE  90           HD1      PHE  90  -6.197   7.876  -8.570
  696    HD2  PHE  90           HD2      PHE  90  -4.600   7.831 -12.511
  697    HE1  PHE  90           HE1      PHE  90  -7.270   5.703  -8.972
  698    HE2  PHE  90           HE2      PHE  90  -5.674   5.657 -12.923
  699    HZ   PHE  90           HZ       PHE  90  -7.012   4.590 -11.154
  700    H    THR  91           HN       THR  91  -5.845  10.216  -8.298
  701    HA   THR  91           HA       THR  91  -5.556  10.157  -5.551
  702    HB   THR  91           HB       THR  91  -8.107   9.649  -7.073
  703    HG1  THR  91           HG1      THR  91  -8.217  11.744  -7.477
  704   1HG2  THR  91          1HG2      THR  91  -8.702   9.434  -4.852
  705   2HG2  THR  91          2HG2      THR  91  -9.015  11.137  -5.188
  706   3HG2  THR  91          3HG2      THR  91  -7.553  10.663  -4.324
  707    H    ASP  92           HN       ASP  92  -6.919   8.755  -4.039
  708    HA   ASP  92           HA       ASP  92  -7.106   5.972  -4.873
  709   1HB   ASP  92          HB2       ASP  92  -4.807   6.198  -4.028
  710   2HB   ASP  92          HB1       ASP  92  -5.427   6.845  -2.512
  711    H    LEU  93           HN       LEU  93  -7.116   7.817  -1.821
  712    HA   LEU  93           HA       LEU  93  -8.939   6.475  -0.366
  713   1HB   LEU  93          HB2       LEU  93  -7.779   8.466   0.428
  714   2HB   LEU  93          HB1       LEU  93  -8.765   9.475  -0.614
  715    HG   LEU  93           HG       LEU  93 -10.766   8.859   0.670
  716   1HD1  LEU  93          1HD1      LEU  93  -8.829   7.048   2.003
  717   2HD1  LEU  93          2HD1      LEU  93 -10.526   6.793   1.596
  718   3HD1  LEU  93          3HD1      LEU  93 -10.091   7.780   2.992
  719   1HD2  LEU  93          1HD2      LEU  93  -8.701   9.750   2.648
  720   2HD2  LEU  93          2HD2      LEU  93 -10.367  10.294   2.451
  721   3HD2  LEU  93          3HD2      LEU  93  -9.140  10.770   1.278
  722    H    LEU  94           HN       LEU  94 -10.018   9.333  -2.213
  723    HA   LEU  94           HA       LEU  94 -12.712   9.017  -2.014
  724   1HB   LEU  94          HB2       LEU  94 -11.520  10.901  -3.124
  725   2HB   LEU  94          HB1       LEU  94 -11.275   9.878  -4.524
  726    HG   LEU  94           HG       LEU  94 -13.138  11.488  -4.794
  727   1HD1  LEU  94          1HD1      LEU  94 -13.003   9.045  -5.766
  728   2HD1  LEU  94          2HD1      LEU  94 -14.430  10.052  -6.008
  729   3HD1  LEU  94          3HD1      LEU  94 -14.429   8.811  -4.754
  730   1HD2  LEU  94          1HD2      LEU  94 -14.894  11.645  -3.390
  731   2HD2  LEU  94          2HD2      LEU  94 -13.756  10.962  -2.229
  732   3HD2  LEU  94          3HD2      LEU  94 -14.916   9.915  -3.048
  733    H    GLN  95           HN       GLN  95 -10.667   7.551  -4.544
  734    HA   GLN  95           HA       GLN  95 -12.705   6.204  -5.881
  735   1HB   GLN  95          HB2       GLN  95  -9.787   5.468  -5.608
  736   2HB   GLN  95          HB1       GLN  95 -10.878   4.950  -6.864
  737   1HG   GLN  95          HG2       GLN  95 -10.043   7.786  -6.382
  738   2HG   GLN  95          HG1       GLN  95  -9.359   6.720  -7.602
  739    H    LEU  96           HN       LEU  96 -10.416   5.125  -3.397
  740    HA   LEU  96           HA       LEU  96 -11.081   2.490  -3.123
  741   1HB   LEU  96          HB2       LEU  96  -9.299   3.736  -1.894
  742   2HB   LEU  96          HB1       LEU  96 -10.535   4.399  -0.848
  743    HG   LEU  96           HG       LEU  96  -9.925   1.452  -1.091
  744   1HD1  LEU  96          1HD1      LEU  96  -8.171   1.792   0.220
  745   2HD1  LEU  96          2HD1      LEU  96  -9.244   2.454   1.453
  746   3HD1  LEU  96          3HD1      LEU  96  -8.499   3.524   0.265
  747   1HD2  LEU  96          1HD2      LEU  96 -11.120   1.806   1.307
  748   2HD2  LEU  96          2HD2      LEU  96 -11.978   1.352  -0.165
  749   3HD2  LEU  96          3HD2      LEU  96 -11.944   3.038   0.351
  750    H    VAL  97           HN       VAL  97 -12.832   5.291  -1.921
  751    HA   VAL  97           HA       VAL  97 -14.648   3.949  -0.249
  752    HB   VAL  97           HB       VAL  97 -15.114   6.507  -1.787
  753   1HG1  VAL  97          1HG1      VAL  97 -17.193   6.145  -0.972
  754   2HG1  VAL  97          2HG1      VAL  97 -16.482   6.814   0.497
  755   3HG1  VAL  97          3HG1      VAL  97 -16.624   5.067   0.303
  756   1HG2  VAL  97          1HG2      VAL  97 -14.522   7.313   0.707
  757   2HG2  VAL  97          2HG2      VAL  97 -13.323   7.170  -0.579
  758   3HG2  VAL  97          3HG2      VAL  97 -13.506   5.874   0.605
  759    H    GLU  98           HN       GLU  98 -15.445   5.403  -3.410
  760    HA   GLU  98           HA       GLU  98 -17.809   3.846  -3.710
  761   1HB   GLU  98          HB2       GLU  98 -17.567   6.035  -4.760
  762   2HB   GLU  98          HB1       GLU  98 -16.242   5.435  -5.748
  763   1HG   GLU  98          HG2       GLU  98 -17.768   3.884  -6.855
  764   2HG   GLU  98          HG1       GLU  98 -19.096   4.483  -5.864
  765    H    PHE  99           HN       PHE  99 -14.634   3.655  -5.317
  766    HA   PHE  99           HA       PHE  99 -15.308   1.420  -6.890
  767   1HB   PHE  99          HB2       PHE  99 -12.653   2.564  -6.051
  768   2HB   PHE  99          HB1       PHE  99 -12.782   1.144  -7.077
  769    HD1  PHE  99           HD1      PHE  99 -11.962   1.849  -9.114
  770    HD2  PHE  99           HD2      PHE  99 -14.881   4.222  -7.123
  771    HE1  PHE  99           HE1      PHE  99 -12.163   3.274 -11.109
  772    HE2  PHE  99           HE2      PHE  99 -15.086   5.648  -9.111
  773    HZ   PHE  99           HZ       PHE  99 -13.728   5.176 -11.110
  774    H    HIS 100           HN       HIS 100 -14.892   1.567  -3.548
  775    HA   HIS 100           HA       HIS 100 -13.467  -0.613  -2.759
  776   1HB   HIS 100          HB2       HIS 100 -14.842  -0.761  -0.821
  777   2HB   HIS 100          HB1       HIS 100 -14.853   0.934  -1.287
  778    HD1  HIS 100           HD1      HIS 100 -17.064   1.295  -3.145
  779    HD2  HIS 100           HD2      HIS 100 -17.320  -1.467  -0.055
  780    HE1  HIS 100           HE1      HIS 100 -19.522   0.912  -2.791
  781    HE2  HIS 100           HE2      HIS 100 -19.654  -0.700  -0.859
  782    H    GLN 101           HN       GLN 101 -16.598  -0.549  -4.283
  783    HA   GLN 101           HA       GLN 101 -17.220  -3.299  -4.033
  784   1HB   GLN 101          HB2       GLN 101 -18.862  -2.779  -5.883
  785   2HB   GLN 101          HB1       GLN 101 -19.004  -1.783  -4.443
  786   1HG   GLN 101          HG2       GLN 101 -17.503  -0.121  -5.723
  787   2HG   GLN 101          HG1       GLN 101 -17.956  -1.049  -7.145
  788    H    LEU 102           HN       LEU 102 -15.959  -1.403  -6.778
  789    HA   LEU 102           HA       LEU 102 -14.588  -3.810  -7.727
  790   1HB   LEU 102          HB2       LEU 102 -16.397  -2.062  -9.394
  791   2HB   LEU 102          HB1       LEU 102 -15.211  -3.148 -10.092
  792    HG   LEU 102           HG       LEU 102 -17.338  -4.224 -10.183
  793   1HD1  LEU 102          1HD1      LEU 102 -16.683  -6.249  -9.429
  794   2HD1  LEU 102          2HD1      LEU 102 -16.265  -5.642  -7.826
  795   3HD1  LEU 102          3HD1      LEU 102 -15.160  -5.396  -9.179
  796   1HD2  LEU 102          1HD2      LEU 102 -17.854  -4.460  -7.329
  797   2HD2  LEU 102          2HD2      LEU 102 -18.947  -4.049  -8.651
  798   3HD2  LEU 102          3HD2      LEU 102 -17.946  -2.800  -7.914
  799    H    ASN 103           HN       ASN 103 -12.868  -2.546  -6.652
  800    HA   ASN 103           HA       ASN 103 -11.916  -0.236  -8.184
  801   1HB   ASN 103          HB2       ASN 103 -10.387   0.117  -6.285
  802   2HB   ASN 103          HB1       ASN 103 -12.061   0.026  -5.750
  803   1HD2  ASN 103          1HD2      ASN 103 -12.621  -1.452  -4.287
  804   2HD2  ASN 103          2HD2      ASN 103 -11.578  -2.683  -3.673
  805    H    ARG 104           HN       ARG 104  -9.330  -0.185  -8.021
  806    HA   ARG 104           HA       ARG 104  -8.448  -2.606  -9.422
  807   1HB   ARG 104          HB2       ARG 104  -7.315   0.195  -9.340
  808   2HB   ARG 104          HB1       ARG 104  -6.508  -1.155 -10.124
  809   1HG   ARG 104          HG2       ARG 104  -7.682   0.179 -11.755
  810   2HG   ARG 104          HG1       ARG 104  -8.423  -1.415 -11.631
  811   1HD   ARG 104          HD2       ARG 104 -10.217  -0.531 -10.289
  812   2HD   ARG 104          HD1       ARG 104  -9.442   1.052 -10.226
  813    HE   ARG 104           HE       ARG 104 -11.128   0.078 -12.273
  814   1HH1  ARG 104          HH11      ARG 104  -8.259   2.007 -11.779
  815   2HH1  ARG 104          HH12      ARG 104  -8.455   2.897 -13.250
  816   1HH2  ARG 104          HH21      ARG 104 -11.387   1.254 -14.205
  817   2HH2  ARG 104          HH22      ARG 104 -10.231   2.472 -14.626
  818    H    GLY 105           HN       GLY 105  -8.635  -3.173  -6.872
  819   1HA   GLY 105          HA2       GLY 105  -6.838  -2.552  -4.961
  820   2HA   GLY 105          HA1       GLY 105  -7.370  -4.200  -5.233
  821    H    ILE 106           HN       ILE 106  -5.976  -5.674  -6.142
  822    HA   ILE 106           HA       ILE 106  -3.199  -4.740  -6.434
  823    HB   ILE 106           HB       ILE 106  -2.449  -6.883  -5.805
  824   1HG1  ILE 106          2HG1      ILE 106  -4.510  -8.600  -5.351
  825   2HG1  ILE 106          1HG1      ILE 106  -5.090  -7.757  -6.779
  826   1HG2  ILE 106          1HG2      ILE 106  -4.488  -7.294  -3.902
  827   2HG2  ILE 106          2HG2      ILE 106  -4.381  -5.558  -4.174
  828   3HG2  ILE 106          3HG2      ILE 106  -2.949  -6.465  -3.692
  829   1HD1  ILE 106          1HD1      ILE 106  -3.780  -8.988  -8.062
  830   2HD1  ILE 106          2HD1      ILE 106  -3.268  -9.888  -6.637
  831   3HD1  ILE 106          3HD1      ILE 106  -2.357  -8.473  -7.160
  832    H    LEU 107           HN       LEU 107  -2.013  -6.689  -7.783
  833    HA   LEU 107           HA       LEU 107  -2.279  -6.200 -10.454
  834   1HB   LEU 107          HB2       LEU 107  -1.296  -8.521  -8.869
  835   2HB   LEU 107          HB1       LEU 107  -1.447  -8.732 -10.598
  836    HG   LEU 107           HG       LEU 107   0.215  -6.627  -9.213
  837   1HD1  LEU 107          1HD1      LEU 107   1.597  -8.382  -8.978
  838   2HD1  LEU 107          2HD1      LEU 107   1.922  -8.113 -10.690
  839   3HD1  LEU 107          3HD1      LEU 107   0.758  -9.343 -10.196
  840   1HD2  LEU 107          1HD2      LEU 107  -0.912  -6.523 -11.749
  841   2HD2  LEU 107          2HD2      LEU 107   0.737  -7.078 -12.026
  842   3HD2  LEU 107          3HD2      LEU 107   0.448  -5.571 -11.161
  843    HA   PRO 108           HA       PRO 108  -5.484  -8.190 -12.824
  844   1HB   PRO 108          HB2       PRO 108  -3.820 -10.689 -12.794
  845   2HB   PRO 108          HB1       PRO 108  -4.806 -10.021 -14.102
  846   1HG   PRO 108          HG2       PRO 108  -2.153  -9.603 -13.982
  847   2HG   PRO 108          HG1       PRO 108  -3.270  -8.377 -14.606
  848   1HD   PRO 108          HD2       PRO 108  -1.687  -8.351 -12.156
  849   2HD   PRO 108          HD1       PRO 108  -2.552  -7.019 -12.937
  850    H    CYS 109           HN       CYS 109  -4.214 -10.229 -10.158
  851    HA   CYS 109           HA       CYS 109  -6.407 -11.954  -9.947
  852   1HB   CYS 109          HB2       CYS 109  -4.824 -10.933  -7.576
  853   2HB   CYS 109          HB1       CYS 109  -5.698 -12.449  -7.705
  854    HG   CYS 109           HG       CYS 109  -2.695 -12.436  -7.871
  855    H    LEU 110           HN       LEU 110  -7.465 -11.697  -7.388
  856    HA   LEU 110           HA       LEU 110  -9.699 -10.156  -7.737
  857   1HB   LEU 110          HB2       LEU 110  -8.287 -10.950  -5.200
  858   2HB   LEU 110          HB1       LEU 110  -9.805 -10.074  -5.178
  859    HG   LEU 110           HG       LEU 110 -10.212 -12.434  -4.851
  860   1HD1  LEU 110          1HD1      LEU 110 -11.090 -11.995  -7.664
  861   2HD1  LEU 110          2HD1      LEU 110 -11.662 -10.909  -6.398
  862   3HD1  LEU 110          3HD1      LEU 110 -11.987 -12.640  -6.289
  863   1HD2  LEU 110          1HD2      LEU 110  -9.512 -14.136  -6.275
  864   2HD2  LEU 110          2HD2      LEU 110  -8.101 -13.086  -6.160
  865   3HD2  LEU 110          3HD2      LEU 110  -9.137 -13.017  -7.586
  866    H    LEU 111           HN       LEU 111 -10.358  -8.071  -7.160
  867    HA   LEU 111           HA       LEU 111  -8.180  -6.238  -6.438
  868   1HB   LEU 111          HB2       LEU 111  -9.207  -4.550  -7.956
  869   2HB   LEU 111          HB1       LEU 111  -8.470  -5.916  -8.756
  870    HG   LEU 111           HG       LEU 111 -10.557  -5.214  -9.835
  871   1HD1  LEU 111          1HD1      LEU 111 -11.011  -7.309 -10.435
  872   2HD1  LEU 111          2HD1      LEU 111 -11.445  -7.786  -8.795
  873   3HD1  LEU 111          3HD1      LEU 111  -9.753  -7.768  -9.289
  874   1HD2  LEU 111          1HD2      LEU 111 -12.213  -6.280  -7.628
  875   2HD2  LEU 111          2HD2      LEU 111 -12.569  -5.026  -8.814
  876   3HD2  LEU 111          3HD2      LEU 111 -11.544  -4.662  -7.428
  877    H    ARG 112           HN       ARG 112 -11.488  -7.141  -5.989
  878    HA   ARG 112           HA       ARG 112 -12.455  -4.770  -4.816
  879   1HB   ARG 112          HB2       ARG 112 -13.277  -7.604  -4.151
  880   2HB   ARG 112          HB1       ARG 112 -14.218  -6.146  -3.871
  881   1HG   ARG 112          HG2       ARG 112 -14.335  -5.782  -6.302
  882   2HG   ARG 112          HG1       ARG 112 -13.457  -7.292  -6.547
  883   1HD   ARG 112          HD2       ARG 112 -15.857  -7.621  -6.821
  884   2HD   ARG 112          HD1       ARG 112 -15.245  -8.523  -5.435
  885    HE   ARG 112           HE       ARG 112 -16.158  -6.036  -4.536
  886   1HH1  ARG 112          HH11      ARG 112 -17.426  -8.991  -5.895
  887   2HH1  ARG 112          HH12      ARG 112 -18.964  -8.836  -5.116
  888   1HH2  ARG 112          HH21      ARG 112 -18.181  -5.832  -3.509
  889   2HH2  ARG 112          HH22      ARG 112 -19.393  -7.043  -3.761
  890    H    HIS 113           HN       HIS 113 -12.646  -4.148  -2.619
  891    HA   HIS 113           HA       HIS 113 -11.216  -5.713  -0.629
  892   1HB   HIS 113          HB2       HIS 113  -9.848  -3.741   0.076
  893   2HB   HIS 113          HB1       HIS 113  -9.392  -4.422  -1.484
  894    HD1  HIS 113           HD1      HIS 113 -12.002  -1.785  -0.579
  895    HD2  HIS 113           HD2      HIS 113  -8.668  -2.317  -3.002
  896    HE1  HIS 113           HE1      HIS 113 -11.765   0.354  -1.877
  897    HE2  HIS 113           HE2      HIS 113  -9.791  -0.022  -3.395
  898    H    CYS 114           HN       CYS 114 -11.348  -4.721   1.563
  899    HA   CYS 114           HA       CYS 114 -13.638  -2.938   1.920
  900   1HB   CYS 114          HB2       CYS 114 -14.561  -5.195   2.083
  901   2HB   CYS 114          HB1       CYS 114 -13.347  -5.622   3.288
  902    HG   CYS 114           HG       CYS 114 -15.957  -5.232   4.415
  903    H    CYS 115           HN       CYS 115 -11.763  -4.946   4.182
  904    HA   CYS 115           HA       CYS 115 -10.485  -2.538   5.257
  905   1HB   CYS 115          HB2       CYS 115 -11.976  -4.554   6.955
  906   2HB   CYS 115          HB1       CYS 115 -11.051  -3.184   7.560
  907    HG   CYS 115           HG       CYS 115 -12.751  -1.272   6.373
  908    H    THR 116           HN       THR 116  -9.259  -3.733   7.468
  909    HA   THR 116           HA       THR 116  -7.451  -5.644   6.143
  910    HB   THR 116           HB       THR 116  -6.913  -3.847   8.518
  911    HG1  THR 116           HG1      THR 116  -6.070  -3.618   5.822
  912   1HG2  THR 116          1HG2      THR 116  -4.874  -5.279   6.854
  913   2HG2  THR 116          2HG2      THR 116  -5.536  -5.961   8.339
  914   3HG2  THR 116          3HG2      THR 116  -4.651  -4.437   8.387
  915    H    ARG 117           HN       ARG 117  -6.656  -7.470   7.358
  916    HA   ARG 117           HA       ARG 117  -8.443  -8.201   9.587
  917   1HB   ARG 117          HB2       ARG 117  -8.723  -9.619   7.606
  918   2HB   ARG 117          HB1       ARG 117  -7.010 -10.010   7.636
  919   1HG   ARG 117          HG2       ARG 117  -8.338 -11.817   8.563
  920   2HG   ARG 117          HG1       ARG 117  -7.290 -11.111   9.794
  921   1HD   ARG 117          HD2       ARG 117  -9.174  -9.800  10.642
  922   2HD   ARG 117          HD1       ARG 117 -10.219 -10.505   9.410
  923    HE   ARG 117           HE       ARG 117  -9.061 -12.585  10.876
  924   1HH1  ARG 117          HH11      ARG 117 -11.331  -9.974  11.335
  925   2HH1  ARG 117          HH12      ARG 117 -12.226 -10.803  12.563
  926   1HH2  ARG 117          HH21      ARG 117 -10.238 -13.676  12.491
  927   2HH2  ARG 117          HH22      ARG 117 -11.607 -12.904  13.220
  928    H    VAL 118           HN       VAL 118  -6.796  -6.897  10.824
  929    HA   VAL 118           HA       VAL 118  -4.875  -8.740  11.974
  930    HB   VAL 118           HB       VAL 118  -3.095  -6.892  11.953
  931   1HG1  VAL 118          1HG1      VAL 118  -3.349  -7.814   9.178
  932   2HG1  VAL 118          2HG1      VAL 118  -3.505  -9.081  10.394
  933   3HG1  VAL 118          3HG1      VAL 118  -2.056  -8.076  10.349
  934   1HG2  VAL 118          1HG2      VAL 118  -3.733  -4.961  11.026
  935   2HG2  VAL 118          2HG2      VAL 118  -5.138  -5.698  10.258
  936   3HG2  VAL 118          3HG2      VAL 118  -3.562  -5.778   9.473
  937    H    ALA 119           HN       ALA 119  -5.376  -5.204  12.147
  938    HA   ALA 119           HA       ALA 119  -5.307  -5.293  15.020
  939   1HB   ALA 119          HB1       ALA 119  -6.147  -2.841  13.565
  940   2HB   ALA 119          HB2       ALA 119  -4.498  -3.423  13.339
  941   3HB   ALA 119          HB3       ALA 119  -5.076  -3.022  14.956
  942    H    LEU 120           HN       LEU 120  -7.155  -3.327  15.704
  943    HA   LEU 120           HA       LEU 120  -9.462  -4.805  16.184
  944   1HB   LEU 120          HB2       LEU 120  -9.165  -1.802  16.111
  945   2HB   LEU 120          HB1       LEU 120 -10.486  -2.674  16.863
  946    HG   LEU 120           HG       LEU 120  -7.593  -2.766  17.722
  947   1HD1  LEU 120          1HD1      LEU 120  -9.010  -0.672  18.167
  948   2HD1  LEU 120          2HD1      LEU 120  -8.175  -1.419  19.530
  949   3HD1  LEU 120          3HD1      LEU 120  -9.901  -1.690  19.298
  950   1HD2  LEU 120          1HD2      LEU 120  -8.760  -3.909  19.747
  951   2HD2  LEU 120          2HD2      LEU 120  -8.373  -4.857  18.310
  952   3HD2  LEU 120          3HD2      LEU 120 -10.021  -4.285  18.573
  953    HA   PRO1135           HA       PRO1135  14.130  -7.067  -9.717
  954   1HB   PRO1135          HB2       PRO1135  13.407  -9.496  -8.148
  955   2HB   PRO1135          HB1       PRO1135  14.631  -9.292  -9.405
  956   1HG   PRO1135          HG2       PRO1135  15.332  -9.439  -6.841
  957   2HG   PRO1135          HG1       PRO1135  16.157  -8.327  -7.948
  958   1HD   PRO1135          HD2       PRO1135  14.127  -7.746  -5.842
  959   2HD   PRO1135          HD1       PRO1135  15.518  -6.777  -6.368
  960    H    GLN1136           HN       GLN1136  11.646  -7.421  -7.269
  961    HA   GLN1136           HA       GLN1136   9.525  -6.789  -8.936
  962   1HB   GLN1136          HB2       GLN1136   9.937  -8.905 -10.071
  963   2HB   GLN1136          HB1       GLN1136   9.826  -9.773  -8.550
  964   1HG   GLN1136          HG2       GLN1136   7.792 -10.016  -9.837
  965   2HG   GLN1136          HG1       GLN1136   7.485  -9.133  -8.342
  966    HA   PRO1137           HA       PRO1137   7.903  -8.821  -4.739
  967   1HB   PRO1137          HB2       PRO1137  10.511  -8.780  -3.305
  968   2HB   PRO1137          HB1       PRO1137   9.187  -9.947  -3.203
  969   1HG   PRO1137          HG2       PRO1137  11.422 -10.555  -4.507
  970   2HG   PRO1137          HG1       PRO1137   9.840 -11.058  -5.133
  971   1HD   PRO1137          HD2       PRO1137  11.615  -8.824  -6.026
  972   2HD   PRO1137          HD1       PRO1137  10.621  -9.929  -6.994
  973    H    GLU1138           HN       GLU1138  10.836  -6.836  -4.270
  974    HA   GLU1138           HA       GLU1138   9.771  -5.146  -2.323
  975   1HB   GLU1138          HB2       GLU1138  11.598  -3.567  -3.007
  976   2HB   GLU1138          HB1       GLU1138  12.134  -5.201  -2.645
  977   1HG   GLU1138          HG2       GLU1138  12.290  -5.710  -5.000
  978   2HG   GLU1138          HG1       GLU1138  11.653  -4.120  -5.410
  979   2HN   PTR1139          HN        PTR1139   8.467  -3.442  -2.353
  980   2HN   PTR1139          HN        PTR1139   8.467  -3.442  -2.353
  981    HA   PTR1139           HA       PTR1139   6.832  -2.073  -3.129
  982    HA   PTR1139           HA       PTR1139   6.832  -2.073  -3.129
  983   1HB   PTR1139          HB1       PTR1139   7.755  -0.381  -4.793
  984   1HB   PTR1139          HB1       PTR1139   7.755  -0.381  -4.793
  985   2HB   PTR1139          HB2       PTR1139   9.262  -1.310  -4.688
  986   2HB   PTR1139          HB2       PTR1139   9.262  -1.310  -4.688
  987    HD1  PTR1139           HD1      PTR1139   6.597  -0.007  -2.458
  988    HD1  PTR1139           HD1      PTR1139   6.597  -0.007  -2.458
  989    HD2  PTR1139           HD2      PTR1139  10.758  -0.605  -2.977
  990    HD2  PTR1139           HD2      PTR1139  10.758  -0.605  -2.977
  991    HE1  PTR1139           HE1      PTR1139   7.012   1.068  -0.298
  992    HE1  PTR1139           HE1      PTR1139   7.012   1.068  -0.298
  993    HE2  PTR1139           HE2      PTR1139  11.194   0.501  -0.781
  994    HE2  PTR1139           HE2      PTR1139  11.194   0.501  -0.781
  995    H    VAL1140           HN       VAL1140   7.203  -1.369  -6.305
  996    HA   VAL1140           HA       VAL1140   6.495  -3.559  -7.758
  997    HB   VAL1140           HB       VAL1140   4.248  -2.789  -5.988
  998   1HG1  VAL1140          1HG1      VAL1140   3.833  -3.314  -8.921
  999   2HG1  VAL1140          2HG1      VAL1140   3.234  -1.957  -7.969
 1000   3HG1  VAL1140          3HG1      VAL1140   2.572  -3.574  -7.717
 1001   1HG2  VAL1140          1HG2      VAL1140   4.282  -4.982  -5.613
 1002   2HG2  VAL1140          2HG2      VAL1140   5.630  -5.124  -6.740
 1003   3HG2  VAL1140          3HG2      VAL1140   3.976  -5.317  -7.317
 1004    H    ASN1141           HN       ASN1141   5.159  -0.201  -7.294
 1005    HA   ASN1141           HA       ASN1141   4.429   0.073 -10.005
 1006   1HB   ASN1141          HB2       ASN1141   5.992   2.293  -8.687
 1007   2HB   ASN1141          HB1       ASN1141   4.689   2.411  -9.838
 1008   1HD2  ASN1141          1HD2      ASN1141   5.312   1.398  -6.488
 1009   2HD2  ASN1141          2HD2      ASN1141   3.846   2.034  -5.860
 1010    H    GLN1142           HN       GLN1142   7.303  -0.144  -8.146
 1011    HA   GLN1142           HA       GLN1142   8.871  -1.065 -10.339
 1012   1HB   GLN1142          HB2       GLN1142   9.621   1.332  -8.662
 1013   2HB   GLN1142          HB1       GLN1142  10.752   0.475  -9.695
 1014   1HG   GLN1142          HG2       GLN1142   9.611   1.186 -11.671
 1015   2HG   GLN1142          HG1       GLN1142   8.283   1.853 -10.719
 1016    HA   PRO1143           HA       PRO1143  10.561  -3.483  -7.036
 1017   1HB   PRO1143          HB2       PRO1143  13.290  -2.364  -7.461
 1018   2HB   PRO1143          HB1       PRO1143  12.767  -4.051  -7.460
 1019   1HG   PRO1143          HG2       PRO1143  13.402  -2.784  -9.739
 1020   2HG   PRO1143          HG1       PRO1143  12.103  -3.989  -9.673
 1021   1HD   PRO1143          HD2       PRO1143  11.926  -1.014  -9.799
 1022   2HD   PRO1143          HD1       PRO1143  10.861  -2.239 -10.517
 1023    H    ASP1144           HN       ASP1144  11.199  -0.143  -7.469
 1024    HA   ASP1144           HA       ASP1144  10.251   0.784  -5.157
 1025   1HB   ASP1144          HB2       ASP1144  12.198   1.298  -3.728
 1026   2HB   ASP1144          HB1       ASP1144  12.068  -0.438  -3.964
  Start of MODEL    9
    1   1H    GLY   1          HT1       GLY   1  22.384   7.619  -2.577
    2   2H    GLY   1          HT2       GLY   1  22.358   5.946  -2.818
    3   3H    GLY   1          HT3       GLY   1  23.832   6.774  -2.801
    4   1HA   GLY   1          HA1       GLY   1  22.952   5.455  -0.706
    5   2HA   GLY   1          HA2       GLY   1  23.931   6.908  -0.564
    6    H    SER   2           HN       SER   2  20.641   7.018  -1.715
    7    HA   SER   2           HA       SER   2  19.886   8.940   0.210
    8   1HB   SER   2          HB2       SER   2  18.820   8.869  -1.977
    9   2HB   SER   2          HB1       SER   2  18.169   7.267  -1.638
   10    HG   SER   2           HG       SER   2  16.635   8.931  -1.269
   11    HA   PRO   3           HA       PRO   3  17.267   5.364   2.231
   12   1HB   PRO   3          HB2       PRO   3  18.205   2.834   1.734
   13   2HB   PRO   3          HB1       PRO   3  16.874   3.587   0.851
   14   1HG   PRO   3          HG2       PRO   3  19.756   3.342   0.089
   15   2HG   PRO   3          HG1       PRO   3  18.310   3.129  -0.916
   16   1HD   PRO   3          HD2       PRO   3  19.765   5.379  -1.005
   17   2HD   PRO   3          HD1       PRO   3  17.999   5.408  -1.173
   18    H    ALA   4           HN       ALA   4  17.706   4.470   4.252
   19    HA   ALA   4           HA       ALA   4  20.499   3.982   4.967
   20   1HB   ALA   4          HB1       ALA   4  19.476   6.434   5.446
   21   2HB   ALA   4          HB2       ALA   4  20.720   5.675   6.438
   22   3HB   ALA   4          HB3       ALA   4  19.031   5.605   6.937
   23    H    SER   5           HN       SER   5  20.185   3.739   7.700
   24    HA   SER   5           HA       SER   5  18.074   1.720   8.024
   25   1HB   SER   5          HB2       SER   5  20.966   1.397   8.865
   26   2HB   SER   5          HB1       SER   5  19.665   0.266   9.235
   27    HG   SER   5           HG       SER   5  21.150   0.086   7.201
   28    H    GLY   6           HN       GLY   6  20.488   3.745   9.666
   29   1HA   GLY   6          HA2       GLY   6  19.073   3.544  12.188
   30   2HA   GLY   6          HA1       GLY   6  20.537   4.466  11.881
   31    H    THR   7           HN       THR   7  17.073   4.456  11.058
   32    HA   THR   7           HA       THR   7  16.921   7.275  11.746
   33    HB   THR   7           HB       THR   7  16.167   6.265   8.995
   34    HG1  THR   7           HG1      THR   7  18.356   6.637   9.109
   35   1HG2  THR   7          1HG2      THR   7  14.621   7.999   9.821
   36   2HG2  THR   7          2HG2      THR   7  15.580   8.520   8.436
   37   3HG2  THR   7          3HG2      THR   7  16.000   9.072  10.058
   38    H    SER   8           HN       SER   8  15.683   6.185  13.451
   39    HA   SER   8           HA       SER   8  12.969   5.457  12.563
   40   1HB   SER   8          HB2       SER   8  14.118   3.597  13.662
   41   2HB   SER   8          HB1       SER   8  14.432   4.607  15.072
   42    HG   SER   8           HG       SER   8  12.234   3.187  14.466
   43    H    LEU   9           HN       LEU   9  11.217   6.411  13.501
   44    HA   LEU   9           HA       LEU   9  11.705   8.423  15.585
   45   1HB   LEU   9          HB2       LEU   9  10.036   8.836  13.103
   46   2HB   LEU   9          HB1       LEU   9  10.168   9.968  14.435
   47    HG   LEU   9           HG       LEU   9  12.409   9.143  12.587
   48   1HD1  LEU   9          1HD1      LEU   9  11.151  10.589  11.316
   49   2HD1  LEU   9          2HD1      LEU   9  12.238  11.707  12.140
   50   3HD1  LEU   9          3HD1      LEU   9  10.585  11.499  12.716
   51   1HD2  LEU   9          1HD2      LEU   9  13.297  11.334  13.889
   52   2HD2  LEU   9          2HD2      LEU   9  13.663   9.680  14.380
   53   3HD2  LEU   9          3HD2      LEU   9  12.353  10.563  15.164
   54    H    SER  10           HN       SER  10   9.287   9.358  16.106
   55    HA   SER  10           HA       SER  10   7.813   6.971  16.950
   56   1HB   SER  10          HB2       SER  10   8.467   8.524  18.728
   57   2HB   SER  10          HB1       SER  10   7.619   9.836  17.910
   58    HG   SER  10           HG       SER  10   6.319   7.455  18.711
   59    H    ALA  11           HN       ALA  11   5.467   6.984  16.871
   60    HA   ALA  11           HA       ALA  11   4.326   8.748  14.821
   61   1HB   ALA  11          HB1       ALA  11   4.575   6.962  13.434
   62   2HB   ALA  11          HB2       ALA  11   3.028   6.528  14.162
   63   3HB   ALA  11          HB3       ALA  11   4.518   5.790  14.749
   64    H    ALA  12           HN       ALA  12   2.681   9.784  15.720
   65    HA   ALA  12           HA       ALA  12   0.720   8.285  17.277
   66   1HB   ALA  12          HB1       ALA  12   2.395   9.268  18.866
   67   2HB   ALA  12          HB2       ALA  12   0.727   9.771  19.134
   68   3HB   ALA  12          HB3       ALA  12   1.859  10.863  18.337
   69    H    ILE  13           HN       ILE  13   0.760   9.486  14.624
   70    HA   ILE  13           HA       ILE  13  -0.785  11.904  14.724
   71    HB   ILE  13           HB       ILE  13   0.699  11.456  12.833
   72   1HG1  ILE  13          2HG1      ILE  13  -2.219  11.508  12.026
   73   2HG1  ILE  13          1HG1      ILE  13  -1.261  12.909  12.495
   74   1HG2  ILE  13          1HG2      ILE  13  -1.132   9.116  12.360
   75   2HG2  ILE  13          2HG2      ILE  13   0.610   9.098  12.632
   76   3HG2  ILE  13          3HG2      ILE  13  -0.041   9.754  11.130
   77   1HD1  ILE  13          1HD1      ILE  13  -1.021  13.130  10.276
   78   2HD1  ILE  13          2HD1      ILE  13  -1.335  11.424   9.962
   79   3HD1  ILE  13          3HD1      ILE  13   0.262  11.942  10.504
   80    H    HIS  14           HN       HIS  14  -1.510   8.583  15.000
   81    HA   HIS  14           HA       HIS  14  -4.144   8.646  13.891
   82   1HB   HIS  14          HB2       HIS  14  -2.890   6.686  15.826
   83   2HB   HIS  14          HB1       HIS  14  -4.415   6.448  14.980
   84    HD1  HIS  14           HD1      HIS  14  -0.802   7.175  13.983
   85    HD2  HIS  14           HD2      HIS  14  -4.095   4.952  12.769
   86    HE1  HIS  14           HE1      HIS  14  -0.033   5.881  11.971
   87    HE2  HIS  14           HE2      HIS  14  -2.013   4.472  11.311
   88    H    ARG  15           HN       ARG  15  -5.904   9.523  14.779
   89    HA   ARG  15           HA       ARG  15  -6.040   9.682  17.700
   90   1HB   ARG  15          HB2       ARG  15  -7.177  11.880  17.489
   91   2HB   ARG  15          HB1       ARG  15  -5.502  11.899  16.945
   92   1HG   ARG  15          HG2       ARG  15  -6.195  11.828  14.636
   93   2HG   ARG  15          HG1       ARG  15  -7.880  11.620  15.108
   94   1HD   ARG  15          HD2       ARG  15  -6.157  14.077  15.488
   95   2HD   ARG  15          HD1       ARG  15  -7.564  13.896  14.447
   96    HE   ARG  15           HE       ARG  15  -8.390  13.346  17.042
   97   1HH1  ARG  15          HH11      ARG  15  -7.143  16.047  15.220
   98   2HH1  ARG  15          HH12      ARG  15  -7.969  17.233  16.173
   99   1HH2  ARG  15          HH21      ARG  15  -9.479  14.905  18.298
  100   2HH2  ARG  15          HH22      ARG  15  -9.294  16.586  17.921
  101    H    THR  16           HN       THR  16  -7.290   8.238  15.226
  102    HA   THR  16           HA       THR  16  -9.905   7.971  16.484
  103    HB   THR  16           HB       THR  16 -11.056   8.047  14.295
  104    HG1  THR  16           HG1      THR  16  -8.601   9.034  13.287
  105   1HG2  THR  16          1HG2      THR  16  -9.532  10.484  15.137
  106   2HG2  THR  16          2HG2      THR  16 -11.229  10.088  15.410
  107   3HG2  THR  16          3HG2      THR  16 -10.671  10.509  13.790
  108    H    GLN  17           HN       GLN  17  -9.197   6.723  13.309
  109    HA   GLN  17           HA       GLN  17  -8.323   4.150  14.309
  110   1HB   GLN  17          HB2       GLN  17 -10.159   3.006  12.949
  111   2HB   GLN  17          HB1       GLN  17 -10.631   3.722  14.484
  112   1HG   GLN  17          HG2       GLN  17 -12.265   4.160  12.728
  113   2HG   GLN  17          HG1       GLN  17 -11.546   5.648  13.340
  114    H    LEU  18           HN       LEU  18  -7.222   6.268  12.672
  115    HA   LEU  18           HA       LEU  18  -7.299   5.850   9.941
  116   1HB   LEU  18          HB2       LEU  18  -4.809   6.565  11.480
  117   2HB   LEU  18          HB1       LEU  18  -5.196   6.989   9.824
  118    HG   LEU  18           HG       LEU  18  -6.513   8.063  12.317
  119   1HD1  LEU  18          1HD1      LEU  18  -5.132   9.688  10.232
  120   2HD1  LEU  18          2HD1      LEU  18  -4.185   8.857  11.466
  121   3HD1  LEU  18          3HD1      LEU  18  -5.404  10.041  11.938
  122   1HD2  LEU  18          1HD2      LEU  18  -7.980   9.307  10.976
  123   2HD2  LEU  18          2HD2      LEU  18  -8.044   7.670  10.325
  124   3HD2  LEU  18          3HD2      LEU  18  -7.104   8.912   9.498
  125    H    TRP  19           HN       TRP  19  -5.945   4.718   8.480
  126    HA   TRP  19           HA       TRP  19  -4.630   2.349   9.647
  127   1HB   TRP  19          HB2       TRP  19  -5.908   2.518   6.912
  128   2HB   TRP  19          HB1       TRP  19  -5.239   1.084   7.678
  129    HD1  TRP  19           HD1      TRP  19  -6.699  -0.038   9.658
  130    HE1  TRP  19           HE1      TRP  19  -9.225   0.055  10.145
  131    HE3  TRP  19           HE3      TRP  19  -7.930   4.011   6.790
  132    HZ2  TRP  19           HZ2      TRP  19 -11.448   1.630   9.401
  133    HZ3  TRP  19           HZ3      TRP  19 -10.278   4.742   6.726
  134    HH2  TRP  19           HH2      TRP  19 -11.999   3.576   8.005
  135    H    PHE  20           HN       PHE  20  -3.462   4.985   9.039
  136    HA   PHE  20           HA       PHE  20  -1.626   4.230   6.867
  137   1HB   PHE  20          HB2       PHE  20  -2.305   6.970   7.958
  138   2HB   PHE  20          HB1       PHE  20  -1.086   6.660   6.727
  139    HD1  PHE  20           HD1      PHE  20  -1.756   7.302   4.646
  140    HD2  PHE  20           HD2      PHE  20  -4.630   5.582   7.271
  141    HE1  PHE  20           HE1      PHE  20  -3.470   7.499   2.893
  142    HE2  PHE  20           HE2      PHE  20  -6.347   5.771   5.521
  143    HZ   PHE  20           HZ       PHE  20  -5.768   6.732   3.328
  144    H    HIS  21           HN       HIS  21   0.486   3.994   7.247
  145    HA   HIS  21           HA       HIS  21   1.627   4.977   9.762
  146   1HB   HIS  21          HB2       HIS  21   0.838   2.592  10.028
  147   2HB   HIS  21          HB1       HIS  21   2.009   2.131   8.800
  148    HD1  HIS  21           HD1      HIS  21   4.607   2.746   9.509
  149    HD2  HIS  21           HD2      HIS  21   1.787   2.547  12.553
  150    HE1  HIS  21           HE1      HIS  21   5.928   2.488  11.632
  151    HE2  HIS  21           HE2      HIS  21   4.198   2.293  13.452
  152    H    GLY  22           HN       GLY  22   4.129   4.690   9.701
  153   1HA   GLY  22          HA2       GLY  22   4.993   5.457   7.017
  154   2HA   GLY  22          HA1       GLY  22   5.849   5.791   8.513
  155    H    ARG  23           HN       ARG  23   7.761   4.813   8.391
  156    HA   ARG  23           HA       ARG  23   8.475   2.715   6.788
  157   1HB   ARG  23          HB2       ARG  23  10.385   2.337   8.355
  158   2HB   ARG  23          HB1       ARG  23  10.188   3.985   7.792
  159   1HG   ARG  23          HG2       ARG  23   9.271   4.668   9.888
  160   2HG   ARG  23          HG1       ARG  23   9.195   2.997  10.453
  161   1HD   ARG  23          HD2       ARG  23  11.716   4.508   9.772
  162   2HD   ARG  23          HD1       ARG  23  11.113   4.201  11.401
  163    HE   ARG  23           HE       ARG  23  11.329   1.741  10.140
  164   1HH1  ARG  23          HH11      ARG  23  13.467   4.330  11.082
  165   2HH1  ARG  23          HH12      ARG  23  14.818   3.284  11.357
  166   1HH2  ARG  23          HH21      ARG  23  13.103   0.362  10.496
  167   2HH2  ARG  23          HH22      ARG  23  14.613   1.030  11.021
  168    H    ILE  24           HN       ILE  24   7.276   0.957   6.665
  169    HA   ILE  24           HA       ILE  24   7.190  -0.780   9.036
  170    HB   ILE  24           HB       ILE  24   5.057  -0.384   6.941
  171   1HG1  ILE  24          2HG1      ILE  24   5.057  -0.281   9.957
  172   2HG1  ILE  24          1HG1      ILE  24   4.934   1.088   8.859
  173   1HG2  ILE  24          1HG2      ILE  24   5.281  -2.653   8.913
  174   2HG2  ILE  24          2HG2      ILE  24   5.367  -2.777   7.156
  175   3HG2  ILE  24          3HG2      ILE  24   3.860  -2.290   7.933
  176   1HD1  ILE  24          1HD1      ILE  24   2.908  -1.124   8.939
  177   2HD1  ILE  24          2HD1      ILE  24   2.768   0.453   8.164
  178   3HD1  ILE  24          3HD1      ILE  24   2.789   0.334   9.923
  179    H    SER  25           HN       SER  25   8.819  -2.121   8.643
  180    HA   SER  25           HA       SER  25  10.166  -2.813   6.467
  181   1HB   SER  25          HB2       SER  25   9.263  -4.791   8.568
  182   2HB   SER  25          HB1       SER  25  10.614  -5.031   7.459
  183    HG   SER  25           HG       SER  25  11.803  -3.756   8.642
  184    H    ARG  26           HN       ARG  26   9.029  -2.828   4.542
  185    HA   ARG  26           HA       ARG  26   6.733  -4.210   3.899
  186   1HB   ARG  26          HB2       ARG  26   7.789  -4.305   1.531
  187   2HB   ARG  26          HB1       ARG  26   7.486  -2.724   2.248
  188   1HG   ARG  26          HG2       ARG  26   9.590  -2.219   1.910
  189   2HG   ARG  26          HG1       ARG  26  10.062  -3.467   3.049
  190   1HD   ARG  26          HD2       ARG  26  10.566  -4.966   1.371
  191   2HD   ARG  26          HD1       ARG  26   9.486  -4.185   0.211
  192    HE   ARG  26           HE       ARG  26  11.303  -2.999  -0.470
  193   1HH1  ARG  26          HH11      ARG  26  11.812  -3.854   2.876
  194   2HH1  ARG  26          HH12      ARG  26  13.152  -2.779   3.083
  195   1HH2  ARG  26          HH21      ARG  26  13.050  -1.539  -0.174
  196   2HH2  ARG  26          HH22      ARG  26  13.855  -1.476   1.358
  197    H    GLU  27           HN       GLU  27  10.083  -5.391   3.767
  198    HA   GLU  27           HA       GLU  27   9.526  -7.934   2.724
  199   1HB   GLU  27          HB2       GLU  27  11.753  -7.116   4.600
  200   2HB   GLU  27          HB1       GLU  27  11.710  -8.596   3.652
  201   1HG   GLU  27          HG2       GLU  27  11.709  -7.255   1.594
  202   2HG   GLU  27          HG1       GLU  27  11.810  -5.792   2.570
  203    H    GLU  28           HN       GLU  28   9.810  -6.843   6.096
  204    HA   GLU  28           HA       GLU  28   9.107  -9.438   7.129
  205   1HB   GLU  28          HB2       GLU  28   9.365  -6.775   8.533
  206   2HB   GLU  28          HB1       GLU  28   9.178  -8.331   9.330
  207   1HG   GLU  28          HG2       GLU  28  11.493  -7.499   7.595
  208   2HG   GLU  28          HG1       GLU  28  11.491  -7.591   9.356
  209    H    SER  29           HN       SER  29   7.387  -6.677   6.064
  210    HA   SER  29           HA       SER  29   5.104  -6.878   7.723
  211   1HB   SER  29          HB2       SER  29   5.621  -4.852   6.427
  212   2HB   SER  29          HB1       SER  29   5.341  -5.737   4.928
  213    HG   SER  29           HG       SER  29   3.567  -4.461   6.381
  214    H    GLN  30           HN       GLN  30   5.800  -8.104   4.461
  215    HA   GLN  30           HA       GLN  30   3.355  -9.283   3.935
  216   1HB   GLN  30          HB2       GLN  30   4.659 -10.851   2.454
  217   2HB   GLN  30          HB1       GLN  30   4.938  -9.139   2.176
  218   1HG   GLN  30          HG2       GLN  30   7.013  -9.280   3.452
  219   2HG   GLN  30          HG1       GLN  30   6.734 -10.999   3.713
  220    H    ARG  31           HN       ARG  31   5.828 -10.268   6.137
  221    HA   ARG  31           HA       ARG  31   5.001 -12.995   6.377
  222   1HB   ARG  31          HB2       ARG  31   7.270 -12.291   6.980
  223   2HB   ARG  31          HB1       ARG  31   6.624 -11.263   8.252
  224   1HG   ARG  31          HG2       ARG  31   5.771 -13.228   9.418
  225   2HG   ARG  31          HG1       ARG  31   6.405 -14.264   8.138
  226   1HD   ARG  31          HD2       ARG  31   8.036 -12.462   9.927
  227   2HD   ARG  31          HD1       ARG  31   7.896 -14.212  10.081
  228    HE   ARG  31           HE       ARG  31   9.629 -12.807   8.346
  229   1HH1  ARG  31          HH11      ARG  31   7.639 -15.672   8.502
  230   2HH1  ARG  31          HH12      ARG  31   8.551 -16.521   7.300
  231   1HH2  ARG  31          HH21      ARG  31  10.832 -13.926   6.771
  232   2HH2  ARG  31          HH22      ARG  31  10.364 -15.532   6.320
  233    H    LEU  32           HN       LEU  32   4.485 -10.052   8.305
  234    HA   LEU  32           HA       LEU  32   2.824 -11.283  10.248
  235   1HB   LEU  32          HB2       LEU  32   2.991  -8.387   9.415
  236   2HB   LEU  32          HB1       LEU  32   2.289  -8.991  10.906
  237    HG   LEU  32           HG       LEU  32   5.146  -9.614  10.301
  238   1HD1  LEU  32          1HD1      LEU  32   5.734  -7.506  11.529
  239   2HD1  LEU  32          2HD1      LEU  32   4.071  -6.979  11.268
  240   3HD1  LEU  32          3HD1      LEU  32   5.125  -7.289   9.888
  241   1HD2  LEU  32          1HD2      LEU  32   3.449  -9.266  12.754
  242   2HD2  LEU  32          2HD2      LEU  32   5.210  -9.294  12.829
  243   3HD2  LEU  32          3HD2      LEU  32   4.333 -10.696  12.218
  244    H    ILE  33           HN       ILE  33   2.034  -9.106   7.532
  245    HA   ILE  33           HA       ILE  33  -0.785  -9.560   7.797
  246    HB   ILE  33           HB       ILE  33   0.798  -8.229   5.590
  247   1HG1  ILE  33          2HG1      ILE  33  -0.180  -6.149   6.572
  248   2HG1  ILE  33          1HG1      ILE  33  -0.836  -7.121   7.884
  249   1HG2  ILE  33          1HG2      ILE  33  -1.580  -7.218   5.162
  250   2HG2  ILE  33          2HG2      ILE  33  -2.124  -8.718   5.913
  251   3HG2  ILE  33          3HG2      ILE  33  -1.126  -8.771   4.460
  252   1HD1  ILE  33          1HD1      ILE  33   2.095  -7.109   7.289
  253   2HD1  ILE  33          2HD1      ILE  33   1.263  -7.532   8.786
  254   3HD1  ILE  33          3HD1      ILE  33   1.349  -5.847   8.270
  255    H    GLY  34           HN       GLY  34   1.593 -11.564   6.697
  256   1HA   GLY  34          HA2       GLY  34   0.004 -12.635   4.485
  257   2HA   GLY  34          HA1       GLY  34   1.651 -13.103   4.895
  258    H    GLN  35           HN       GLN  35  -0.513 -12.785   7.485
  259    HA   GLN  35           HA       GLN  35  -0.654 -15.688   7.789
  260   1HB   GLN  35          HB2       GLN  35  -1.210 -15.283  10.099
  261   2HB   GLN  35          HB1       GLN  35   0.191 -14.297   9.705
  262   1HG   GLN  35          HG2       GLN  35  -1.312 -12.357   9.411
  263   2HG   GLN  35          HG1       GLN  35  -2.661 -13.367   9.926
  264    H    GLN  36           HN       GLN  36  -2.402 -12.946   6.765
  265    HA   GLN  36           HA       GLN  36  -5.010 -13.978   7.419
  266   1HB   GLN  36          HB2       GLN  36  -4.014 -11.575   5.938
  267   2HB   GLN  36          HB1       GLN  36  -5.692 -12.068   5.766
  268   1HG   GLN  36          HG2       GLN  36  -6.111 -10.866   7.575
  269   2HG   GLN  36          HG1       GLN  36  -5.273 -12.115   8.492
  270    H    GLY  37           HN       GLY  37  -6.156 -15.375   6.238
  271   1HA   GLY  37          HA2       GLY  37  -5.124 -16.090   3.582
  272   2HA   GLY  37          HA1       GLY  37  -6.178 -17.087   4.579
  273    H    LEU  38           HN       LEU  38  -6.860 -13.707   4.166
  274    HA   LEU  38           HA       LEU  38  -9.398 -14.344   2.966
  275   1HB   LEU  38          HB2       LEU  38  -8.122 -11.707   3.682
  276   2HB   LEU  38          HB1       LEU  38  -9.740 -11.870   3.027
  277    HG   LEU  38           HG       LEU  38  -9.825 -11.561   5.434
  278   1HD1  LEU  38          1HD1      LEU  38 -11.484 -13.019   4.289
  279   2HD1  LEU  38          2HD1      LEU  38 -11.252 -13.394   5.997
  280   3HD1  LEU  38          3HD1      LEU  38 -10.513 -14.414   4.762
  281   1HD2  LEU  38          1HD2      LEU  38  -8.752 -12.916   6.992
  282   2HD2  LEU  38          2HD2      LEU  38  -7.530 -12.685   5.744
  283   3HD2  LEU  38          3HD2      LEU  38  -8.442 -14.191   5.815
  284    H    VAL  39           HN       VAL  39 -10.042 -12.543   1.194
  285    HA   VAL  39           HA       VAL  39  -8.497 -13.248  -1.117
  286    HB   VAL  39           HB       VAL  39 -10.211 -12.031  -2.388
  287   1HG1  VAL  39          1HG1      VAL  39 -12.076 -13.493  -1.880
  288   2HG1  VAL  39          2HG1      VAL  39 -11.397 -13.847  -0.291
  289   3HG1  VAL  39          3HG1      VAL  39 -10.560 -14.386  -1.746
  290   1HG2  VAL  39          1HG2      VAL  39 -10.764 -10.936   0.262
  291   2HG2  VAL  39          2HG2      VAL  39 -12.213 -11.479  -0.587
  292   3HG2  VAL  39          3HG2      VAL  39 -11.147 -10.289  -1.335
  293    H    ASP  40           HN       ASP  40  -8.305 -11.434  -2.840
  294    HA   ASP  40           HA       ASP  40  -6.265  -9.680  -1.962
  295   1HB   ASP  40          HB2       ASP  40  -7.906  -9.436  -4.490
  296   2HB   ASP  40          HB1       ASP  40  -6.292  -8.797  -4.201
  297    H    GLY  41           HN       GLY  41  -8.132  -9.177  -0.213
  298   1HA   GLY  41          HA2       GLY  41  -9.063  -6.473  -1.010
  299   2HA   GLY  41          HA1       GLY  41 -10.179  -7.583  -0.222
  300    H    LEU  42           HN       LEU  42  -7.331  -8.267   1.173
  301    HA   LEU  42           HA       LEU  42  -7.910  -6.419   3.357
  302   1HB   LEU  42          HB2       LEU  42  -6.334  -8.991   3.258
  303   2HB   LEU  42          HB1       LEU  42  -6.380  -7.950   4.665
  304    HG   LEU  42           HG       LEU  42  -7.914  -9.914   4.786
  305   1HD1  LEU  42          1HD1      LEU  42  -9.586  -7.440   4.744
  306   2HD1  LEU  42          2HD1      LEU  42  -8.258  -7.592   5.894
  307   3HD1  LEU  42          3HD1      LEU  42  -9.574  -8.767   5.905
  308   1HD2  LEU  42          1HD2      LEU  42  -9.508  -8.469   2.680
  309   2HD2  LEU  42          2HD2      LEU  42  -9.896 -10.002   3.457
  310   3HD2  LEU  42          3HD2      LEU  42  -8.514  -9.893   2.366
  311    H    PHE  43           HN       PHE  43  -6.984  -4.591   2.762
  312    HA   PHE  43           HA       PHE  43  -4.086  -4.686   2.275
  313   1HB   PHE  43          HB2       PHE  43  -4.305  -2.763   0.797
  314   2HB   PHE  43          HB1       PHE  43  -5.293  -4.105   0.239
  315    HD1  PHE  43           HD1      PHE  43  -6.053  -1.955  -1.111
  316    HD2  PHE  43           HD2      PHE  43  -6.986  -2.706   2.972
  317    HE1  PHE  43           HE1      PHE  43  -7.984  -0.443  -1.271
  318    HE2  PHE  43           HE2      PHE  43  -8.910  -1.196   2.818
  319    HZ   PHE  43           HZ       PHE  43  -9.413  -0.060   0.694
  320    H    LEU  44           HN       LEU  44  -2.950  -2.588   2.682
  321    HA   LEU  44           HA       LEU  44  -4.128  -0.974   4.819
  322   1HB   LEU  44          HB2       LEU  44  -2.815  -2.748   5.929
  323   2HB   LEU  44          HB1       LEU  44  -1.401  -2.266   5.012
  324    HG   LEU  44           HG       LEU  44  -1.419  -0.065   6.140
  325   1HD1  LEU  44          1HD1      LEU  44  -2.904   0.400   7.953
  326   2HD1  LEU  44          2HD1      LEU  44  -3.629  -1.203   7.842
  327   3HD1  LEU  44          3HD1      LEU  44  -3.877  -0.033   6.548
  328   1HD2  LEU  44          1HD2      LEU  44  -1.560  -2.038   8.361
  329   2HD2  LEU  44          2HD2      LEU  44  -0.337  -0.820   8.002
  330   3HD2  LEU  44          3HD2      LEU  44  -0.390  -2.316   7.071
  331    H    VAL  45           HN       VAL  45  -3.085   1.107   5.065
  332    HA   VAL  45           HA       VAL  45  -1.622   1.869   2.628
  333    HB   VAL  45           HB       VAL  45  -3.278   3.617   4.452
  334   1HG1  VAL  45          1HG1      VAL  45  -1.703   5.085   3.602
  335   2HG1  VAL  45          2HG1      VAL  45  -2.985   5.187   2.396
  336   3HG1  VAL  45          3HG1      VAL  45  -1.553   4.207   2.080
  337   1HG2  VAL  45          1HG2      VAL  45  -3.789   2.409   1.744
  338   2HG2  VAL  45          2HG2      VAL  45  -4.705   3.784   2.365
  339   3HG2  VAL  45          3HG2      VAL  45  -4.748   2.240   3.215
  340    H    ARG  46           HN       ARG  46   0.270   0.938   3.897
  341    HA   ARG  46           HA       ARG  46   1.352   2.822   5.872
  342   1HB   ARG  46          HB2       ARG  46   2.978   1.057   6.289
  343   2HB   ARG  46          HB1       ARG  46   1.348   0.383   6.348
  344   1HG   ARG  46          HG2       ARG  46   1.565  -0.458   4.102
  345   2HG   ARG  46          HG1       ARG  46   3.148   0.299   3.940
  346   1HD   ARG  46          HD2       ARG  46   3.362  -1.202   6.226
  347   2HD   ARG  46          HD1       ARG  46   2.383  -2.192   5.145
  348    HE   ARG  46           HE       ARG  46   4.311  -2.642   4.040
  349   1HH1  ARG  46          HH11      ARG  46   4.601   0.593   5.321
  350   2HH1  ARG  46          HH12      ARG  46   6.189   0.832   4.678
  351   1HH2  ARG  46          HH21      ARG  46   6.386  -2.325   3.211
  352   2HH2  ARG  46          HH22      ARG  46   7.206  -0.835   3.489
  353    H    GLU  47           HN       GLU  47   3.710   3.369   5.615
  354    HA   GLU  47           HA       GLU  47   4.592   3.204   2.854
  355   1HB   GLU  47          HB2       GLU  47   4.960   5.555   2.621
  356   2HB   GLU  47          HB1       GLU  47   3.295   5.319   3.105
  357   1HG   GLU  47          HG2       GLU  47   4.015   5.802   5.455
  358   2HG   GLU  47          HG1       GLU  47   5.584   6.271   4.800
  359    H    SER  48           HN       SER  48   6.685   5.162   3.242
  360    HA   SER  48           HA       SER  48   8.324   3.848   5.279
  361   1HB   SER  48          HB2       SER  48  10.276   3.967   3.723
  362   2HB   SER  48          HB1       SER  48   9.029   2.854   3.182
  363    HG   SER  48           HG       SER  48   9.628   4.065   1.443
  364    H    GLN  49           HN       GLN  49   9.749   5.189   6.337
  365    HA   GLN  49           HA       GLN  49   9.288   8.036   5.846
  366   1HB   GLN  49          HB2       GLN  49  10.012   8.410   8.120
  367   2HB   GLN  49          HB1       GLN  49   8.817   7.115   8.119
  368   1HG   GLN  49          HG2       GLN  49  10.486   6.439   9.612
  369   2HG   GLN  49          HG1       GLN  49  10.763   5.508   8.147
  370    H    ARG  50           HN       ARG  50  11.122   6.088   4.427
  371    HA   ARG  50           HA       ARG  50  13.587   7.667   4.660
  372   1HB   ARG  50          HB2       ARG  50  13.913   5.354   5.454
  373   2HB   ARG  50          HB1       ARG  50  13.339   4.747   3.908
  374   1HG   ARG  50          HG2       ARG  50  15.681   4.602   3.832
  375   2HG   ARG  50          HG1       ARG  50  15.256   6.002   2.846
  376   1HD   ARG  50          HD2       ARG  50  16.154   6.124   5.724
  377   2HD   ARG  50          HD1       ARG  50  17.202   6.393   4.333
  378    HE   ARG  50           HE       ARG  50  15.442   8.269   5.514
  379   1HH1  ARG  50          HH11      ARG  50  16.695   7.249   2.419
  380   2HH1  ARG  50          HH12      ARG  50  16.442   8.788   1.671
  381   1HH2  ARG  50          HH21      ARG  50  15.113  10.295   4.529
  382   2HH2  ARG  50          HH22      ARG  50  15.547  10.517   2.867
  383    H    ASN  51           HN       ASN  51  11.355   5.939   2.486
  384    HA   ASN  51           HA       ASN  51  12.776   6.874   0.152
  385   1HB   ASN  51          HB2       ASN  51  10.051   5.585   0.322
  386   2HB   ASN  51          HB1       ASN  51  11.045   5.760  -1.121
  387   1HD2  ASN  51          1HD2      ASN  51  13.255   5.184   1.183
  388   2HD2  ASN  51          2HD2      ASN  51  13.314   3.465   1.129
  389    HA   PRO  52           HA       PRO  52  10.897  11.002   0.330
  390   1HB   PRO  52          HB2       PRO  52  11.713  10.819  -2.544
  391   2HB   PRO  52          HB1       PRO  52  11.952  12.139  -1.393
  392   1HG   PRO  52          HG2       PRO  52  13.966  10.519  -2.043
  393   2HG   PRO  52          HG1       PRO  52  13.768  11.110  -0.383
  394   1HD   PRO  52          HD2       PRO  52  13.235   8.409  -1.509
  395   2HD   PRO  52          HD1       PRO  52  13.754   8.873   0.123
  396    H    GLN  53           HN       GLN  53  10.422   8.523  -2.065
  397    HA   GLN  53           HA       GLN  53   7.655   9.408  -2.631
  398   1HB   GLN  53          HB2       GLN  53   9.374   7.428  -4.148
  399   2HB   GLN  53          HB1       GLN  53   7.837   8.109  -4.659
  400   1HG   GLN  53          HG2       GLN  53   8.858  10.317  -4.820
  401   2HG   GLN  53          HG1       GLN  53  10.397   9.643  -4.294
  402    H    GLY  54           HN       GLY  54   7.956   8.332  -0.185
  403   1HA   GLY  54          HA2       GLY  54   7.384   5.473  -0.463
  404   2HA   GLY  54          HA1       GLY  54   7.950   6.260   0.995
  405    H    PHE  55           HN       PHE  55   5.237   5.583  -1.027
  406    HA   PHE  55           HA       PHE  55   3.405   5.934   1.234
  407   1HB   PHE  55          HB2       PHE  55   2.828   6.966  -1.569
  408   2HB   PHE  55          HB1       PHE  55   1.700   6.969  -0.218
  409    HD1  PHE  55           HD1      PHE  55   5.150   8.177  -0.992
  410    HD2  PHE  55           HD2      PHE  55   1.411   8.950   0.886
  411    HE1  PHE  55           HE1      PHE  55   5.947  10.409  -0.332
  412    HE2  PHE  55           HE2      PHE  55   2.200  11.184   1.547
  413    HZ   PHE  55           HZ       PHE  55   4.472  11.916   0.937
  414    H    VAL  56           HN       VAL  56   3.152   3.733   1.487
  415    HA   VAL  56           HA       VAL  56   2.565   2.200  -0.928
  416    HB   VAL  56           HB       VAL  56   3.989   0.660  -0.226
  417   1HG1  VAL  56          1HG1      VAL  56   5.479   1.015   1.405
  418   2HG1  VAL  56          2HG1      VAL  56   4.248   1.351   2.619
  419   3HG1  VAL  56          3HG1      VAL  56   4.725   2.604   1.469
  420   1HG2  VAL  56          1HG2      VAL  56   3.418  -0.820   1.640
  421   2HG2  VAL  56          2HG2      VAL  56   2.035  -0.505   0.593
  422   3HG2  VAL  56          3HG2      VAL  56   2.175   0.318   2.149
  423    H    LEU  57           HN       LEU  57   1.108   0.707  -1.117
  424    HA   LEU  57           HA       LEU  57  -1.092   0.634   0.814
  425   1HB   LEU  57          HB2       LEU  57  -1.534   1.747  -1.514
  426   2HB   LEU  57          HB1       LEU  57  -1.432   0.110  -2.135
  427    HG   LEU  57           HG       LEU  57  -3.463   1.241  -0.229
  428   1HD1  LEU  57          1HD1      LEU  57  -3.946  -0.306  -2.747
  429   2HD1  LEU  57          2HD1      LEU  57  -3.654   1.433  -2.773
  430   3HD1  LEU  57          3HD1      LEU  57  -5.033   0.782  -1.886
  431   1HD2  LEU  57          1HD2      LEU  57  -2.711  -0.940   0.613
  432   2HD2  LEU  57          2HD2      LEU  57  -3.074  -1.656  -0.960
  433   3HD2  LEU  57          3HD2      LEU  57  -4.374  -0.985   0.023
  434    H    SER  58           HN       SER  58  -1.026  -1.351   1.730
  435    HA   SER  58           HA       SER  58   0.448  -3.443   0.331
  436   1HB   SER  58          HB2       SER  58  -0.571  -3.514   3.172
  437   2HB   SER  58          HB1       SER  58   0.719  -4.485   2.459
  438    HG   SER  58           HG       SER  58   0.822  -1.661   2.655
  439    H    LEU  59           HN       LEU  59  -0.453  -5.182  -0.494
  440    HA   LEU  59           HA       LEU  59  -3.343  -5.513  -0.203
  441   1HB   LEU  59          HB2       LEU  59  -1.332  -6.414  -2.241
  442   2HB   LEU  59          HB1       LEU  59  -2.935  -7.121  -2.175
  443    HG   LEU  59           HG       LEU  59  -2.520  -5.215  -3.844
  444   1HD1  LEU  59          1HD1      LEU  59  -4.793  -5.650  -2.024
  445   2HD1  LEU  59          2HD1      LEU  59  -4.722  -5.665  -3.787
  446   3HD1  LEU  59          3HD1      LEU  59  -4.802  -4.130  -2.920
  447   1HD2  LEU  59          1HD2      LEU  59  -2.845  -3.574  -1.334
  448   2HD2  LEU  59          2HD2      LEU  59  -2.751  -2.964  -2.987
  449   3HD2  LEU  59          3HD2      LEU  59  -1.347  -3.739  -2.251
  450    H    CYS  60           HN       CYS  60  -4.199  -7.717  -0.131
  451    HA   CYS  60           HA       CYS  60  -2.466  -9.726   1.027
  452   1HB   CYS  60          HB2       CYS  60  -3.546  -8.479   2.943
  453   2HB   CYS  60          HB1       CYS  60  -5.103  -8.964   2.288
  454    HG   CYS  60           HG       CYS  60  -3.972 -11.784   2.439
  455    H    HIS  61           HN       HIS  61  -2.674 -10.574  -0.953
  456    HA   HIS  61           HA       HIS  61  -5.290 -11.254  -1.924
  457   1HB   HIS  61          HB2       HIS  61  -4.084 -10.499  -3.658
  458   2HB   HIS  61          HB1       HIS  61  -2.559 -10.981  -2.972
  459    HD1  HIS  61           HD1      HIS  61  -5.544 -12.954  -4.343
  460    HD2  HIS  61           HD2      HIS  61  -1.426 -12.694  -4.723
  461    HE1  HIS  61           HE1      HIS  61  -4.926 -14.680  -6.051
  462    HE2  HIS  61           HE2      HIS  61  -2.442 -14.419  -6.356
  463    H    LEU  62           HN       LEU  62  -5.465 -13.633  -2.810
  464    HA   LEU  62           HA       LEU  62  -4.637 -15.284  -0.546
  465   1HB   LEU  62          HB2       LEU  62  -6.271 -16.955  -1.344
  466   2HB   LEU  62          HB1       LEU  62  -6.981 -15.406  -0.957
  467    HG   LEU  62           HG       LEU  62  -7.945 -16.515  -2.966
  468   1HD1  LEU  62          1HD1      LEU  62  -7.306 -13.829  -2.599
  469   2HD1  LEU  62          2HD1      LEU  62  -8.537 -14.505  -3.663
  470   3HD1  LEU  62          3HD1      LEU  62  -6.920 -14.177  -4.286
  471   1HD2  LEU  62          1HD2      LEU  62  -5.319 -15.869  -4.279
  472   2HD2  LEU  62          2HD2      LEU  62  -6.733 -16.606  -5.027
  473   3HD2  LEU  62          3HD2      LEU  62  -5.827 -17.487  -3.799
  474    H    GLN  63           HN       GLN  63  -2.714 -14.604  -2.087
  475    HA   GLN  63           HA       GLN  63  -1.656 -17.151  -2.500
  476   1HB   GLN  63          HB2       GLN  63  -1.493 -15.217  -4.813
  477   2HB   GLN  63          HB1       GLN  63  -0.677 -16.763  -4.723
  478   1HG   GLN  63          HG2       GLN  63  -3.659 -16.392  -4.747
  479   2HG   GLN  63          HG1       GLN  63  -2.678 -16.799  -6.149
  480    H    LYS  64           HN       LYS  64  -1.356 -13.669  -2.466
  481    HA   LYS  64           HA       LYS  64   1.103 -13.965  -0.978
  482   1HB   LYS  64          HB2       LYS  64   2.286 -12.290  -2.498
  483   2HB   LYS  64          HB1       LYS  64   2.125 -13.940  -3.088
  484   1HG   LYS  64          HG2       LYS  64   0.380 -13.340  -4.563
  485   2HG   LYS  64          HG1       LYS  64   0.204 -11.752  -3.819
  486   1HD   LYS  64          HD2       LYS  64   2.404 -11.113  -4.629
  487   2HD   LYS  64          HD1       LYS  64   2.630 -12.716  -5.326
  488   1HE   LYS  64          HE2       LYS  64   0.733 -12.339  -6.817
  489   2HE   LYS  64          HE1       LYS  64   0.489 -10.742  -6.111
  490   1HZ   LYS  64          HZ1       LYS  64   1.916 -11.158  -8.303
  491   2HZ   LYS  64          HZ2       LYS  64   3.148 -11.293  -7.151
  492   3HZ   LYS  64          HZ3       LYS  64   2.222  -9.881  -7.237
  493    H    VAL  65           HN       VAL  65   2.077 -11.631  -0.660
  494    HA   VAL  65           HA       VAL  65   0.023  -9.595  -0.280
  495    HB   VAL  65           HB       VAL  65   0.774  -9.098   2.002
  496   1HG1  VAL  65          1HG1      VAL  65   0.069 -11.481   2.971
  497   2HG1  VAL  65          2HG1      VAL  65  -0.429 -11.705   1.296
  498   3HG1  VAL  65          3HG1      VAL  65  -1.087 -10.370   2.242
  499   1HG2  VAL  65          1HG2      VAL  65   2.214 -10.673   3.208
  500   2HG2  VAL  65          2HG2      VAL  65   3.041  -9.930   1.840
  501   3HG2  VAL  65          3HG2      VAL  65   2.450 -11.586   1.716
  502    H    LYS  66           HN       LYS  66   0.824  -7.591  -0.878
  503    HA   LYS  66           HA       LYS  66   3.745  -7.252  -0.877
  504   1HB   LYS  66          HB2       LYS  66   3.389  -6.120  -3.217
  505   2HB   LYS  66          HB1       LYS  66   3.614  -7.856  -3.077
  506   1HG   LYS  66          HG2       LYS  66   0.848  -6.760  -3.036
  507   2HG   LYS  66          HG1       LYS  66   1.716  -6.852  -4.570
  508   1HD   LYS  66          HD2       LYS  66   2.043  -9.223  -4.298
  509   2HD   LYS  66          HD1       LYS  66   1.342  -9.175  -2.682
  510   1HE   LYS  66          HE2       LYS  66  -0.125  -8.463  -5.214
  511   2HE   LYS  66          HE1       LYS  66  -0.215 -10.028  -4.410
  512   1HZ   LYS  66          HZ1       LYS  66  -1.507  -7.552  -3.745
  513   2HZ   LYS  66          HZ2       LYS  66  -0.771  -8.291  -2.416
  514   3HZ   LYS  66          HZ3       LYS  66  -1.924  -9.134  -3.319
  515    H    HIS  67           HN       HIS  67   4.128  -4.901  -2.045
  516    HA   HIS  67           HA       HIS  67   2.407  -2.939  -0.675
  517   1HB   HIS  67          HB2       HIS  67   5.420  -2.747  -0.743
  518   2HB   HIS  67          HB1       HIS  67   4.298  -1.798   0.224
  519    HD1  HIS  67           HD1      HIS  67   3.251  -2.998   2.323
  520    HD2  HIS  67           HD2      HIS  67   6.197  -5.159   0.346
  521    HE1  HIS  67           HE1      HIS  67   3.875  -4.871   3.882
  522    HE2  HIS  67           HE2      HIS  67   5.579  -6.227   2.617
  523    H    TYR  68           HN       TYR  68   2.469  -0.798  -1.584
  524    HA   TYR  68           HA       TYR  68   3.833  -0.447  -4.162
  525   1HB   TYR  68          HB2       TYR  68   0.901   0.154  -3.720
  526   2HB   TYR  68          HB1       TYR  68   1.809   0.473  -5.183
  527    HD1  TYR  68           HD1      TYR  68   1.398  -0.946  -6.930
  528    HD2  TYR  68           HD2      TYR  68   1.095  -2.477  -2.972
  529    HE1  TYR  68           HE1      TYR  68   0.667  -3.112  -7.831
  530    HE2  TYR  68           HE2      TYR  68   0.373  -4.655  -3.865
  531    HH   TYR  68           HH       TYR  68  -0.868  -5.371  -6.186
  532    H    LEU  69           HN       LEU  69   5.229   1.099  -2.833
  533    HA   LEU  69           HA       LEU  69   3.676   3.489  -2.134
  534   1HB   LEU  69          HB2       LEU  69   5.301   4.102  -0.483
  535   2HB   LEU  69          HB1       LEU  69   4.664   2.530  -0.209
  536    HG   LEU  69           HG       LEU  69   6.630   1.488  -0.649
  537   1HD1  LEU  69          1HD1      LEU  69   8.634   2.487  -1.579
  538   2HD1  LEU  69          2HD1      LEU  69   7.798   4.028  -1.761
  539   3HD1  LEU  69          3HD1      LEU  69   7.295   2.634  -2.719
  540   1HD2  LEU  69          1HD2      LEU  69   8.323   2.947   0.673
  541   2HD2  LEU  69          2HD2      LEU  69   6.873   2.337   1.464
  542   3HD2  LEU  69          3HD2      LEU  69   6.931   4.004   0.895
  543    H    ILE  70           HN       ILE  70   4.564   3.278  -4.716
  544    HA   ILE  70           HA       ILE  70   6.738   5.270  -4.717
  545    HB   ILE  70           HB       ILE  70   5.853   3.694  -7.114
  546   1HG1  ILE  70          2HG1      ILE  70   8.145   3.139  -5.202
  547   2HG1  ILE  70          1HG1      ILE  70   6.701   2.148  -5.363
  548   1HG2  ILE  70          1HG2      ILE  70   8.342   4.357  -7.641
  549   2HG2  ILE  70          2HG2      ILE  70   8.008   5.637  -6.475
  550   3HG2  ILE  70          3HG2      ILE  70   7.020   5.489  -7.927
  551   1HD1  ILE  70          1HD1      ILE  70   9.100   2.266  -7.020
  552   2HD1  ILE  70          2HD1      ILE  70   7.580   2.180  -7.909
  553   3HD1  ILE  70          3HD1      ILE  70   7.980   0.937  -6.727
  554    H    LEU  71           HN       LEU  71   4.096   5.884  -4.116
  555    HA   LEU  71           HA       LEU  71   3.216   7.492  -6.359
  556   1HB   LEU  71          HB2       LEU  71   1.262   7.510  -4.329
  557   2HB   LEU  71          HB1       LEU  71   1.177   6.717  -5.879
  558    HG   LEU  71           HG       LEU  71   2.338   5.458  -3.397
  559   1HD1  LEU  71          1HD1      LEU  71  -0.391   5.459  -4.583
  560   2HD1  LEU  71          2HD1      LEU  71   0.092   5.652  -2.898
  561   3HD1  LEU  71          3HD1      LEU  71   0.181   4.065  -3.668
  562   1HD2  LEU  71          1HD2      LEU  71   3.016   4.670  -5.814
  563   2HD2  LEU  71          2HD2      LEU  71   1.403   3.964  -5.813
  564   3HD2  LEU  71          3HD2      LEU  71   2.571   3.487  -4.585
  565    HA   PRO  72           HA       PRO  72   4.843  10.559  -3.194
  566   1HB   PRO  72          HB2       PRO  72   6.490  11.876  -4.895
  567   2HB   PRO  72          HB1       PRO  72   7.012  10.461  -3.976
  568   1HG   PRO  72          HG2       PRO  72   6.070  10.625  -6.817
  569   2HG   PRO  72          HG1       PRO  72   7.473   9.766  -6.160
  570   1HD   PRO  72          HD2       PRO  72   5.178   8.493  -6.724
  571   2HD   PRO  72          HD1       PRO  72   6.180   8.026  -5.338
  572    H    SER  73           HN       SER  73   3.060  11.860  -3.026
  573    HA   SER  73           HA       SER  73   1.432  12.880  -4.959
  574   1HB   SER  73          HB2       SER  73   0.887  14.720  -3.407
  575   2HB   SER  73          HB1       SER  73   0.997  13.178  -2.560
  576    HG   SER  73           HG       SER  73   2.399  15.428  -2.154
  577    H    GLU  74           HN       GLU  74   2.244  13.614  -6.838
  578    HA   GLU  74           HA       GLU  74   4.357  15.649  -6.773
  579   1HB   GLU  74          HB2       GLU  74   4.197  13.449  -8.278
  580   2HB   GLU  74          HB1       GLU  74   3.322  14.547  -9.335
  581   1HG   GLU  74          HG2       GLU  74   5.688  14.416  -9.906
  582   2HG   GLU  74          HG1       GLU  74   5.226  16.041  -9.408
  583    H    GLU  75           HN       GLU  75   4.146  17.319  -8.646
  584    HA   GLU  75           HA       GLU  75   1.517  18.571  -8.332
  585   1HB   GLU  75          HB2       GLU  75   4.109  19.709  -9.406
  586   2HB   GLU  75          HB1       GLU  75   2.620  20.613  -9.165
  587   1HG   GLU  75          HG2       GLU  75   4.226  19.280  -6.997
  588   2HG   GLU  75          HG1       GLU  75   4.244  20.999  -7.379
  589    H    GLU  76           HN       GLU  76   2.672  16.398 -10.245
  590    HA   GLU  76           HA       GLU  76   1.455  17.474 -12.691
  591   1HB   GLU  76          HB2       GLU  76   3.858  16.934 -12.971
  592   2HB   GLU  76          HB1       GLU  76   3.544  15.293 -12.426
  593   1HG   GLU  76          HG2       GLU  76   2.120  14.908 -14.362
  594   2HG   GLU  76          HG1       GLU  76   2.394  16.564 -14.901
  595    H    GLY  77           HN       GLY  77   0.977  15.610 -10.038
  596   1HA   GLY  77          HA2       GLY  77  -1.378  14.399 -10.960
  597   2HA   GLY  77          HA1       GLY  77  -0.094  13.196 -10.975
  598    H    ARG  78           HN       ARG  78  -2.310  12.896  -9.327
  599    HA   ARG  78           HA       ARG  78  -1.736  13.878  -6.694
  600   1HB   ARG  78          HB2       ARG  78  -3.601  11.654  -7.537
  601   2HB   ARG  78          HB1       ARG  78  -3.629  12.514  -6.004
  602   1HG   ARG  78          HG2       ARG  78  -4.111  13.790  -8.688
  603   2HG   ARG  78          HG1       ARG  78  -5.381  13.241  -7.599
  604   1HD   ARG  78          HD2       ARG  78  -5.149  15.566  -7.234
  605   2HD   ARG  78          HD1       ARG  78  -4.388  14.770  -5.859
  606    HE   ARG  78           HE       ARG  78  -2.456  15.294  -7.841
  607   1HH1  ARG  78          HH11      ARG  78  -4.427  16.943  -5.480
  608   2HH1  ARG  78          HH12      ARG  78  -3.314  18.255  -5.282
  609   1HH2  ARG  78          HH21      ARG  78  -0.990  17.020  -7.584
  610   2HH2  ARG  78          HH22      ARG  78  -1.363  18.298  -6.477
  611    H    LEU  79           HN       LEU  79  -2.556  10.679  -6.204
  612    HA   LEU  79           HA       LEU  79   0.095  10.060  -5.231
  613   1HB   LEU  79          HB2       LEU  79  -2.475   8.475  -5.285
  614   2HB   LEU  79          HB1       LEU  79  -0.984   7.880  -4.578
  615    HG   LEU  79           HG       LEU  79  -2.480   8.714  -2.853
  616   1HD1  LEU  79          1HD1      LEU  79   0.030   9.013  -2.716
  617   2HD1  LEU  79          2HD1      LEU  79  -0.942  10.042  -1.665
  618   3HD1  LEU  79          3HD1      LEU  79  -0.245  10.701  -3.146
  619   1HD2  LEU  79          1HD2      LEU  79  -2.218  11.487  -3.946
  620   2HD2  LEU  79          2HD2      LEU  79  -3.380  10.849  -2.784
  621   3HD2  LEU  79          3HD2      LEU  79  -3.516  10.425  -4.490
  622    H    TYR  80           HN       TYR  80   1.638   8.941  -6.329
  623    HA   TYR  80           HA       TYR  80   0.926   8.035  -8.993
  624   1HB   TYR  80          HB2       TYR  80   3.558   8.529  -7.664
  625   2HB   TYR  80          HB1       TYR  80   3.456   7.698  -9.209
  626    HD1  TYR  80           HD1      TYR  80   4.167   9.104 -10.882
  627    HD2  TYR  80           HD2      TYR  80   1.687  10.682  -7.808
  628    HE1  TYR  80           HE1      TYR  80   4.124  11.273 -12.039
  629    HE2  TYR  80           HE2      TYR  80   1.636  12.854  -8.957
  630    HH   TYR  80           HH       TYR  80   3.715  13.823 -11.148
  631    H    PHE  81           HN       PHE  81   0.038   6.045  -9.072
  632    HA   PHE  81           HA       PHE  81   1.445   3.880  -7.745
  633   1HB   PHE  81          HB2       PHE  81  -1.310   3.691  -8.923
  634   2HB   PHE  81          HB1       PHE  81  -0.479   2.464  -7.983
  635    HD1  PHE  81           HD1      PHE  81  -0.965   2.242  -5.755
  636    HD2  PHE  81           HD2      PHE  81  -1.794   5.945  -7.689
  637    HE1  PHE  81           HE1      PHE  81  -2.168   3.016  -3.751
  638    HE2  PHE  81           HE2      PHE  81  -2.983   6.729  -5.681
  639    HZ   PHE  81           HZ       PHE  81  -3.175   5.265  -3.711
  640    H    SER  82           HN       SER  82   2.138   2.156  -8.811
  641    HA   SER  82           HA       SER  82   1.446   1.710 -11.542
  642   1HB   SER  82          HB2       SER  82   3.221   3.236 -11.998
  643   2HB   SER  82          HB1       SER  82   4.279   2.474 -10.822
  644    HG   SER  82           HG       SER  82   3.559   1.637 -13.385
  645    H    MET  83           HN       MET  83   2.072  -0.374 -12.224
  646    HA   MET  83           HA       MET  83   3.285  -2.189 -10.378
  647   1HB   MET  83          HB2       MET  83   1.325  -3.745 -10.442
  648   2HB   MET  83          HB1       MET  83   1.043  -2.256  -9.555
  649   1HG   MET  83          HG2       MET  83  -0.061  -1.334 -11.583
  650   2HG   MET  83          HG1       MET  83   0.081  -2.928 -12.321
  651   1HE   MET  83          HE1       MET  83  -1.431  -2.503  -8.242
  652   2HE   MET  83          HE2       MET  83  -2.430  -1.301  -9.056
  653   3HE   MET  83          HE3       MET  83  -0.672  -1.205  -9.162
  654    H    ASP  84           HN       ASP  84   2.676  -4.594 -11.524
  655    HA   ASP  84           HA       ASP  84   4.395  -4.800 -13.651
  656   1HB   ASP  84          HB2       ASP  84   3.544  -6.739 -12.403
  657   2HB   ASP  84          HB1       ASP  84   1.960  -6.522 -13.139
  658    H    ASP  85           HN       ASP  85   0.871  -4.371 -13.788
  659    HA   ASP  85           HA       ASP  85   1.176  -3.256 -16.474
  660   1HB   ASP  85          HB2       ASP  85  -0.781  -4.522 -17.285
  661   2HB   ASP  85          HB1       ASP  85   0.546  -5.587 -16.831
  662    H    GLY  86           HN       GLY  86   0.801  -1.878 -14.042
  663   1HA   GLY  86          HA2       GLY  86  -1.836  -0.698 -14.581
  664   2HA   GLY  86          HA1       GLY  86  -1.431  -1.147 -12.934
  665    H    GLN  87           HN       GLN  87  -1.976   1.448 -14.392
  666    HA   GLN  87           HA       GLN  87   0.210   2.973 -13.177
  667   1HB   GLN  87          HB2       GLN  87   0.202   4.489 -15.173
  668   2HB   GLN  87          HB1       GLN  87   0.825   2.877 -15.508
  669   1HG   GLN  87          HG2       GLN  87  -1.304   2.233 -16.480
  670   2HG   GLN  87          HG1       GLN  87  -1.971   3.819 -16.112
  671    H    THR  88           HN       THR  88  -1.558   3.212 -11.556
  672    HA   THR  88           HA       THR  88  -3.700   4.948 -12.501
  673    HB   THR  88           HB       THR  88  -4.871   4.349 -10.423
  674    HG1  THR  88           HG1      THR  88  -3.981   2.747  -9.116
  675   1HG2  THR  88          1HG2      THR  88  -4.491   1.672 -11.073
  676   2HG2  THR  88          2HG2      THR  88  -4.196   2.560 -12.573
  677   3HG2  THR  88          3HG2      THR  88  -5.725   2.761 -11.709
  678    H    ARG  89           HN       ARG  89  -0.905   5.752 -11.651
  679    HA   ARG  89           HA       ARG  89  -0.659   7.202  -9.413
  680   1HB   ARG  89          HB2       ARG  89   0.687   8.845 -10.686
  681   2HB   ARG  89          HB1       ARG  89   1.076   7.179 -11.088
  682   1HG   ARG  89          HG2       ARG  89  -0.083   7.322 -13.156
  683   2HG   ARG  89          HG1       ARG  89  -0.786   8.881 -12.725
  684   1HD   ARG  89          HD2       ARG  89   1.427   9.899 -12.734
  685   2HD   ARG  89          HD1       ARG  89   2.155   8.338 -13.119
  686    HE   ARG  89           HE       ARG  89   0.243   8.928 -15.074
  687   1HH1  ARG  89          HH11      ARG  89   3.340  10.088 -13.962
  688   2HH1  ARG  89          HH12      ARG  89   3.813  10.692 -15.515
  689   1HH2  ARG  89          HH21      ARG  89   0.862   9.722 -17.118
  690   2HH2  ARG  89          HH22      ARG  89   2.407  10.485 -17.306
  691    H    PHE  90           HN       PHE  90  -3.067   7.583  -9.077
  692    HA   PHE  90           HA       PHE  90  -3.593  10.413  -9.578
  693   1HB   PHE  90          HB2       PHE  90  -4.822   8.989 -11.283
  694   2HB   PHE  90          HB1       PHE  90  -5.734   8.305  -9.944
  695    HD1  PHE  90           HD1      PHE  90  -4.683  11.813 -10.599
  696    HD2  PHE  90           HD2      PHE  90  -7.901   9.058 -10.199
  697    HE1  PHE  90           HE1      PHE  90  -6.289  13.671 -10.760
  698    HE2  PHE  90           HE2      PHE  90  -9.513  10.910 -10.360
  699    HZ   PHE  90           HZ       PHE  90  -8.707  13.220 -10.641
  700    H    THR  91           HN       THR  91  -5.920  10.766  -8.213
  701    HA   THR  91           HA       THR  91  -5.181  10.532  -5.522
  702    HB   THR  91           HB       THR  91  -7.887  10.971  -6.789
  703    HG1  THR  91           HG1      THR  91  -6.069  12.760  -5.564
  704   1HG2  THR  91          1HG2      THR  91  -8.593  11.918  -4.630
  705   2HG2  THR  91          2HG2      THR  91  -7.118  11.285  -3.901
  706   3HG2  THR  91          3HG2      THR  91  -8.319  10.177  -4.566
  707    H    ASP  92           HN       ASP  92  -6.432   9.305  -3.828
  708    HA   ASP  92           HA       ASP  92  -7.247   6.667  -4.852
  709   1HB   ASP  92          HB2       ASP  92  -6.239   5.702  -2.754
  710   2HB   ASP  92          HB1       ASP  92  -5.082   6.348  -3.912
  711    H    LEU  93           HN       LEU  93  -7.409   8.772  -1.980
  712    HA   LEU  93           HA       LEU  93  -9.300   7.607  -0.463
  713   1HB   LEU  93          HB2       LEU  93  -8.196   9.788  -0.020
  714   2HB   LEU  93          HB1       LEU  93  -9.297  10.544  -1.153
  715    HG   LEU  93           HG       LEU  93 -10.173   9.145   1.376
  716   1HD1  LEU  93          1HD1      LEU  93  -9.666  12.056   0.801
  717   2HD1  LEU  93          2HD1      LEU  93  -8.898  11.049   2.028
  718   3HD1  LEU  93          3HD1      LEU  93 -10.602  11.476   2.178
  719   1HD2  LEU  93          1HD2      LEU  93 -12.067   9.145   0.098
  720   2HD2  LEU  93          2HD2      LEU  93 -11.574  10.559  -0.832
  721   3HD2  LEU  93          3HD2      LEU  93 -12.188  10.754   0.809
  722    H    LEU  94           HN       LEU  94 -10.172   9.917  -3.043
  723    HA   LEU  94           HA       LEU  94 -12.880   9.771  -2.979
  724   1HB   LEU  94          HB2       LEU  94 -11.515  11.175  -4.509
  725   2HB   LEU  94          HB1       LEU  94 -11.228   9.762  -5.504
  726    HG   LEU  94           HG       LEU  94 -12.972  11.272  -6.409
  727   1HD1  LEU  94          1HD1      LEU  94 -14.204   9.569  -7.267
  728   2HD1  LEU  94          2HD1      LEU  94 -14.447   8.802  -5.698
  729   3HD1  LEU  94          3HD1      LEU  94 -12.907   8.623  -6.539
  730   1HD2  LEU  94          1HD2      LEU  94 -14.820  11.898  -5.280
  731   2HD2  LEU  94          2HD2      LEU  94 -13.806  11.579  -3.873
  732   3HD2  LEU  94          3HD2      LEU  94 -14.954  10.361  -4.428
  733    H    GLN  95           HN       GLN  95 -10.884   7.612  -5.036
  734    HA   GLN  95           HA       GLN  95 -13.054   5.971  -5.741
  735   1HB   GLN  95          HB2       GLN  95 -11.304   4.541  -6.664
  736   2HB   GLN  95          HB1       GLN  95 -11.092   6.203  -7.142
  737   1HG   GLN  95          HG2       GLN  95  -9.320   6.480  -5.550
  738   2HG   GLN  95          HG1       GLN  95  -9.600   4.864  -4.899
  739    H    LEU  96           HN       LEU  96 -10.588   5.816  -3.227
  740    HA   LEU  96           HA       LEU  96 -10.707   3.246  -2.363
  741   1HB   LEU  96          HB2       LEU  96  -9.359   5.091  -1.359
  742   2HB   LEU  96          HB1       LEU  96 -10.802   5.649  -0.538
  743    HG   LEU  96           HG       LEU  96  -9.554   2.932  -0.112
  744   1HD1  LEU  96          1HD1      LEU  96  -9.026   4.046   2.164
  745   2HD1  LEU  96          2HD1      LEU  96  -9.177   5.558   1.268
  746   3HD1  LEU  96          3HD1      LEU  96  -7.973   4.363   0.786
  747   1HD2  LEU  96          1HD2      LEU  96 -11.939   4.335   0.978
  748   2HD2  LEU  96          2HD2      LEU  96 -11.000   3.309   2.063
  749   3HD2  LEU  96          3HD2      LEU  96 -11.705   2.629   0.597
  750    H    VAL  97           HN       VAL  97 -12.954   5.811  -1.341
  751    HA   VAL  97           HA       VAL  97 -14.628   4.103   0.164
  752    HB   VAL  97           HB       VAL  97 -15.330   6.763  -1.081
  753   1HG1  VAL  97          1HG1      VAL  97 -17.342   5.769  -0.391
  754   2HG1  VAL  97          2HG1      VAL  97 -16.886   6.832   0.940
  755   3HG1  VAL  97          3HG1      VAL  97 -16.609   5.095   1.065
  756   1HG2  VAL  97          1HG2      VAL  97 -13.843   6.019   1.400
  757   2HG2  VAL  97          2HG2      VAL  97 -14.836   7.477   1.380
  758   3HG2  VAL  97          3HG2      VAL  97 -13.511   7.297   0.230
  759    H    GLU  98           HN       GLU  98 -15.373   5.742  -2.934
  760    HA   GLU  98           HA       GLU  98 -17.686   4.195  -3.416
  761   1HB   GLU  98          HB2       GLU  98 -17.333   6.394  -4.431
  762   2HB   GLU  98          HB1       GLU  98 -15.986   5.759  -5.366
  763   1HG   GLU  98          HG2       GLU  98 -17.508   4.259  -6.545
  764   2HG   GLU  98          HG1       GLU  98 -18.859   4.889  -5.604
  765    H    PHE  99           HN       PHE  99 -14.483   4.003  -5.007
  766    HA   PHE  99           HA       PHE  99 -15.146   1.722  -6.517
  767   1HB   PHE  99          HB2       PHE  99 -12.469   2.850  -5.705
  768   2HB   PHE  99          HB1       PHE  99 -12.634   1.431  -6.725
  769    HD1  PHE  99           HD1      PHE  99 -12.005   1.980  -8.850
  770    HD2  PHE  99           HD2      PHE  99 -14.472   4.691  -6.685
  771    HE1  PHE  99           HE1      PHE  99 -12.184   3.409 -10.844
  772    HE2  PHE  99           HE2      PHE  99 -14.657   6.118  -8.674
  773    HZ   PHE  99           HZ       PHE  99 -13.511   5.480 -10.758
  774    H    HIS 100           HN       HIS 100 -14.613   2.023  -3.186
  775    HA   HIS 100           HA       HIS 100 -13.246  -0.119  -2.285
  776   1HB   HIS 100          HB2       HIS 100 -14.414   1.376  -0.771
  777   2HB   HIS 100          HB1       HIS 100 -15.971   0.815  -1.360
  778    HD1  HIS 100           HD1      HIS 100 -16.180  -1.997  -0.971
  779    HD2  HIS 100           HD2      HIS 100 -13.811   0.254   1.593
  780    HE1  HIS 100           HE1      HIS 100 -15.944  -3.381   1.114
  781    HE2  HIS 100           HE2      HIS 100 -14.639  -1.928   2.704
  782    H    GLN 101           HN       GLN 101 -16.359  -0.174  -3.872
  783    HA   GLN 101           HA       GLN 101 -17.116  -2.816  -3.372
  784   1HB   GLN 101          HB2       GLN 101 -17.678  -1.559  -6.031
  785   2HB   GLN 101          HB1       GLN 101 -18.724  -2.551  -5.031
  786   1HG   GLN 101          HG2       GLN 101 -18.097   0.361  -4.795
  787   2HG   GLN 101          HG1       GLN 101 -19.663  -0.431  -4.928
  788    H    LEU 102           HN       LEU 102 -15.702  -1.570  -6.406
  789    HA   LEU 102           HA       LEU 102 -14.210  -4.091  -6.656
  790   1HB   LEU 102          HB2       LEU 102 -15.710  -2.670  -8.857
  791   2HB   LEU 102          HB1       LEU 102 -14.623  -4.022  -9.105
  792    HG   LEU 102           HG       LEU 102 -16.874  -4.833  -9.180
  793   1HD1  LEU 102          1HD1      LEU 102 -16.398  -6.679  -8.033
  794   2HD1  LEU 102          2HD1      LEU 102 -16.377  -5.818  -6.493
  795   3HD1  LEU 102          3HD1      LEU 102 -14.935  -5.846  -7.509
  796   1HD2  LEU 102          1HD2      LEU 102 -17.592  -4.229  -6.408
  797   2HD2  LEU 102          2HD2      LEU 102 -18.560  -4.145  -7.880
  798   3HD2  LEU 102          3HD2      LEU 102 -17.485  -2.815  -7.457
  799    H    ASN 103           HN       ASN 103 -12.804  -2.189  -5.584
  800    HA   ASN 103           HA       ASN 103 -11.574  -0.470  -7.575
  801   1HB   ASN 103          HB2       ASN 103 -11.941   0.358  -5.274
  802   2HB   ASN 103          HB1       ASN 103 -10.862  -0.889  -4.662
  803   1HD2  ASN 103          1HD2      ASN 103  -8.920  -0.177  -4.213
  804   2HD2  ASN 103          2HD2      ASN 103  -8.081   1.098  -5.023
  805    H    ARG 104           HN       ARG 104  -9.708  -0.866  -8.626
  806    HA   ARG 104           HA       ARG 104  -8.596  -3.419  -8.741
  807   1HB   ARG 104          HB2       ARG 104  -7.529  -0.735  -9.589
  808   2HB   ARG 104          HB1       ARG 104  -6.628  -2.219  -9.854
  809   1HG   ARG 104          HG2       ARG 104  -7.853  -1.579 -11.845
  810   2HG   ARG 104          HG1       ARG 104  -8.462  -3.103 -11.199
  811   1HD   ARG 104          HD2       ARG 104 -10.340  -1.943 -10.184
  812   2HD   ARG 104          HD1       ARG 104  -9.714  -0.395 -10.750
  813    HE   ARG 104           HE       ARG 104 -10.036  -2.075 -12.961
  814   1HH1  ARG 104          HH11      ARG 104 -11.990  -0.437 -10.579
  815   2HH1  ARG 104          HH12      ARG 104 -13.357  -0.275 -11.628
  816   1HH2  ARG 104          HH21      ARG 104 -11.832  -1.863 -14.345
  817   2HH2  ARG 104          HH22      ARG 104 -13.269  -1.086 -13.767
  818    H    GLY 105           HN       GLY 105  -8.187  -4.098  -6.591
  819   1HA   GLY 105          HA2       GLY 105  -6.348  -2.685  -4.911
  820   2HA   GLY 105          HA1       GLY 105  -6.982  -4.300  -4.635
  821    H    ILE 106           HN       ILE 106  -6.018  -6.047  -5.998
  822    HA   ILE 106           HA       ILE 106  -3.116  -5.688  -6.056
  823    HB   ILE 106           HB       ILE 106  -4.265  -7.578  -4.812
  824   1HG1  ILE 106          2HG1      ILE 106  -1.819  -7.501  -5.553
  825   2HG1  ILE 106          1HG1      ILE 106  -2.483  -9.081  -5.159
  826   1HG2  ILE 106          1HG2      ILE 106  -4.427  -9.496  -6.832
  827   2HG2  ILE 106          2HG2      ILE 106  -5.278  -8.087  -7.458
  828   3HG2  ILE 106          3HG2      ILE 106  -5.752  -8.786  -5.919
  829   1HD1  ILE 106          1HD1      ILE 106  -2.850  -8.567  -7.929
  830   2HD1  ILE 106          2HD1      ILE 106  -1.919  -9.840  -7.146
  831   3HD1  ILE 106          3HD1      ILE 106  -1.168  -8.282  -7.495
  832    H    LEU 107           HN       LEU 107  -1.813  -6.391  -7.820
  833    HA   LEU 107           HA       LEU 107  -2.223  -5.480 -10.261
  834   1HB   LEU 107          HB2       LEU 107  -0.662  -7.720  -9.247
  835   2HB   LEU 107          HB1       LEU 107  -1.010  -7.836 -10.963
  836    HG   LEU 107           HG       LEU 107   0.242  -5.414  -9.675
  837   1HD1  LEU 107          1HD1      LEU 107   2.359  -6.196 -10.347
  838   2HD1  LEU 107          2HD1      LEU 107   1.663  -7.509 -11.297
  839   3HD1  LEU 107          3HD1      LEU 107   1.596  -7.563  -9.535
  840   1HD2  LEU 107          1HD2      LEU 107   0.721  -4.739 -11.916
  841   2HD2  LEU 107          2HD2      LEU 107  -0.996  -5.130 -11.829
  842   3HD2  LEU 107          3HD2      LEU 107   0.131  -6.268 -12.561
  843    HA   PRO 108           HA       PRO 108  -4.797  -8.699 -12.356
  844   1HB   PRO 108          HB2       PRO 108  -4.237 -11.345 -12.125
  845   2HB   PRO 108          HB1       PRO 108  -3.233 -10.213 -13.034
  846   1HG   PRO 108          HG2       PRO 108  -2.605 -11.613 -10.580
  847   2HG   PRO 108          HG1       PRO 108  -1.549 -10.597 -11.573
  848   1HD   PRO 108          HD2       PRO 108  -3.080  -9.914  -9.142
  849   2HD   PRO 108          HD1       PRO 108  -1.643  -9.137  -9.822
  850    H    CYS 109           HN       CYS 109  -4.512 -11.125  -9.750
  851    HA   CYS 109           HA       CYS 109  -7.060 -12.068  -9.785
  852   1HB   CYS 109          HB2       CYS 109  -5.435 -11.751  -7.256
  853   2HB   CYS 109          HB1       CYS 109  -6.712 -12.921  -7.553
  854    HG   CYS 109           HG       CYS 109  -5.215 -14.754  -8.525
  855    H    LEU 110           HN       LEU 110  -8.296 -11.914  -7.387
  856    HA   LEU 110           HA       LEU 110 -10.244 -10.156  -7.508
  857   1HB   LEU 110          HB2       LEU 110  -8.786 -11.039  -5.040
  858   2HB   LEU 110          HB1       LEU 110 -10.203 -10.014  -4.937
  859    HG   LEU 110           HG       LEU 110 -10.872 -12.283  -4.568
  860   1HD1  LEU 110          1HD1      LEU 110 -11.791 -12.031  -7.358
  861   2HD1  LEU 110          2HD1      LEU 110 -12.077 -10.639  -6.314
  862   3HD1  LEU 110          3HD1      LEU 110 -12.713 -12.222  -5.868
  863   1HD2  LEU 110          1HD2      LEU 110  -8.840 -13.169  -5.907
  864   2HD2  LEU 110          2HD2      LEU 110  -9.935 -13.104  -7.288
  865   3HD2  LEU 110          3HD2      LEU 110 -10.335 -14.105  -5.892
  866    H    LEU 111           HN       LEU 111 -10.810  -8.076  -6.860
  867    HA   LEU 111           HA       LEU 111  -8.542  -6.285  -6.341
  868   1HB   LEU 111          HB2       LEU 111  -9.750  -4.556  -7.690
  869   2HB   LEU 111          HB1       LEU 111  -9.093  -5.899  -8.594
  870    HG   LEU 111           HG       LEU 111 -11.285  -5.198  -9.431
  871   1HD1  LEU 111          1HD1      LEU 111 -12.071  -7.783  -8.354
  872   2HD1  LEU 111          2HD1      LEU 111 -10.430  -7.765  -8.998
  873   3HD1  LEU 111          3HD1      LEU 111 -11.783  -7.281 -10.020
  874   1HD2  LEU 111          1HD2      LEU 111 -12.001  -4.705  -6.907
  875   2HD2  LEU 111          2HD2      LEU 111 -12.721  -6.304  -7.101
  876   3HD2  LEU 111          3HD2      LEU 111 -13.163  -4.999  -8.199
  877    H    ARG 112           HN       ARG 112 -11.842  -7.095  -5.589
  878    HA   ARG 112           HA       ARG 112 -12.737  -4.821  -4.286
  879   1HB   ARG 112          HB2       ARG 112 -13.180  -7.666  -3.358
  880   2HB   ARG 112          HB1       ARG 112 -14.199  -6.278  -3.006
  881   1HG   ARG 112          HG2       ARG 112 -14.737  -6.092  -5.396
  882   2HG   ARG 112          HG1       ARG 112 -13.754  -7.519  -5.712
  883   1HD   ARG 112          HD2       ARG 112 -16.114  -8.104  -5.576
  884   2HD   ARG 112          HD1       ARG 112 -15.204  -8.844  -4.259
  885    HE   ARG 112           HE       ARG 112 -16.234  -6.402  -3.361
  886   1HH1  ARG 112          HH11      ARG 112 -17.362  -9.557  -4.339
  887   2HH1  ARG 112          HH12      ARG 112 -18.771  -9.502  -3.334
  888   1HH2  ARG 112          HH21      ARG 112 -18.089  -6.328  -2.040
  889   2HH2  ARG 112          HH22      ARG 112 -19.185  -7.669  -2.031
  890    H    HIS 113           HN       HIS 113 -12.634  -4.084  -2.088
  891    HA   HIS 113           HA       HIS 113 -10.767  -5.454  -0.321
  892   1HB   HIS 113          HB2       HIS 113  -9.336  -3.518   0.028
  893   2HB   HIS 113          HB1       HIS 113  -9.315  -3.999  -1.668
  894    HD1  HIS 113           HD1      HIS 113 -11.350  -1.541   0.429
  895    HD2  HIS 113           HD2      HIS 113  -9.468  -1.840  -3.263
  896    HE1  HIS 113           HE1      HIS 113 -11.681   0.692  -0.677
  897    HE2  HIS 113           HE2      HIS 113 -10.611   0.457  -2.946
  898    H    CYS 114           HN       CYS 114 -10.721  -4.626   1.854
  899    HA   CYS 114           HA       CYS 114 -12.901  -2.816   2.566
  900   1HB   CYS 114          HB2       CYS 114 -13.889  -5.031   2.728
  901   2HB   CYS 114          HB1       CYS 114 -12.549  -5.586   3.731
  902    HG   CYS 114           HG       CYS 114 -14.073  -5.270   5.796
  903    H    CYS 115           HN       CYS 115 -11.077  -4.931   4.741
  904    HA   CYS 115           HA       CYS 115  -9.433  -2.663   5.598
  905   1HB   CYS 115          HB2       CYS 115 -11.084  -4.353   7.491
  906   2HB   CYS 115          HB1       CYS 115  -9.961  -3.080   7.959
  907    HG   CYS 115           HG       CYS 115 -11.913  -1.599   5.920
  908    H    THR 116           HN       THR 116  -8.296  -3.901   7.849
  909    HA   THR 116           HA       THR 116  -6.987  -6.272   6.683
  910    HB   THR 116           HB       THR 116  -5.698  -4.047   8.277
  911    HG1  THR 116           HG1      THR 116  -5.447  -3.242   6.373
  912   1HG2  THR 116          1HG2      THR 116  -3.566  -5.195   7.681
  913   2HG2  THR 116          2HG2      THR 116  -4.526  -6.593   7.199
  914   3HG2  THR 116          3HG2      THR 116  -4.555  -6.038   8.872
  915    H    ARG 117           HN       ARG 117  -5.915  -7.678   8.338
  916    HA   ARG 117           HA       ARG 117  -7.456  -7.636  10.856
  917   1HB   ARG 117          HB2       ARG 117  -8.085  -9.513   9.408
  918   2HB   ARG 117          HB1       ARG 117  -6.407 -10.030   9.341
  919   1HG   ARG 117          HG2       ARG 117  -7.678 -11.388  10.899
  920   2HG   ARG 117          HG1       ARG 117  -6.432 -10.462  11.740
  921   1HD   ARG 117          HD2       ARG 117  -8.535 -10.430  12.975
  922   2HD   ARG 117          HD1       ARG 117  -8.104  -8.816  12.414
  923    HE   ARG 117           HE       ARG 117  -9.775  -9.996  10.507
  924   1HH1  ARG 117          HH11      ARG 117  -9.920  -8.811  13.786
  925   2HH1  ARG 117          HH12      ARG 117 -11.598  -8.395  13.694
  926   1HH2  ARG 117          HH21      ARG 117 -11.982  -9.449  10.383
  927   2HH2  ARG 117          HH22      ARG 117 -12.770  -8.757  11.763
  928    H    VAL 118           HN       VAL 118  -5.954  -6.537  12.084
  929    HA   VAL 118           HA       VAL 118  -3.633  -8.106  12.865
  930    HB   VAL 118           HB       VAL 118  -2.241  -5.943  12.869
  931   1HG1  VAL 118          1HG1      VAL 118  -1.407  -6.403  10.660
  932   2HG1  VAL 118          2HG1      VAL 118  -2.926  -7.175  10.202
  933   3HG1  VAL 118          3HG1      VAL 118  -1.884  -7.925  11.411
  934   1HG2  VAL 118          1HG2      VAL 118  -3.176  -4.753  10.566
  935   2HG2  VAL 118          2HG2      VAL 118  -3.336  -4.112  12.201
  936   3HG2  VAL 118          3HG2      VAL 118  -4.648  -5.050  11.491
  937    H    ALA 119           HN       ALA 119  -4.775  -4.771  13.464
  938    HA   ALA 119           HA       ALA 119  -4.343  -5.085  16.285
  939   1HB   ALA 119          HB1       ALA 119  -5.215  -2.835  14.533
  940   2HB   ALA 119          HB2       ALA 119  -3.812  -2.948  15.596
  941   3HB   ALA 119          HB3       ALA 119  -5.421  -2.727  16.281
  942    H    LEU 120           HN       LEU 120  -7.177  -3.569  14.922
  943    HA   LEU 120           HA       LEU 120  -8.845  -5.153  16.741
  944   1HB   LEU 120          HB2       LEU 120  -9.460  -2.583  15.278
  945   2HB   LEU 120          HB1       LEU 120 -10.546  -3.403  16.385
  946    HG   LEU 120           HG       LEU 120  -7.890  -2.162  17.107
  947   1HD1  LEU 120          1HD1      LEU 120 -10.711  -1.253  17.252
  948   2HD1  LEU 120          2HD1      LEU 120  -9.237  -0.334  16.946
  949   3HD1  LEU 120          3HD1      LEU 120  -9.637  -0.838  18.588
  950   1HD2  LEU 120          1HD2      LEU 120  -8.661  -2.636  19.446
  951   2HD2  LEU 120          2HD2      LEU 120  -8.216  -4.061  18.504
  952   3HD2  LEU 120          3HD2      LEU 120  -9.915  -3.664  18.752
  953    HA   PRO1135           HA       PRO1135  10.188  -4.523 -12.645
  954   1HB   PRO1135          HB2       PRO1135  13.157  -4.679 -12.895
  955   2HB   PRO1135          HB1       PRO1135  11.904  -5.254 -14.000
  956   1HG   PRO1135          HG2       PRO1135  13.268  -3.026 -14.527
  957   2HG   PRO1135          HG1       PRO1135  11.537  -3.148 -14.893
  958   1HD   PRO1135          HD2       PRO1135  12.914  -1.684 -12.695
  959   2HD   PRO1135          HD1       PRO1135  11.422  -1.275 -13.566
  960    H    GLN1136           HN       GLN1136  12.562  -3.445 -10.317
  961    HA   GLN1136           HA       GLN1136  13.056  -5.973  -9.120
  962   1HB   GLN1136          HB2       GLN1136  14.494  -3.888  -8.937
  963   2HB   GLN1136          HB1       GLN1136  13.312  -3.278  -7.786
  964   1HG   GLN1136          HG2       GLN1136  15.085  -4.207  -6.534
  965   2HG   GLN1136          HG1       GLN1136  13.729  -5.328  -6.411
  966    HA   PRO1137           HA       PRO1137   9.309  -6.162  -6.716
  967   1HB   PRO1137          HB2       PRO1137   9.783  -8.429  -5.384
  968   2HB   PRO1137          HB1       PRO1137   9.530  -8.431  -7.133
  969   1HG   PRO1137          HG2       PRO1137  12.067  -8.656  -5.585
  970   2HG   PRO1137          HG1       PRO1137  11.592  -9.466  -7.086
  971   1HD   PRO1137          HD2       PRO1137  13.220  -7.205  -6.893
  972   2HD   PRO1137          HD1       PRO1137  12.406  -7.770  -8.364
  973    H    GLU1138           HN       GLU1138  10.725  -4.176  -5.669
  974    HA   GLU1138           HA       GLU1138  11.058  -4.850  -2.822
  975   1HB   GLU1138          HB2       GLU1138  13.144  -4.117  -3.753
  976   2HB   GLU1138          HB1       GLU1138  12.393  -2.704  -4.477
  977   1HG   GLU1138          HG2       GLU1138  11.913  -1.872  -2.190
  978   2HG   GLU1138          HG1       GLU1138  12.805  -3.252  -1.549
  979   2HN   PTR1139          HN        PTR1139   9.199  -3.067  -5.071
  980   2HN   PTR1139          HN        PTR1139   9.199  -3.067  -5.071
  981    HA   PTR1139           HA       PTR1139   7.584  -2.016  -2.967
  982    HA   PTR1139           HA       PTR1139   7.584  -2.016  -2.967
  983   1HB   PTR1139          HB1       PTR1139   7.851   0.355  -4.138
  984   1HB   PTR1139          HB1       PTR1139   7.851   0.355  -4.138
  985   2HB   PTR1139          HB2       PTR1139   9.479  -0.284  -4.369
  986   2HB   PTR1139          HB2       PTR1139   9.479  -0.284  -4.369
  987    HD1  PTR1139           HD1      PTR1139   6.889  -0.027  -1.696
  988    HD1  PTR1139           HD1      PTR1139   6.889  -0.027  -1.696
  989    HD2  PTR1139           HD2      PTR1139  11.009   0.089  -2.681
  990    HD2  PTR1139           HD2      PTR1139  11.009   0.089  -2.681
  991    HE1  PTR1139           HE1      PTR1139   7.406   0.556   0.610
  992    HE1  PTR1139           HE1      PTR1139   7.406   0.556   0.610
  993    HE2  PTR1139           HE2      PTR1139  11.538   0.704  -0.328
  994    HE2  PTR1139           HE2      PTR1139  11.538   0.704  -0.328
  995    H    VAL1140           HN       VAL1140   8.265  -1.947  -6.386
  996    HA   VAL1140           HA       VAL1140   6.838  -2.351  -8.165
  997    HB   VAL1140           HB       VAL1140   4.637  -2.431  -6.060
  998   1HG1  VAL1140          1HG1      VAL1140   4.385  -2.496  -9.069
  999   2HG1  VAL1140          2HG1      VAL1140   3.508  -1.492  -7.917
 1000   3HG1  VAL1140          3HG1      VAL1140   3.174  -3.220  -8.013
 1001   1HG2  VAL1140          1HG2      VAL1140   5.269  -4.658  -7.932
 1002   2HG2  VAL1140          2HG2      VAL1140   4.616  -4.712  -6.295
 1003   3HG2  VAL1140          3HG2      VAL1140   6.330  -4.376  -6.551
 1004    H    ASN1141           HN       ASN1141   5.569  -1.197  -9.441
 1005    HA   ASN1141           HA       ASN1141   4.536   0.688 -10.255
 1006   1HB   ASN1141          HB2       ASN1141   5.722   2.316  -8.000
 1007   2HB   ASN1141          HB1       ASN1141   4.404   2.746  -9.079
 1008   1HD2  ASN1141          1HD2      ASN1141   5.126   1.867  -6.002
 1009   2HD2  ASN1141          2HD2      ASN1141   3.595   1.258  -5.501
 1010    H    GLN1142           HN       GLN1142   7.511   0.370  -8.565
 1011    HA   GLN1142           HA       GLN1142   9.101   0.515 -10.854
 1012   1HB   GLN1142          HB2       GLN1142   9.280   2.726  -8.793
 1013   2HB   GLN1142          HB1       GLN1142  10.507   2.436 -10.010
 1014   1HG   GLN1142          HG2       GLN1142   9.442   3.802 -11.392
 1015   2HG   GLN1142          HG1       GLN1142   8.053   2.729 -11.379
 1016    HA   PRO1143           HA       PRO1143  11.745  -1.919  -8.224
 1017   1HB   PRO1143          HB2       PRO1143  14.027  -0.253  -7.953
 1018   2HB   PRO1143          HB1       PRO1143  13.827  -1.578  -9.101
 1019   1HG   PRO1143          HG2       PRO1143  13.519   1.342  -9.513
 1020   2HG   PRO1143          HG1       PRO1143  13.998   0.087 -10.666
 1021   1HD   PRO1143          HD2       PRO1143  11.562   1.241 -10.736
 1022   2HD   PRO1143          HD1       PRO1143  11.807  -0.462 -11.171
 1023    H    ASP1144           HN       ASP1144  11.277   1.470  -7.726
 1024    HA   ASP1144           HA       ASP1144  10.067   1.479  -5.377
 1025   1HB   ASP1144          HB2       ASP1144  11.954   0.410  -4.250
 1026   2HB   ASP1144          HB1       ASP1144  13.063   1.627  -4.866
  Start of MODEL   10
    1   1H    GLY   1          HT1       GLY   1  21.983   9.413  -7.583
    2   2H    GLY   1          HT2       GLY   1  21.963   8.473  -8.988
    3   3H    GLY   1          HT3       GLY   1  22.785   7.923  -7.617
    4   1HA   GLY   1          HA1       GLY   1  19.972   7.792  -8.268
    5   2HA   GLY   1          HA2       GLY   1  20.937   6.732  -7.253
    6    H    SER   2           HN       SER   2  18.267   8.160  -6.939
    7    HA   SER   2           HA       SER   2  18.608  10.053  -4.844
    8   1HB   SER   2          HB2       SER   2  16.606  10.087  -6.230
    9   2HB   SER   2          HB1       SER   2  16.163   8.475  -5.674
   10    HG   SER   2           HG       SER   2  15.970  10.922  -4.378
   11    HA   PRO   3           HA       PRO   3  17.420   6.404  -1.937
   12   1HB   PRO   3          HB2       PRO   3  17.541   3.884  -2.885
   13   2HB   PRO   3          HB1       PRO   3  16.092   4.882  -3.051
   14   1HG   PRO   3          HG2       PRO   3  18.238   4.309  -5.059
   15   2HG   PRO   3          HG1       PRO   3  16.479   4.344  -5.281
   16   1HD   PRO   3          HD2       PRO   3  18.107   6.407  -5.978
   17   2HD   PRO   3          HD1       PRO   3  16.423   6.632  -5.467
   18    H    ALA   4           HN       ALA   4  19.420   7.042  -1.063
   19    HA   ALA   4           HA       ALA   4  21.466   4.981  -1.174
   20   1HB   ALA   4          HB1       ALA   4  23.144   6.179  -2.092
   21   2HB   ALA   4          HB2       ALA   4  22.583   7.700  -1.397
   22   3HB   ALA   4          HB3       ALA   4  21.816   7.058  -2.850
   23    H    SER   5           HN       SER   5  19.659   5.669   0.864
   24    HA   SER   5           HA       SER   5  21.551   6.490   2.941
   25   1HB   SER   5          HB2       SER   5  18.754   7.618   2.662
   26   2HB   SER   5          HB1       SER   5  19.839   7.904   4.023
   27    HG   SER   5           HG       SER   5  21.004   9.232   2.836
   28    H    GLY   6           HN       GLY   6  20.291   6.213   5.183
   29   1HA   GLY   6          HA2       GLY   6  18.301   4.234   5.390
   30   2HA   GLY   6          HA1       GLY   6  19.874   3.460   5.502
   31    H    THR   7           HN       THR   7  17.429   4.612   7.305
   32    HA   THR   7           HA       THR   7  19.133   4.846   9.653
   33    HB   THR   7           HB       THR   7  17.134   6.983   8.886
   34    HG1  THR   7           HG1      THR   7  19.161   7.141   7.825
   35   1HG2  THR   7          1HG2      THR   7  18.815   6.680  11.358
   36   2HG2  THR   7          2HG2      THR   7  17.056   6.769  11.253
   37   3HG2  THR   7          3HG2      THR   7  18.036   8.184  10.868
   38    H    SER   8           HN       SER   8  17.869   4.769  11.681
   39    HA   SER   8           HA       SER   8  15.425   3.174  11.298
   40   1HB   SER   8          HB2       SER   8  17.363   3.196  13.625
   41   2HB   SER   8          HB1       SER   8  15.911   2.201  13.518
   42    HG   SER   8           HG       SER   8  17.077   0.826  12.465
   43    H    LEU   9           HN       LEU   9  13.623   4.268  11.671
   44    HA   LEU   9           HA       LEU   9  13.370   5.848  14.096
   45   1HB   LEU   9          HB2       LEU   9  12.818   7.017  11.367
   46   2HB   LEU   9          HB1       LEU   9  12.417   7.780  12.893
   47    HG   LEU   9           HG       LEU   9  15.218   7.151  11.954
   48   1HD1  LEU   9          1HD1      LEU   9  15.401   9.241  11.128
   49   2HD1  LEU   9          2HD1      LEU   9  14.306   9.929  12.327
   50   3HD1  LEU   9          3HD1      LEU   9  13.657   9.077  10.926
   51   1HD2  LEU   9          1HD2      LEU   9  14.426   8.913  14.251
   52   2HD2  LEU   9          2HD2      LEU   9  16.007   8.229  13.876
   53   3HD2  LEU   9          3HD2      LEU   9  14.712   7.186  14.462
   54    H    SER  10           HN       SER  10  11.058   6.604  14.377
   55    HA   SER  10           HA       SER  10   9.076   5.058  12.920
   56   1HB   SER  10          HB2       SER  10   9.767   3.499  14.677
   57   2HB   SER  10          HB1       SER  10   9.468   4.730  15.905
   58    HG   SER  10           HG       SER  10   7.743   3.142  15.532
   59    H    ALA  11           HN       ALA  11   6.898   5.747  13.325
   60    HA   ALA  11           HA       ALA  11   6.508   8.113  14.968
   61   1HB   ALA  11          HB1       ALA  11   7.204   9.220  13.008
   62   2HB   ALA  11          HB2       ALA  11   5.443   9.315  13.001
   63   3HB   ALA  11          HB3       ALA  11   6.266   8.143  11.971
   64    H    ALA  12           HN       ALA  12   4.177   8.813  14.933
   65    HA   ALA  12           HA       ALA  12   2.279   6.772  14.106
   66   1HB   ALA  12          HB1       ALA  12   2.278   7.598  16.992
   67   2HB   ALA  12          HB2       ALA  12   3.179   6.192  16.426
   68   3HB   ALA  12          HB3       ALA  12   1.428   6.256  16.225
   69    H    ILE  13           HN       ILE  13   1.806   8.675  12.742
   70    HA   ILE  13           HA       ILE  13   0.639  10.992  13.992
   71    HB   ILE  13           HB       ILE  13   1.865  11.182  11.868
   72   1HG1  ILE  13          2HG1      ILE  13  -1.066  11.909  11.650
   73   2HG1  ILE  13          1HG1      ILE  13   0.176  12.868  12.447
   74   1HG2  ILE  13          1HG2      ILE  13   0.033   9.078  11.079
   75   2HG2  ILE  13          2HG2      ILE  13   1.562   9.577  10.357
   76   3HG2  ILE  13          3HG2      ILE  13   0.068  10.405   9.918
   77   1HD1  ILE  13          1HD1      ILE  13   0.781  13.809  10.536
   78   2HD1  ILE  13          2HD1      ILE  13  -0.656  13.077   9.821
   79   3HD1  ILE  13          3HD1      ILE  13   0.897  12.248   9.721
   80    H    HIS  14           HN       HIS  14  -0.850   9.279  15.145
   81    HA   HIS  14           HA       HIS  14  -3.354   9.131  13.592
   82   1HB   HIS  14          HB2       HIS  14  -2.438   7.191  15.725
   83   2HB   HIS  14          HB1       HIS  14  -3.937   7.095  14.808
   84    HD1  HIS  14           HD1      HIS  14  -0.263   7.378  13.855
   85    HD2  HIS  14           HD2      HIS  14  -3.680   5.232  12.879
   86    HE1  HIS  14           HE1      HIS  14   0.441   5.791  12.046
   87    HE2  HIS  14           HE2      HIS  14  -1.663   4.559  11.406
   88    H    ARG  15           HN       ARG  15  -5.131  10.015  14.503
   89    HA   ARG  15           HA       ARG  15  -4.917  10.851  17.304
   90   1HB   ARG  15          HB2       ARG  15  -6.354  12.791  16.737
   91   2HB   ARG  15          HB1       ARG  15  -4.801  12.808  15.905
   92   1HG   ARG  15          HG2       ARG  15  -5.839  12.000  13.870
   93   2HG   ARG  15          HG1       ARG  15  -7.389  11.837  14.690
   94   1HD   ARG  15          HD2       ARG  15  -5.912  14.393  14.036
   95   2HD   ARG  15          HD1       ARG  15  -7.451  13.835  13.387
   96    HE   ARG  15           HE       ARG  15  -7.742  14.030  16.146
   97   1HH1  ARG  15          HH11      ARG  15  -7.158  16.133  13.423
   98   2HH1  ARG  15          HH12      ARG  15  -7.935  17.498  14.150
   99   1HH2  ARG  15          HH21      ARG  15  -8.764  15.826  17.106
  100   2HH2  ARG  15          HH22      ARG  15  -8.847  17.324  16.241
  101    H    THR  16           HN       THR  16  -6.401   8.812  15.349
  102    HA   THR  16           HA       THR  16  -8.646   8.482  17.177
  103    HB   THR  16           HB       THR  16 -10.222   8.103  15.310
  104    HG1  THR  16           HG1      THR  16  -8.169   9.140  13.656
  105   1HG2  THR  16          1HG2      THR  16  -9.319  10.583  16.194
  106   2HG2  THR  16          2HG2      THR  16 -10.831  10.227  15.359
  107   3HG2  THR  16          3HG2      THR  16  -9.409  10.718  14.438
  108    H    GLN  17           HN       GLN  17  -8.419   6.833  14.110
  109    HA   GLN  17           HA       GLN  17  -7.038   4.546  15.229
  110   1HB   GLN  17          HB2       GLN  17  -8.891   2.994  14.539
  111   2HB   GLN  17          HB1       GLN  17  -9.256   3.999  15.932
  112   1HG   GLN  17          HG2       GLN  17 -11.177   3.892  14.507
  113   2HG   GLN  17          HG1       GLN  17 -10.518   5.525  14.465
  114    H    LEU  18           HN       LEU  18  -6.572   6.498  13.146
  115    HA   LEU  18           HA       LEU  18  -7.116   5.738  10.568
  116   1HB   LEU  18          HB2       LEU  18  -4.448   6.787  11.498
  117   2HB   LEU  18          HB1       LEU  18  -5.154   6.958   9.902
  118    HG   LEU  18           HG       LEU  18  -6.114   8.274  12.442
  119   1HD1  LEU  18          1HD1      LEU  18  -5.318   9.777  10.019
  120   2HD1  LEU  18          2HD1      LEU  18  -4.034   9.048  10.983
  121   3HD1  LEU  18          3HD1      LEU  18  -5.151  10.197  11.723
  122   1HD2  LEU  18          1HD2      LEU  18  -7.872   9.252  11.227
  123   2HD2  LEU  18          2HD2      LEU  18  -7.920   7.537  10.820
  124   3HD2  LEU  18          3HD2      LEU  18  -7.226   8.693   9.683
  125    H    TRP  19           HN       TRP  19  -5.762   4.716   8.947
  126    HA   TRP  19           HA       TRP  19  -4.257   2.428  10.028
  127   1HB   TRP  19          HB2       TRP  19  -4.908   1.513   7.598
  128   2HB   TRP  19          HB1       TRP  19  -5.931   1.277   9.005
  129    HD1  TRP  19           HD1      TRP  19  -8.323   1.451   8.185
  130    HE1  TRP  19           HE1      TRP  19  -9.673   3.071   6.717
  131    HE3  TRP  19           HE3      TRP  19  -4.535   4.551   6.670
  132    HZ2  TRP  19           HZ2      TRP  19  -9.206   5.354   5.133
  133    HZ3  TRP  19           HZ3      TRP  19  -5.078   6.425   5.180
  134    HH2  TRP  19           HH2      TRP  19  -7.365   6.818   4.426
  135    H    PHE  20           HN       PHE  20  -2.832   4.621   9.790
  136    HA   PHE  20           HA       PHE  20  -1.373   4.386   7.244
  137   1HB   PHE  20          HB2       PHE  20  -2.474   6.596   7.764
  138   2HB   PHE  20          HB1       PHE  20  -1.377   6.745   9.132
  139    HD1  PHE  20           HD1      PHE  20   0.414   8.118   8.797
  140    HD2  PHE  20           HD2      PHE  20  -1.132   5.923   5.497
  141    HE1  PHE  20           HE1      PHE  20   2.086   9.163   7.325
  142    HE2  PHE  20           HE2      PHE  20   0.539   6.958   4.020
  143    HZ   PHE  20           HZ       PHE  20   2.150   8.581   4.932
  144    H    HIS  21           HN       HIS  21   0.787   3.933   7.282
  145    HA   HIS  21           HA       HIS  21   2.193   4.014   9.856
  146   1HB   HIS  21          HB2       HIS  21   1.290   1.723   9.578
  147   2HB   HIS  21          HB1       HIS  21   2.155   1.580   8.054
  148    HD1  HIS  21           HD1      HIS  21   4.857   1.678   8.287
  149    HD2  HIS  21           HD2      HIS  21   2.706   0.964  11.769
  150    HE1  HIS  21           HE1      HIS  21   6.523   0.752   9.928
  151    HE2  HIS  21           HE2      HIS  21   5.179   0.245  11.998
  152    H    GLY  22           HN       GLY  22   4.615   3.627   9.543
  153   1HA   GLY  22          HA2       GLY  22   5.452   5.094   7.146
  154   2HA   GLY  22          HA1       GLY  22   6.371   4.922   8.631
  155    H    ARG  23           HN       ARG  23   7.937   3.446   8.695
  156    HA   ARG  23           HA       ARG  23   8.383   1.841   6.331
  157   1HB   ARG  23          HB2       ARG  23  10.216   3.100   7.225
  158   2HB   ARG  23          HB1       ARG  23  10.079   2.287   8.776
  159   1HG   ARG  23          HG2       ARG  23  10.589   0.140   7.579
  160   2HG   ARG  23          HG1       ARG  23  10.939   1.104   6.144
  161   1HD   ARG  23          HD2       ARG  23  12.983   0.572   7.350
  162   2HD   ARG  23          HD1       ARG  23  12.675   2.306   7.379
  163    HE   ARG  23           HE       ARG  23  11.561   1.190   9.682
  164   1HH1  ARG  23          HH11      ARG  23  14.708   1.715   8.268
  165   2HH1  ARG  23          HH12      ARG  23  15.516   1.812   9.796
  166   1HH2  ARG  23          HH21      ARG  23  12.622   1.317  11.692
  167   2HH2  ARG  23          HH22      ARG  23  14.331   1.584  11.741
  168    H    ILE  24           HN       ILE  24   6.744   0.242   6.589
  169    HA   ILE  24           HA       ILE  24   7.327  -1.727   8.702
  170    HB   ILE  24           HB       ILE  24   4.969  -1.012   8.662
  171   1HG1  ILE  24          2HG1      ILE  24   5.387  -3.848   7.698
  172   2HG1  ILE  24          1HG1      ILE  24   5.525  -3.296   9.364
  173   1HG2  ILE  24          1HG2      ILE  24   3.522  -1.440   6.810
  174   2HG2  ILE  24          2HG2      ILE  24   4.822  -2.217   5.910
  175   3HG2  ILE  24          3HG2      ILE  24   4.890  -0.486   6.237
  176   1HD1  ILE  24          1HD1      ILE  24   3.316  -3.353   9.685
  177   2HD1  ILE  24          2HD1      ILE  24   3.305  -4.392   8.259
  178   3HD1  ILE  24          3HD1      ILE  24   2.966  -2.669   8.098
  179    H    SER  25           HN       SER  25   8.756  -3.172   7.988
  180    HA   SER  25           HA       SER  25   9.779  -3.662   5.592
  181   1HB   SER  25          HB2       SER  25  10.520  -4.857   7.573
  182   2HB   SER  25          HB1       SER  25   9.042  -5.817   7.578
  183    HG   SER  25           HG       SER  25  10.921  -5.784   5.452
  184    H    ARG  26           HN       ARG  26   8.444  -3.411   3.845
  185    HA   ARG  26           HA       ARG  26   5.992  -4.562   3.370
  186   1HB   ARG  26          HB2       ARG  26   6.330  -4.102   1.018
  187   2HB   ARG  26          HB1       ARG  26   7.018  -2.787   1.950
  188   1HG   ARG  26          HG2       ARG  26   8.603  -5.045   0.736
  189   2HG   ARG  26          HG1       ARG  26   8.377  -3.456   0.009
  190   1HD   ARG  26          HD2       ARG  26   9.239  -2.739   2.447
  191   2HD   ARG  26          HD1       ARG  26  10.068  -4.281   2.279
  192    HE   ARG  26           HE       ARG  26  10.482  -2.870  -0.079
  193   1HH1  ARG  26          HH11      ARG  26  11.272  -2.612   3.317
  194   2HH1  ARG  26          HH12      ARG  26  12.687  -1.651   3.046
  195   1HH2  ARG  26          HH21      ARG  26  12.337  -1.586  -0.427
  196   2HH2  ARG  26          HH22      ARG  26  13.289  -1.069   0.925
  197    H    GLU  27           HN       GLU  27   9.165  -5.879   2.414
  198    HA   GLU  27           HA       GLU  27   8.179  -8.242   1.261
  199   1HB   GLU  27          HB2       GLU  27  10.867  -7.610   2.479
  200   2HB   GLU  27          HB1       GLU  27  10.516  -9.096   1.606
  201   1HG   GLU  27          HG2       GLU  27  10.332  -6.312   0.476
  202   2HG   GLU  27          HG1       GLU  27  11.646  -7.456   0.199
  203    H    GLU  28           HN       GLU  28   9.110  -7.472   4.581
  204    HA   GLU  28           HA       GLU  28   8.807 -10.189   5.474
  205   1HB   GLU  28          HB2       GLU  28  10.349  -8.617   6.594
  206   2HB   GLU  28          HB1       GLU  28   8.972  -7.642   7.087
  207   1HG   GLU  28          HG2       GLU  28   8.118  -9.502   8.410
  208   2HG   GLU  28          HG1       GLU  28   9.495 -10.485   7.915
  209    H    SER  29           HN       SER  29   6.771  -7.408   5.113
  210    HA   SER  29           HA       SER  29   4.745  -7.918   6.930
  211   1HB   SER  29          HB2       SER  29   4.821  -5.880   5.574
  212   2HB   SER  29          HB1       SER  29   4.495  -6.821   4.119
  213    HG   SER  29           HG       SER  29   2.732  -5.735   5.696
  214    H    GLN  30           HN       GLN  30   4.992  -9.054   3.559
  215    HA   GLN  30           HA       GLN  30   2.679 -10.581   3.495
  216   1HB   GLN  30          HB2       GLN  30   3.986 -12.015   1.799
  217   2HB   GLN  30          HB1       GLN  30   3.703 -10.323   1.429
  218   1HG   GLN  30          HG2       GLN  30   5.982  -9.813   2.243
  219   2HG   GLN  30          HG1       GLN  30   6.248 -11.542   2.458
  220    H    ARG  31           HN       ARG  31   5.701 -11.265   5.062
  221    HA   ARG  31           HA       ARG  31   5.293 -14.065   5.370
  222   1HB   ARG  31          HB2       ARG  31   7.517 -12.988   5.548
  223   2HB   ARG  31          HB1       ARG  31   6.996 -12.196   7.027
  224   1HG   ARG  31          HG2       ARG  31   8.305 -14.046   7.674
  225   2HG   ARG  31          HG1       ARG  31   6.627 -14.479   8.003
  226   1HD   ARG  31          HD2       ARG  31   8.126 -15.278   5.512
  227   2HD   ARG  31          HD1       ARG  31   7.988 -16.293   6.947
  228    HE   ARG  31           HE       ARG  31   6.049 -15.970   4.914
  229   1HH1  ARG  31          HH11      ARG  31   6.361 -16.369   8.368
  230   2HH1  ARG  31          HH12      ARG  31   4.789 -17.070   8.554
  231   1HH2  ARG  31          HH21      ARG  31   3.983 -16.895   5.159
  232   2HH2  ARG  31          HH22      ARG  31   3.439 -17.369   6.732
  233    H    LEU  32           HN       LEU  32   4.323 -11.226   7.166
  234    HA   LEU  32           HA       LEU  32   3.155 -12.937   9.251
  235   1HB   LEU  32          HB2       LEU  32   3.747  -9.980   9.233
  236   2HB   LEU  32          HB1       LEU  32   2.889 -10.797  10.525
  237    HG   LEU  32           HG       LEU  32   4.897 -12.195  10.935
  238   1HD1  LEU  32          1HD1      LEU  32   6.012 -12.239   8.869
  239   2HD1  LEU  32          2HD1      LEU  32   7.048 -11.291   9.935
  240   3HD1  LEU  32          3HD1      LEU  32   6.028 -10.481   8.747
  241   1HD2  LEU  32          1HD2      LEU  32   4.839 -10.479  12.441
  242   2HD2  LEU  32          2HD2      LEU  32   4.891  -9.233  11.194
  243   3HD2  LEU  32          3HD2      LEU  32   6.359 -10.112  11.625
  244    H    ILE  33           HN       ILE  33   2.289  -9.869   7.635
  245    HA   ILE  33           HA       ILE  33  -0.496 -10.234   8.111
  246    HB   ILE  33           HB       ILE  33   0.944  -8.330   6.257
  247   1HG1  ILE  33          2HG1      ILE  33   0.298  -6.657   7.999
  248   2HG1  ILE  33          1HG1      ILE  33  -0.300  -7.979   8.993
  249   1HG2  ILE  33          1HG2      ILE  33  -1.248  -7.072   6.313
  250   2HG2  ILE  33          2HG2      ILE  33  -1.974  -8.546   6.952
  251   3HG2  ILE  33          3HG2      ILE  33  -1.229  -8.552   5.353
  252   1HD1  ILE  33          1HD1      ILE  33   2.531  -7.921   8.032
  253   2HD1  ILE  33          2HD1      ILE  33   1.837  -8.797   9.395
  254   3HD1  ILE  33          3HD1      ILE  33   2.027  -7.046   9.478
  255    H    GLY  34           HN       GLY  34   1.552 -11.728   5.904
  256   1HA   GLY  34          HA2       GLY  34  -0.542 -11.972   3.868
  257   2HA   GLY  34          HA1       GLY  34   1.127 -12.502   3.699
  258    H    GLN  35           HN       GLN  35  -0.643 -13.157   6.564
  259    HA   GLN  35           HA       GLN  35  -0.829 -15.991   5.834
  260   1HB   GLN  35          HB2       GLN  35  -0.716 -16.518   8.177
  261   2HB   GLN  35          HB1       GLN  35   0.607 -15.419   7.821
  262   1HG   GLN  35          HG2       GLN  35  -0.250 -14.652   9.841
  263   2HG   GLN  35          HG1       GLN  35  -0.945 -13.566   8.640
  264    H    GLN  36           HN       GLN  36  -2.537 -13.109   6.272
  265    HA   GLN  36           HA       GLN  36  -4.874 -13.866   7.548
  266   1HB   GLN  36          HB2       GLN  36  -4.027 -11.710   5.832
  267   2HB   GLN  36          HB1       GLN  36  -5.687 -12.173   5.465
  268   1HG   GLN  36          HG2       GLN  36  -6.466 -11.353   7.387
  269   2HG   GLN  36          HG1       GLN  36  -5.118 -12.003   8.318
  270    H    GLY  37           HN       GLY  37  -6.998 -14.405   6.631
  271   1HA   GLY  37          HA2       GLY  37  -6.689 -16.360   4.461
  272   2HA   GLY  37          HA1       GLY  37  -7.998 -16.327   5.636
  273    H    LEU  38           HN       LEU  38  -7.610 -13.202   4.724
  274    HA   LEU  38           HA       LEU  38  -9.943 -13.297   3.044
  275   1HB   LEU  38          HB2       LEU  38  -8.231 -10.995   3.965
  276   2HB   LEU  38          HB1       LEU  38  -9.693 -10.820   3.014
  277    HG   LEU  38           HG       LEU  38 -10.160 -10.356   5.343
  278   1HD1  LEU  38          1HD1      LEU  38 -12.140 -11.447   5.395
  279   2HD1  LEU  38          2HD1      LEU  38 -11.411 -13.021   5.071
  280   3HD1  LEU  38          3HD1      LEU  38 -11.667 -11.878   3.752
  281   1HD2  LEU  38          1HD2      LEU  38  -9.782 -11.869   7.107
  282   2HD2  LEU  38          2HD2      LEU  38  -8.282 -11.846   6.180
  283   3HD2  LEU  38          3HD2      LEU  38  -9.409 -13.191   6.003
  284    H    VAL  39           HN       VAL  39 -10.035 -12.032   1.017
  285    HA   VAL  39           HA       VAL  39  -7.968 -12.906  -0.779
  286    HB   VAL  39           HB       VAL  39  -9.388 -11.942  -2.545
  287   1HG1  VAL  39          1HG1      VAL  39 -10.356 -13.915  -0.572
  288   2HG1  VAL  39          2HG1      VAL  39 -10.084 -14.082  -2.307
  289   3HG1  VAL  39          3HG1      VAL  39 -11.550 -13.301  -1.715
  290   1HG2  VAL  39          1HG2      VAL  39 -10.554 -10.586  -0.248
  291   2HG2  VAL  39          2HG2      VAL  39 -11.770 -11.344  -1.278
  292   3HG2  VAL  39          3HG2      VAL  39 -10.636 -10.181  -1.963
  293    H    ASP  40           HN       ASP  40  -7.557 -11.205  -2.661
  294    HA   ASP  40           HA       ASP  40  -5.788  -9.278  -1.583
  295   1HB   ASP  40          HB2       ASP  40  -6.962  -9.337  -4.372
  296   2HB   ASP  40          HB1       ASP  40  -5.478  -8.537  -3.870
  297    H    GLY  41           HN       GLY  41  -7.971  -8.774  -0.238
  298   1HA   GLY  41          HA2       GLY  41  -8.923  -6.214  -1.414
  299   2HA   GLY  41          HA1       GLY  41 -10.051  -7.324  -0.643
  300    H    LEU  42           HN       LEU  42  -7.437  -7.706   1.178
  301    HA   LEU  42           HA       LEU  42  -8.344  -5.656   3.048
  302   1HB   LEU  42          HB2       LEU  42  -6.705  -8.161   3.442
  303   2HB   LEU  42          HB1       LEU  42  -7.007  -7.001   4.713
  304    HG   LEU  42           HG       LEU  42  -8.452  -9.151   4.577
  305   1HD1  LEU  42          1HD1      LEU  42 -10.308  -6.898   4.772
  306   2HD1  LEU  42          2HD1      LEU  42  -8.834  -6.712   5.721
  307   3HD1  LEU  42          3HD1      LEU  42  -9.868  -8.119   5.966
  308   1HD2  LEU  42          1HD2      LEU  42  -9.914  -7.447   2.569
  309   2HD2  LEU  42          2HD2      LEU  42 -10.427  -9.007   3.209
  310   3HD2  LEU  42          3HD2      LEU  42  -8.998  -8.904   2.181
  311    H    PHE  43           HN       PHE  43  -7.375  -3.872   2.398
  312    HA   PHE  43           HA       PHE  43  -4.456  -3.939   2.059
  313   1HB   PHE  43          HB2       PHE  43  -4.712  -1.858   0.756
  314   2HB   PHE  43          HB1       PHE  43  -5.604  -3.210   0.072
  315    HD1  PHE  43           HD1      PHE  43  -7.334  -2.006   2.918
  316    HD2  PHE  43           HD2      PHE  43  -6.560  -1.137  -1.173
  317    HE1  PHE  43           HE1      PHE  43  -9.341  -0.605   2.844
  318    HE2  PHE  43           HE2      PHE  43  -8.580   0.262  -1.254
  319    HZ   PHE  43           HZ       PHE  43  -9.974   0.526   0.755
  320    H    LEU  44           HN       LEU  44  -3.223  -2.051   2.644
  321    HA   LEU  44           HA       LEU  44  -4.272  -0.419   4.839
  322   1HB   LEU  44          HB2       LEU  44  -3.149  -2.368   5.866
  323   2HB   LEU  44          HB1       LEU  44  -1.694  -2.000   4.961
  324    HG   LEU  44           HG       LEU  44  -1.585   0.197   6.177
  325   1HD1  LEU  44          1HD1      LEU  44  -4.125  -0.151   6.824
  326   2HD1  LEU  44          2HD1      LEU  44  -3.018   0.762   7.848
  327   3HD1  LEU  44          3HD1      LEU  44  -3.403  -0.912   8.241
  328   1HD2  LEU  44          1HD2      LEU  44  -0.106  -1.462   6.923
  329   2HD2  LEU  44          2HD2      LEU  44  -1.403  -2.425   7.629
  330   3HD2  LEU  44          3HD2      LEU  44  -0.924  -0.905   8.383
  331    H    VAL  45           HN       VAL  45  -3.275   1.670   4.923
  332    HA   VAL  45           HA       VAL  45  -1.528   2.174   2.604
  333    HB   VAL  45           HB       VAL  45  -3.215   4.163   4.123
  334   1HG1  VAL  45          1HG1      VAL  45  -0.973   4.507   2.336
  335   2HG1  VAL  45          2HG1      VAL  45  -1.893   5.721   3.224
  336   3HG1  VAL  45          3HG1      VAL  45  -2.437   5.195   1.632
  337   1HG2  VAL  45          1HG2      VAL  45  -3.564   3.082   1.329
  338   2HG2  VAL  45          2HG2      VAL  45  -4.635   4.195   2.182
  339   3HG2  VAL  45          3HG2      VAL  45  -4.475   2.528   2.735
  340    H    ARG  46           HN       ARG  46   0.509   2.118   3.126
  341    HA   ARG  46           HA       ARG  46   1.456   3.947   5.185
  342   1HB   ARG  46          HB2       ARG  46   3.064   2.315   6.068
  343   2HB   ARG  46          HB1       ARG  46   1.413   1.770   6.317
  344   1HG   ARG  46          HG2       ARG  46   2.997  -0.009   5.615
  345   2HG   ARG  46          HG1       ARG  46   1.595   0.166   4.566
  346   1HD   ARG  46          HD2       ARG  46   2.829   1.079   2.849
  347   2HD   ARG  46          HD1       ARG  46   4.115   1.622   3.919
  348    HE   ARG  46           HE       ARG  46   3.762  -1.058   2.847
  349   1HH1  ARG  46          HH11      ARG  46   5.623   1.166   4.786
  350   2HH1  ARG  46          HH12      ARG  46   7.045   0.180   4.757
  351   1HH2  ARG  46          HH21      ARG  46   5.616  -2.342   2.828
  352   2HH2  ARG  46          HH22      ARG  46   7.041  -1.814   3.660
  353    H    GLU  47           HN       GLU  47   4.026   3.988   4.972
  354    HA   GLU  47           HA       GLU  47   4.730   3.562   2.193
  355   1HB   GLU  47          HB2       GLU  47   5.510   5.853   1.861
  356   2HB   GLU  47          HB1       GLU  47   3.799   5.840   2.241
  357   1HG   GLU  47          HG2       GLU  47   5.941   6.379   4.280
  358   2HG   GLU  47          HG1       GLU  47   5.141   7.640   3.347
  359    H    SER  48           HN       SER  48   7.051   5.549   2.867
  360    HA   SER  48           HA       SER  48   8.567   3.546   4.421
  361   1HB   SER  48          HB2       SER  48   9.686   5.364   2.290
  362   2HB   SER  48          HB1       SER  48  10.538   4.091   3.161
  363    HG   SER  48           HG       SER  48   9.846   2.733   1.765
  364    H    GLN  49           HN       GLN  49  10.139   4.279   5.778
  365    HA   GLN  49           HA       GLN  49  10.023   7.131   6.462
  366   1HB   GLN  49          HB2       GLN  49  10.875   6.590   8.621
  367   2HB   GLN  49          HB1       GLN  49   9.659   5.359   8.302
  368   1HG   GLN  49          HG2       GLN  49  11.514   4.268   9.279
  369   2HG   GLN  49          HG1       GLN  49  11.521   3.854   7.571
  370    H    ARG  50           HN       ARG  50  11.415   4.957   4.555
  371    HA   ARG  50           HA       ARG  50  14.130   6.032   4.597
  372   1HB   ARG  50          HB2       ARG  50  13.916   3.569   4.697
  373   2HB   ARG  50          HB1       ARG  50  13.010   3.594   3.191
  374   1HG   ARG  50          HG2       ARG  50  15.220   2.939   2.666
  375   2HG   ARG  50          HG1       ARG  50  15.029   4.599   2.100
  376   1HD   ARG  50          HD2       ARG  50  16.281   3.837   4.735
  377   2HD   ARG  50          HD1       ARG  50  17.195   4.137   3.258
  378    HE   ARG  50           HE       ARG  50  16.169   6.085   5.033
  379   1HH1  ARG  50          HH11      ARG  50  16.697   5.477   1.637
  380   2HH1  ARG  50          HH12      ARG  50  16.782   7.157   1.223
  381   1HH2  ARG  50          HH21      ARG  50  16.283   8.291   4.491
  382   2HH2  ARG  50          HH22      ARG  50  16.549   8.754   2.843
  383    H    ASN  51           HN       ASN  51  11.411   5.256   2.337
  384    HA   ASN  51           HA       ASN  51  12.649   6.834   0.258
  385   1HB   ASN  51          HB2       ASN  51   9.822   5.770   0.357
  386   2HB   ASN  51          HB1       ASN  51  10.734   6.246  -1.073
  387   1HD2  ASN  51          1HD2      ASN  51  13.032   4.825   0.694
  388   2HD2  ASN  51          2HD2      ASN  51  12.852   3.188   0.191
  389    HA   PRO  52           HA       PRO  52  10.998  10.555   2.329
  390   1HB   PRO  52          HB2       PRO  52  12.363  11.852   0.039
  391   2HB   PRO  52          HB1       PRO  52  12.515  12.174   1.769
  392   1HG   PRO  52          HG2       PRO  52  14.456  10.921   0.444
  393   2HG   PRO  52          HG1       PRO  52  14.021  10.441   2.095
  394   1HD   PRO  52          HD2       PRO  52  13.310   9.141  -0.509
  395   2HD   PRO  52          HD1       PRO  52  13.797   8.396   1.022
  396    H    GLN  53           HN       GLN  53  10.975   9.953  -1.137
  397    HA   GLN  53           HA       GLN  53   8.381  11.340  -1.335
  398   1HB   GLN  53          HB2       GLN  53  10.369  10.802  -3.551
  399   2HB   GLN  53          HB1       GLN  53   8.891  11.742  -3.680
  400   1HG   GLN  53          HG2       GLN  53  11.268  12.462  -1.982
  401   2HG   GLN  53          HG1       GLN  53  10.909  13.132  -3.569
  402    H    GLY  54           HN       GLY  54   8.214   8.891  -0.318
  403   1HA   GLY  54          HA2       GLY  54   7.181   7.361  -2.601
  404   2HA   GLY  54          HA1       GLY  54   8.275   6.595  -1.474
  405    H    PHE  55           HN       PHE  55   5.141   7.047  -2.312
  406    HA   PHE  55           HA       PHE  55   4.068   6.313   0.354
  407   1HB   PHE  55          HB2       PHE  55   2.789   7.738  -1.992
  408   2HB   PHE  55          HB1       PHE  55   1.840   7.002  -0.705
  409    HD1  PHE  55           HD1      PHE  55   5.023   8.927  -0.505
  410    HD2  PHE  55           HD2      PHE  55   0.877   8.769   0.432
  411    HE1  PHE  55           HE1      PHE  55   5.261  10.967   0.837
  412    HE2  PHE  55           HE2      PHE  55   1.104  10.816   1.779
  413    HZ   PHE  55           HZ       PHE  55   3.297  11.918   1.983
  414    H    VAL  56           HN       VAL  56   2.776   4.502   0.488
  415    HA   VAL  56           HA       VAL  56   2.520   2.880  -1.929
  416    HB   VAL  56           HB       VAL  56   4.180   1.546  -1.220
  417   1HG1  VAL  56          1HG1      VAL  56   3.953   2.083   1.679
  418   2HG1  VAL  56          2HG1      VAL  56   4.564   3.368   0.640
  419   3HG1  VAL  56          3HG1      VAL  56   5.384   1.812   0.697
  420   1HG2  VAL  56          1HG2      VAL  56   2.257   0.771   0.955
  421   2HG2  VAL  56          2HG2      VAL  56   3.587  -0.198   0.333
  422   3HG2  VAL  56          3HG2      VAL  56   2.212   0.165  -0.704
  423    H    LEU  57           HN       LEU  57   1.002   1.304  -1.968
  424    HA   LEU  57           HA       LEU  57  -1.096   1.481   0.079
  425   1HB   LEU  57          HB2       LEU  57  -1.913   2.245  -2.096
  426   2HB   LEU  57          HB1       LEU  57  -1.329   0.777  -2.855
  427    HG   LEU  57           HG       LEU  57  -3.829   0.916  -2.402
  428   1HD1  LEU  57          1HD1      LEU  57  -3.878  -1.319  -2.478
  429   2HD1  LEU  57          2HD1      LEU  57  -2.977  -1.487  -0.972
  430   3HD1  LEU  57          3HD1      LEU  57  -2.118  -1.211  -2.488
  431   1HD2  LEU  57          1HD2      LEU  57  -3.821   1.867  -0.205
  432   2HD2  LEU  57          2HD2      LEU  57  -2.824   0.550   0.418
  433   3HD2  LEU  57          3HD2      LEU  57  -4.485   0.237  -0.093
  434    H    SER  58           HN       SER  58  -1.274  -0.310   1.270
  435    HA   SER  58           HA       SER  58   0.212  -2.666   0.406
  436   1HB   SER  58          HB2       SER  58  -1.014  -2.125   3.110
  437   2HB   SER  58          HB1       SER  58   0.225  -3.316   2.715
  438    HG   SER  58           HG       SER  58   0.539  -0.508   2.441
  439    H    LEU  59           HN       LEU  59  -0.711  -4.564  -0.097
  440    HA   LEU  59           HA       LEU  59  -3.628  -4.750   0.225
  441   1HB   LEU  59          HB2       LEU  59  -1.862  -6.178  -1.758
  442   2HB   LEU  59          HB1       LEU  59  -3.599  -6.349  -1.633
  443    HG   LEU  59           HG       LEU  59  -2.140  -3.816  -2.388
  444   1HD1  LEU  59          1HD1      LEU  59  -2.905  -4.178  -4.599
  445   2HD1  LEU  59          2HD1      LEU  59  -3.907  -5.541  -4.103
  446   3HD1  LEU  59          3HD1      LEU  59  -2.150  -5.682  -4.075
  447   1HD2  LEU  59          1HD2      LEU  59  -4.101  -3.137  -1.298
  448   2HD2  LEU  59          2HD2      LEU  59  -5.044  -4.460  -1.986
  449   3HD2  LEU  59          3HD2      LEU  59  -4.514  -3.127  -3.012
  450    H    CYS  60           HN       CYS  60  -4.325  -7.170   0.201
  451    HA   CYS  60           HA       CYS  60  -2.583  -8.861   1.762
  452   1HB   CYS  60          HB2       CYS  60  -3.974  -7.633   3.442
  453   2HB   CYS  60          HB1       CYS  60  -5.410  -8.240   2.630
  454    HG   CYS  60           HG       CYS  60  -3.280 -10.649   3.526
  455    H    HIS  61           HN       HIS  61  -2.445  -9.916  -0.091
  456    HA   HIS  61           HA       HIS  61  -4.765 -10.815  -1.472
  457   1HB   HIS  61          HB2       HIS  61  -3.123 -10.312  -2.902
  458   2HB   HIS  61          HB1       HIS  61  -1.854 -10.734  -1.793
  459    HD1  HIS  61           HD1      HIS  61  -4.459 -12.661  -3.836
  460    HD2  HIS  61           HD2      HIS  61  -0.467 -12.857  -2.737
  461    HE1  HIS  61           HE1      HIS  61  -3.538 -14.661  -5.035
  462    HE2  HIS  61           HE2      HIS  61  -1.092 -14.694  -4.444
  463    H    LEU  62           HN       LEU  62  -4.767 -13.316  -2.046
  464    HA   LEU  62           HA       LEU  62  -4.708 -14.590   0.584
  465   1HB   LEU  62          HB2       LEU  62  -6.095 -16.379  -0.428
  466   2HB   LEU  62          HB1       LEU  62  -6.828 -14.792  -0.466
  467    HG   LEU  62           HG       LEU  62  -7.176 -16.198  -2.516
  468   1HD1  LEU  62          1HD1      LEU  62  -6.673 -13.457  -2.289
  469   2HD1  LEU  62          2HD1      LEU  62  -7.564 -14.290  -3.563
  470   3HD1  LEU  62          3HD1      LEU  62  -5.838 -13.979  -3.753
  471   1HD2  LEU  62          1HD2      LEU  62  -4.912 -17.172  -2.588
  472   2HD2  LEU  62          2HD2      LEU  62  -4.276 -15.593  -3.044
  473   3HD2  LEU  62          3HD2      LEU  62  -5.394 -16.434  -4.115
  474    H    GLN  63           HN       GLN  63  -2.388 -14.155  -0.467
  475    HA   GLN  63           HA       GLN  63  -1.364 -16.717  -0.093
  476   1HB   GLN  63          HB2       GLN  63  -0.558 -15.267  -2.619
  477   2HB   GLN  63          HB1       GLN  63   0.212 -16.717  -2.002
  478   1HG   GLN  63          HG2       GLN  63  -1.876 -17.952  -2.292
  479   2HG   GLN  63          HG1       GLN  63  -2.639 -16.499  -2.933
  480    H    LYS  64           HN       LYS  64  -0.926 -13.312  -0.692
  481    HA   LYS  64           HA       LYS  64   0.978 -13.209   1.475
  482   1HB   LYS  64          HB2       LYS  64   2.715 -12.047   0.126
  483   2HB   LYS  64          HB1       LYS  64   2.455 -13.711  -0.374
  484   1HG   LYS  64          HG2       LYS  64   1.317 -13.079  -2.314
  485   2HG   LYS  64          HG1       LYS  64   1.075 -11.430  -1.737
  486   1HD   LYS  64          HD2       LYS  64   3.424 -10.965  -1.955
  487   2HD   LYS  64          HD1       LYS  64   3.753 -12.643  -2.394
  488   1HE   LYS  64          HE2       LYS  64   2.090 -10.679  -3.968
  489   2HE   LYS  64          HE1       LYS  64   3.727 -11.200  -4.364
  490   1HZ   LYS  64          HZ1       LYS  64   2.573 -12.634  -5.656
  491   2HZ   LYS  64          HZ2       LYS  64   1.199 -12.623  -4.670
  492   3HZ   LYS  64          HZ3       LYS  64   2.545 -13.549  -4.232
  493    H    VAL  65           HN       VAL  65   2.001 -10.626   0.702
  494    HA   VAL  65           HA       VAL  65  -0.302  -8.859   0.493
  495    HB   VAL  65           HB       VAL  65   0.300  -7.478   2.344
  496   1HG1  VAL  65          1HG1      VAL  65  -1.086  -9.113   3.185
  497   2HG1  VAL  65          2HG1      VAL  65   0.299  -9.214   4.272
  498   3HG1  VAL  65          3HG1      VAL  65   0.113 -10.387   2.970
  499   1HG2  VAL  65          1HG2      VAL  65   2.851  -8.871   2.168
  500   2HG2  VAL  65          2HG2      VAL  65   2.274  -8.677   3.823
  501   3HG2  VAL  65          3HG2      VAL  65   2.476  -7.265   2.788
  502    H    LYS  66           HN       LYS  66   0.349  -6.723  -0.328
  503    HA   LYS  66           HA       LYS  66   3.148  -6.664  -1.267
  504   1HB   LYS  66          HB2       LYS  66   2.229  -5.638  -3.430
  505   2HB   LYS  66          HB1       LYS  66   2.082  -7.376  -3.210
  506   1HG   LYS  66          HG2       LYS  66  -0.228  -6.145  -2.127
  507   2HG   LYS  66          HG1       LYS  66   0.053  -5.479  -3.733
  508   1HD   LYS  66          HD2       LYS  66  -1.380  -7.476  -3.780
  509   2HD   LYS  66          HD1       LYS  66   0.116  -7.704  -4.684
  510   1HE   LYS  66          HE2       LYS  66   1.058  -8.835  -2.655
  511   2HE   LYS  66          HE1       LYS  66  -0.548  -8.747  -1.935
  512   1HZ   LYS  66          HZ1       LYS  66  -1.373 -10.016  -3.872
  513   2HZ   LYS  66          HZ2       LYS  66  -0.268 -10.880  -2.933
  514   3HZ   LYS  66          HZ3       LYS  66   0.220 -10.204  -4.403
  515    H    HIS  67           HN       HIS  67   3.912  -4.567  -1.997
  516    HA   HIS  67           HA       HIS  67   2.477  -2.274  -0.867
  517   1HB   HIS  67          HB2       HIS  67   5.328  -3.054  -0.234
  518   2HB   HIS  67          HB1       HIS  67   4.558  -1.557   0.274
  519    HD1  HIS  67           HD1      HIS  67   2.445  -1.875   1.918
  520    HD2  HIS  67           HD2      HIS  67   4.883  -5.197   1.422
  521    HE1  HIS  67           HE1      HIS  67   1.880  -3.414   3.821
  522    HE2  HIS  67           HE2      HIS  67   3.236  -5.488   3.387
  523    H    TYR  68           HN       TYR  68   2.324  -0.777  -2.443
  524    HA   TYR  68           HA       TYR  68   4.503  -0.539  -4.428
  525   1HB   TYR  68          HB2       TYR  68   1.766   0.662  -4.777
  526   2HB   TYR  68          HB1       TYR  68   2.939   0.232  -6.006
  527    HD1  TYR  68           HD1      TYR  68   2.400  -1.543  -7.344
  528    HD2  TYR  68           HD2      TYR  68   0.949  -1.515  -3.349
  529    HE1  TYR  68           HE1      TYR  68   1.168  -3.626  -7.784
  530    HE2  TYR  68           HE2      TYR  68  -0.282  -3.599  -3.770
  531    HH   TYR  68           HH       TYR  68  -1.104  -4.715  -6.589
  532    H    LEU  69           HN       LEU  69   5.890   0.987  -3.461
  533    HA   LEU  69           HA       LEU  69   4.655   3.552  -2.688
  534   1HB   LEU  69          HB2       LEU  69   5.730   3.530  -0.740
  535   2HB   LEU  69          HB1       LEU  69   5.949   1.828  -1.052
  536    HG   LEU  69           HG       LEU  69   8.033   2.448  -0.341
  537   1HD1  LEU  69          1HD1      LEU  69   7.883   1.915  -3.072
  538   2HD1  LEU  69          2HD1      LEU  69   9.283   1.760  -2.020
  539   3HD1  LEU  69          3HD1      LEU  69   9.030   3.245  -2.913
  540   1HD2  LEU  69          1HD2      LEU  69   8.931   4.726  -1.552
  541   2HD2  LEU  69          2HD2      LEU  69   8.270   4.594   0.079
  542   3HD2  LEU  69          3HD2      LEU  69   7.226   5.048  -1.263
  543    H    ILE  70           HN       ILE  70   5.401   3.437  -5.328
  544    HA   ILE  70           HA       ILE  70   8.132   4.509  -5.284
  545    HB   ILE  70           HB       ILE  70   6.525   3.725  -7.698
  546   1HG1  ILE  70          2HG1      ILE  70   8.630   2.315  -6.041
  547   2HG1  ILE  70          1HG1      ILE  70   6.966   1.808  -6.293
  548   1HG2  ILE  70          1HG2      ILE  70   9.153   4.992  -7.292
  549   2HG2  ILE  70          2HG2      ILE  70   8.091   5.015  -8.698
  550   3HG2  ILE  70          3HG2      ILE  70   9.141   3.628  -8.409
  551   1HD1  ILE  70          1HD1      ILE  70   9.333   1.477  -8.003
  552   2HD1  ILE  70          2HD1      ILE  70   7.814   1.820  -8.829
  553   3HD1  ILE  70          3HD1      ILE  70   7.943   0.420  -7.766
  554    H    LEU  71           HN       LEU  71   5.029   5.784  -5.405
  555    HA   LEU  71           HA       LEU  71   6.269   8.350  -6.012
  556   1HB   LEU  71          HB2       LEU  71   3.820   7.427  -7.467
  557   2HB   LEU  71          HB1       LEU  71   4.545   9.011  -7.596
  558    HG   LEU  71           HG       LEU  71   5.936   6.454  -8.377
  559   1HD1  LEU  71          1HD1      LEU  71   3.809   7.119  -9.676
  560   2HD1  LEU  71          2HD1      LEU  71   5.285   6.774 -10.583
  561   3HD1  LEU  71          3HD1      LEU  71   4.794   8.445 -10.300
  562   1HD2  LEU  71          1HD2      LEU  71   6.602   9.244  -9.252
  563   2HD2  LEU  71          2HD2      LEU  71   7.610   7.797  -9.288
  564   3HD2  LEU  71          3HD2      LEU  71   7.242   8.577  -7.750
  565    HA   PRO  72           HA       PRO  72   3.540   9.442  -2.676
  566   1HB   PRO  72          HB2       PRO  72   4.726  11.708  -1.991
  567   2HB   PRO  72          HB1       PRO  72   5.580  10.171  -1.814
  568   1HG   PRO  72          HG2       PRO  72   5.884  12.272  -3.907
  569   2HG   PRO  72          HG1       PRO  72   7.119  11.268  -3.134
  570   1HD   PRO  72          HD2       PRO  72   5.917  10.796  -5.627
  571   2HD   PRO  72          HD1       PRO  72   6.892   9.643  -4.701
  572    H    SER  73           HN       SER  73   2.272  11.390  -1.991
  573    HA   SER  73           HA       SER  73   0.597  12.279  -4.064
  574   1HB   SER  73          HB2       SER  73   0.930  13.441  -1.289
  575   2HB   SER  73          HB1       SER  73  -0.432  13.731  -2.371
  576    HG   SER  73           HG       SER  73  -1.270  11.985  -1.588
  577    H    GLU  74           HN       GLU  74   0.812  13.889  -5.473
  578    HA   GLU  74           HA       GLU  74   2.796  15.989  -4.859
  579   1HB   GLU  74          HB2       GLU  74   2.253  14.621  -7.494
  580   2HB   GLU  74          HB1       GLU  74   3.268  16.048  -7.316
  581   1HG   GLU  74          HG2       GLU  74   4.885  14.886  -6.086
  582   2HG   GLU  74          HG1       GLU  74   3.795  13.539  -5.765
  583    H    GLU  75           HN       GLU  75   2.495  17.835  -6.658
  584    HA   GLU  75           HA       GLU  75  -0.271  18.721  -6.291
  585   1HB   GLU  75          HB2       GLU  75   2.182  20.269  -7.154
  586   2HB   GLU  75          HB1       GLU  75   0.590  20.960  -6.869
  587   1HG   GLU  75          HG2       GLU  75   2.294  19.588  -4.801
  588   2HG   GLU  75          HG1       GLU  75   2.121  21.331  -4.998
  589    H    GLU  76           HN       GLU  76   1.114  16.914  -8.401
  590    HA   GLU  76           HA       GLU  76  -0.076  18.186 -10.760
  591   1HB   GLU  76          HB2       GLU  76   1.289  16.398 -12.000
  592   2HB   GLU  76          HB1       GLU  76   2.176  17.744 -11.299
  593   1HG   GLU  76          HG2       GLU  76   2.810  16.363  -9.405
  594   2HG   GLU  76          HG1       GLU  76   1.885  15.017 -10.060
  595    H    GLY  77           HN       GLY  77  -0.598  16.019  -8.320
  596   1HA   GLY  77          HA2       GLY  77  -2.971  14.979  -9.438
  597   2HA   GLY  77          HA1       GLY  77  -1.711  13.753  -9.501
  598    H    ARG  78           HN       ARG  78  -2.801  12.427  -7.984
  599    HA   ARG  78           HA       ARG  78  -2.789  13.501  -5.239
  600   1HB   ARG  78          HB2       ARG  78  -4.443  11.142  -6.070
  601   2HB   ARG  78          HB1       ARG  78  -4.675  12.215  -4.698
  602   1HG   ARG  78          HG2       ARG  78  -5.304  12.693  -7.589
  603   2HG   ARG  78          HG1       ARG  78  -6.387  12.735  -6.199
  604   1HD   ARG  78          HD2       ARG  78  -5.930  14.876  -5.769
  605   2HD   ARG  78          HD1       ARG  78  -4.198  14.647  -5.995
  606    HE   ARG  78           HE       ARG  78  -4.417  15.433  -8.121
  607   1HH1  ARG  78          HH11      ARG  78  -7.567  14.462  -6.977
  608   2HH1  ARG  78          HH12      ARG  78  -8.394  15.033  -8.388
  609   1HH2  ARG  78          HH21      ARG  78  -5.502  16.185  -9.978
  610   2HH2  ARG  78          HH22      ARG  78  -7.222  16.011 -10.092
  611    H    LEU  79           HN       LEU  79  -3.408  10.197  -5.179
  612    HA   LEU  79           HA       LEU  79  -0.790   9.617  -4.153
  613   1HB   LEU  79          HB2       LEU  79  -3.152   7.819  -4.719
  614   2HB   LEU  79          HB1       LEU  79  -1.674   7.288  -3.941
  615    HG   LEU  79           HG       LEU  79  -3.384   7.653  -2.276
  616   1HD1  LEU  79          1HD1      LEU  79  -1.093   8.175  -1.649
  617   2HD1  LEU  79          2HD1      LEU  79  -2.230   9.245  -0.827
  618   3HD1  LEU  79          3HD1      LEU  79  -1.306   9.834  -2.208
  619   1HD2  LEU  79          1HD2      LEU  79  -4.570   9.400  -3.744
  620   2HD2  LEU  79          2HD2      LEU  79  -3.483  10.562  -2.984
  621   3HD2  LEU  79          3HD2      LEU  79  -4.597   9.620  -1.995
  622    H    TYR  80           HN       TYR  80   0.936   8.703  -5.288
  623    HA   TYR  80           HA       TYR  80   0.287   8.090  -8.072
  624   1HB   TYR  80          HB2       TYR  80   2.713   9.308  -6.844
  625   2HB   TYR  80          HB1       TYR  80   2.806   8.508  -8.408
  626    HD1  TYR  80           HD1      TYR  80  -0.040  10.533  -7.159
  627    HD2  TYR  80           HD2      TYR  80   3.269  10.306  -9.814
  628    HE1  TYR  80           HE1      TYR  80  -0.829  12.545  -8.308
  629    HE2  TYR  80           HE2      TYR  80   2.488  12.329 -10.969
  630    HH   TYR  80           HH       TYR  80   0.457  13.582 -11.302
  631    H    PHE  81           HN       PHE  81  -0.186   5.967  -7.959
  632    HA   PHE  81           HA       PHE  81   2.071   4.259  -8.106
  633   1HB   PHE  81          HB2       PHE  81   0.965   2.486  -6.609
  634   2HB   PHE  81          HB1       PHE  81   1.822   3.806  -5.820
  635    HD1  PHE  81           HD1      PHE  81  -1.560   4.046  -7.316
  636    HD2  PHE  81           HD2      PHE  81   0.737   3.761  -3.744
  637    HE1  PHE  81           HE1      PHE  81  -3.566   4.561  -5.992
  638    HE2  PHE  81           HE2      PHE  81  -1.267   4.279  -2.413
  639    HZ   PHE  81           HZ       PHE  81  -3.421   4.678  -3.536
  640    H    SER  82           HN       SER  82   1.356   1.949  -8.581
  641    HA   SER  82           HA       SER  82  -1.094   1.866 -10.119
  642   1HB   SER  82          HB2       SER  82   0.017   1.281 -12.189
  643   2HB   SER  82          HB1       SER  82   0.558   2.865 -11.645
  644    HG   SER  82           HG       SER  82   2.462   1.948 -10.934
  645    H    MET  83           HN       MET  83   1.133  -0.278 -11.309
  646    HA   MET  83           HA       MET  83   0.766  -2.360  -9.327
  647   1HB   MET  83          HB2       MET  83  -0.256  -2.681 -12.166
  648   2HB   MET  83          HB1       MET  83  -0.290  -3.905 -10.905
  649   1HG   MET  83          HG2       MET  83  -1.959  -2.779  -9.703
  650   2HG   MET  83          HG1       MET  83  -1.730  -1.292 -10.617
  651   1HE   MET  83          HE1       MET  83  -3.465  -5.085 -12.580
  652   2HE   MET  83          HE2       MET  83  -3.174  -5.033 -10.841
  653   3HE   MET  83          HE3       MET  83  -1.821  -4.909 -11.967
  654    H    ASP  84           HN       ASP  84   1.515  -4.464 -11.138
  655    HA   ASP  84           HA       ASP  84   4.320  -3.940 -11.330
  656   1HB   ASP  84          HB2       ASP  84   3.528  -6.203 -10.865
  657   2HB   ASP  84          HB1       ASP  84   2.665  -6.245 -12.398
  658    H    ASP  85           HN       ASP  85   1.550  -3.914 -13.460
  659    HA   ASP  85           HA       ASP  85   3.219  -2.667 -15.538
  660   1HB   ASP  85          HB2       ASP  85   1.199  -4.869 -16.000
  661   2HB   ASP  85          HB1       ASP  85   1.933  -3.912 -17.280
  662    H    GLY  86           HN       GLY  86   1.561  -1.267 -13.696
  663   1HA   GLY  86          HA2       GLY  86  -0.535  -0.328 -15.555
  664   2HA   GLY  86          HA1       GLY  86  -0.853  -0.519 -13.839
  665    H    GLN  87           HN       GLN  87  -1.403   1.855 -14.881
  666    HA   GLN  87           HA       GLN  87   0.613   3.596 -13.672
  667   1HB   GLN  87          HB2       GLN  87   0.278   5.243 -15.536
  668   2HB   GLN  87          HB1       GLN  87   1.138   3.785 -16.008
  669   1HG   GLN  87          HG2       GLN  87  -1.819   4.124 -16.413
  670   2HG   GLN  87          HG1       GLN  87  -0.632   4.659 -17.599
  671    H    THR  88           HN       THR  88  -1.120   3.453 -11.961
  672    HA   THR  88           HA       THR  88  -3.417   5.114 -12.657
  673    HB   THR  88           HB       THR  88  -4.563   4.094 -10.724
  674    HG1  THR  88           HG1      THR  88  -3.005   3.436  -9.377
  675   1HG2  THR  88          1HG2      THR  88  -3.980   1.592 -11.826
  676   2HG2  THR  88          2HG2      THR  88  -3.829   2.757 -13.144
  677   3HG2  THR  88          3HG2      THR  88  -5.330   2.659 -12.219
  678    H    ARG  89           HN       ARG  89  -0.604   5.713 -11.427
  679    HA   ARG  89           HA       ARG  89  -0.628   6.814  -8.994
  680   1HB   ARG  89          HB2       ARG  89   0.946   8.508  -9.824
  681   2HB   ARG  89          HB1       ARG  89   1.287   6.916 -10.482
  682   1HG   ARG  89          HG2       ARG  89   1.135   7.702 -12.542
  683   2HG   ARG  89          HG1       ARG  89  -0.507   8.267 -12.235
  684   1HD   ARG  89          HD2       ARG  89   0.418  10.342 -11.264
  685   2HD   ARG  89          HD1       ARG  89   2.042   9.770 -11.646
  686    HE   ARG  89           HE       ARG  89   1.722  10.524 -13.764
  687   1HH1  ARG  89          HH11      ARG  89  -1.417   9.943 -12.350
  688   2HH1  ARG  89          HH12      ARG  89  -2.283  10.469 -13.753
  689   1HH2  ARG  89          HH21      ARG  89   0.582  11.223 -15.606
  690   2HH2  ARG  89          HH22      ARG  89  -1.150  11.198 -15.600
  691    H    PHE  90           HN       PHE  90  -3.068   7.311  -8.863
  692    HA   PHE  90           HA       PHE  90  -3.364  10.209  -9.041
  693   1HB   PHE  90          HB2       PHE  90  -5.749   9.897  -9.877
  694   2HB   PHE  90          HB1       PHE  90  -4.471   9.624 -11.047
  695    HD1  PHE  90           HD1      PHE  90  -5.346   8.149 -12.570
  696    HD2  PHE  90           HD2      PHE  90  -5.809   7.333  -8.421
  697    HE1  PHE  90           HE1      PHE  90  -6.296   5.947 -13.111
  698    HE2  PHE  90           HE2      PHE  90  -6.756   5.131  -8.955
  699    HZ   PHE  90           HZ       PHE  90  -7.002   4.434 -11.303
  700    H    THR  91           HN       THR  91  -6.085  10.271  -8.212
  701    HA   THR  91           HA       THR  91  -5.943  10.368  -5.501
  702    HB   THR  91           HB       THR  91  -8.383   9.518  -7.061
  703    HG1  THR  91           HG1      THR  91  -7.840  11.385  -7.974
  704   1HG2  THR  91          1HG2      THR  91  -8.991   9.323  -4.825
  705   2HG2  THR  91          2HG2      THR  91  -9.533  10.936  -5.287
  706   3HG2  THR  91          3HG2      THR  91  -8.051  10.737  -4.352
  707    H    ASP  92           HN       ASP  92  -7.026   9.031  -3.835
  708    HA   ASP  92           HA       ASP  92  -7.060   6.173  -4.405
  709   1HB   ASP  92          HB2       ASP  92  -4.759   6.629  -3.691
  710   2HB   ASP  92          HB1       ASP  92  -5.355   7.398  -2.224
  711    H    LEU  93           HN       LEU  93  -7.001   8.093  -1.410
  712    HA   LEU  93           HA       LEU  93  -8.755   6.745   0.114
  713   1HB   LEU  93          HB2       LEU  93  -7.520   8.795   0.762
  714   2HB   LEU  93          HB1       LEU  93  -8.702   9.752  -0.107
  715    HG   LEU  93           HG       LEU  93  -9.365   7.992   2.256
  716   1HD1  LEU  93          1HD1      LEU  93  -9.014   9.713   3.675
  717   2HD1  LEU  93          2HD1      LEU  93  -9.451  10.933   2.480
  718   3HD1  LEU  93          3HD1      LEU  93  -7.849  10.196   2.443
  719   1HD2  LEU  93          1HD2      LEU  93 -11.335   9.781   2.160
  720   2HD2  LEU  93          2HD2      LEU  93 -11.398   8.257   1.275
  721   3HD2  LEU  93          3HD2      LEU  93 -10.929   9.739   0.443
  722    H    LEU  94           HN       LEU  94  -9.845   9.451  -1.958
  723    HA   LEU  94           HA       LEU  94 -12.569   9.114  -1.519
  724   1HB   LEU  94          HB2       LEU  94 -11.448  11.074  -2.592
  725   2HB   LEU  94          HB1       LEU  94 -11.282  10.122  -4.054
  726    HG   LEU  94           HG       LEU  94 -13.177  11.710  -4.134
  727   1HD1  LEU  94          1HD1      LEU  94 -14.537  10.306  -5.313
  728   2HD1  LEU  94          2HD1      LEU  94 -14.437   9.018  -4.113
  729   3HD1  LEU  94          3HD1      LEU  94 -13.087   9.307  -5.210
  730   1HD2  LEU  94          1HD2      LEU  94 -14.767  11.844  -2.565
  731   2HD2  LEU  94          2HD2      LEU  94 -13.612  10.987  -1.544
  732   3HD2  LEU  94          3HD2      LEU  94 -14.877  10.092  -2.387
  733    H    GLN  95           HN       GLN  95 -10.587   7.825  -4.186
  734    HA   GLN  95           HA       GLN  95 -12.781   6.405  -5.345
  735   1HB   GLN  95          HB2       GLN  95 -10.896   7.192  -6.695
  736   2HB   GLN  95          HB1       GLN  95  -9.810   6.124  -5.816
  737   1HG   GLN  95          HG2       GLN  95 -10.947   4.185  -6.683
  738   2HG   GLN  95          HG1       GLN  95 -12.142   5.207  -7.473
  739    H    LEU  96           HN       LEU  96 -10.509   5.730  -2.860
  740    HA   LEU  96           HA       LEU  96 -10.362   2.953  -2.955
  741   1HB   LEU  96          HB2       LEU  96  -8.925   4.235  -1.513
  742   2HB   LEU  96          HB1       LEU  96 -10.294   4.856  -0.616
  743    HG   LEU  96           HG       LEU  96  -9.587   1.927  -0.651
  744   1HD1  LEU  96          1HD1      LEU  96  -8.074   2.177   1.001
  745   2HD1  LEU  96          2HD1      LEU  96  -8.925   3.545   1.718
  746   3HD1  LEU  96          3HD1      LEU  96  -7.889   3.789   0.312
  747   1HD2  LEU  96          1HD2      LEU  96 -11.551   3.649   0.744
  748   2HD2  LEU  96          2HD2      LEU  96 -10.781   2.382   1.700
  749   3HD2  LEU  96          3HD2      LEU  96 -11.676   1.963   0.238
  750    H    VAL  97           HN       VAL  97 -12.550   4.952  -0.978
  751    HA   VAL  97           HA       VAL  97 -14.113   2.796  -0.060
  752    HB   VAL  97           HB       VAL  97 -14.900   5.704  -0.292
  753   1HG1  VAL  97          1HG1      VAL  97 -16.792   4.159   0.071
  754   2HG1  VAL  97          2HG1      VAL  97 -16.514   5.228   1.447
  755   3HG1  VAL  97          3HG1      VAL  97 -15.986   3.546   1.516
  756   1HG2  VAL  97          1HG2      VAL  97 -14.093   5.968   1.955
  757   2HG2  VAL  97          2HG2      VAL  97 -12.795   5.299   0.968
  758   3HG2  VAL  97          3HG2      VAL  97 -13.698   4.253   2.063
  759    H    GLU  98           HN       GLU  98 -14.901   5.271  -2.524
  760    HA   GLU  98           HA       GLU  98 -17.346   4.146  -3.293
  761   1HB   GLU  98          HB2       GLU  98 -16.702   6.433  -3.862
  762   2HB   GLU  98          HB1       GLU  98 -15.435   5.830  -4.921
  763   1HG   GLU  98          HG2       GLU  98 -17.127   4.798  -6.353
  764   2HG   GLU  98          HG1       GLU  98 -18.393   5.413  -5.293
  765    H    PHE  99           HN       PHE  99 -14.388   4.073  -5.302
  766    HA   PHE  99           HA       PHE  99 -15.408   2.015  -6.942
  767   1HB   PHE  99          HB2       PHE  99 -12.647   3.154  -6.604
  768   2HB   PHE  99          HB1       PHE  99 -12.970   1.820  -7.701
  769    HD1  PHE  99           HD1      PHE  99 -12.800   2.627  -9.844
  770    HD2  PHE  99           HD2      PHE  99 -14.929   4.909  -6.948
  771    HE1  PHE  99           HE1      PHE  99 -13.474   4.218 -11.594
  772    HE2  PHE  99           HE2      PHE  99 -15.606   6.500  -8.694
  773    HZ   PHE  99           HZ       PHE  99 -14.879   6.157 -11.021
  774    H    HIS 100           HN       HIS 100 -14.448   1.718  -3.774
  775    HA   HIS 100           HA       HIS 100 -12.816  -0.498  -3.674
  776   1HB   HIS 100          HB2       HIS 100 -13.369  -0.665  -1.466
  777   2HB   HIS 100          HB1       HIS 100 -14.087   0.907  -1.768
  778    HD1  HIS 100           HD1      HIS 100 -16.770   0.737  -2.428
  779    HD2  HIS 100           HD2      HIS 100 -15.071  -2.416  -0.328
  780    HE1  HIS 100           HE1      HIS 100 -18.703  -0.513  -1.405
  781    HE2  HIS 100           HE2      HIS 100 -17.642  -2.359  -0.064
  782    H    GLN 101           HN       GLN 101 -16.073  -0.251  -4.781
  783    HA   GLN 101           HA       GLN 101 -17.155  -2.742  -4.506
  784   1HB   GLN 101          HB2       GLN 101 -17.241  -1.485  -7.226
  785   2HB   GLN 101          HB1       GLN 101 -18.516  -2.309  -6.351
  786   1HG   GLN 101          HG2       GLN 101 -17.473   0.459  -5.823
  787   2HG   GLN 101          HG1       GLN 101 -19.011   0.032  -6.559
  788    H    LEU 102           HN       LEU 102 -15.346  -1.766  -7.409
  789    HA   LEU 102           HA       LEU 102 -14.025  -4.381  -7.469
  790   1HB   LEU 102          HB2       LEU 102 -15.567  -3.203  -9.784
  791   2HB   LEU 102          HB1       LEU 102 -14.494  -4.582  -9.907
  792    HG   LEU 102           HG       LEU 102 -16.731  -5.395  -9.853
  793   1HD1  LEU 102          1HD1      LEU 102 -16.253  -6.061  -7.074
  794   2HD1  LEU 102          2HD1      LEU 102 -14.794  -6.189  -8.058
  795   3HD1  LEU 102          3HD1      LEU 102 -16.243  -7.089  -8.506
  796   1HD2  LEU 102          1HD2      LEU 102 -17.557  -4.575  -7.214
  797   2HD2  LEU 102          2HD2      LEU 102 -18.399  -4.426  -8.757
  798   3HD2  LEU 102          3HD2      LEU 102 -17.257  -3.181  -8.251
  799    H    ASN 103           HN       ASN 103 -12.775  -2.037  -6.726
  800    HA   ASN 103           HA       ASN 103 -11.532  -0.765  -8.982
  801   1HB   ASN 103          HB2       ASN 103 -11.852   0.422  -6.837
  802   2HB   ASN 103          HB1       ASN 103 -10.732  -0.695  -6.062
  803   1HD2  ASN 103          1HD2      ASN 103  -8.737   0.000  -5.882
  804   2HD2  ASN 103          2HD2      ASN 103  -7.967   1.174  -6.887
  805    H    ARG 104           HN       ARG 104  -9.289  -0.869  -9.534
  806    HA   ARG 104           HA       ARG 104  -8.275  -3.518  -9.625
  807   1HB   ARG 104          HB2       ARG 104  -7.040  -0.865 -10.365
  808   2HB   ARG 104          HB1       ARG 104  -6.232  -2.405 -10.618
  809   1HG   ARG 104          HG2       ARG 104  -7.267  -1.651 -12.665
  810   2HG   ARG 104          HG1       ARG 104  -8.061  -3.115 -12.087
  811   1HD   ARG 104          HD2       ARG 104  -9.908  -1.839 -11.226
  812   2HD   ARG 104          HD1       ARG 104  -9.090  -0.323 -11.602
  813    HE   ARG 104           HE       ARG 104 -10.668  -1.870 -13.363
  814   1HH1  ARG 104          HH11      ARG 104  -7.785   0.098 -13.281
  815   2HH1  ARG 104          HH12      ARG 104  -7.859   0.496 -14.964
  816   1HH2  ARG 104          HH21      ARG 104 -10.768  -1.340 -15.575
  817   2HH2  ARG 104          HH22      ARG 104  -9.553  -0.317 -16.265
  818    H    GLY 105           HN       GLY 105  -7.998  -4.230  -7.492
  819   1HA   GLY 105          HA2       GLY 105  -6.389  -2.775  -5.621
  820   2HA   GLY 105          HA1       GLY 105  -6.990  -4.413  -5.425
  821    H    ILE 106           HN       ILE 106  -5.775  -6.157  -6.339
  822    HA   ILE 106           HA       ILE 106  -2.906  -5.618  -6.287
  823    HB   ILE 106           HB       ILE 106  -3.904  -7.379  -4.856
  824   1HG1  ILE 106          2HG1      ILE 106  -1.497  -7.406  -5.883
  825   2HG1  ILE 106          1HG1      ILE 106  -2.098  -8.812  -5.020
  826   1HG2  ILE 106          1HG2      ILE 106  -4.236  -9.565  -6.446
  827   2HG2  ILE 106          2HG2      ILE 106  -4.918  -8.286  -7.444
  828   3HG2  ILE 106          3HG2      ILE 106  -5.538  -8.558  -5.821
  829   1HD1  ILE 106          1HD1      ILE 106  -0.931  -8.847  -7.465
  830   2HD1  ILE 106          2HD1      ILE 106  -2.644  -8.864  -7.886
  831   3HD1  ILE 106          3HD1      ILE 106  -1.984 -10.106  -6.826
  832    H    LEU 107           HN       LEU 107  -1.441  -6.636  -7.775
  833    HA   LEU 107           HA       LEU 107  -1.544  -6.047 -10.352
  834   1HB   LEU 107          HB2       LEU 107  -0.387  -8.530  -9.133
  835   2HB   LEU 107          HB1       LEU 107  -0.161  -8.133 -10.824
  836    HG   LEU 107           HG       LEU 107   0.923  -6.017 -10.135
  837   1HD1  LEU 107          1HD1      LEU 107   0.392  -7.118  -7.410
  838   2HD1  LEU 107          2HD1      LEU 107   0.124  -5.489  -8.034
  839   3HD1  LEU 107          3HD1      LEU 107   1.763  -6.050  -7.710
  840   1HD2  LEU 107          1HD2      LEU 107   2.985  -7.142  -9.199
  841   2HD2  LEU 107          2HD2      LEU 107   2.356  -7.804 -10.708
  842   3HD2  LEU 107          3HD2      LEU 107   2.046  -8.634  -9.183
  843    HA   PRO 108           HA       PRO 108  -4.053  -9.332 -12.393
  844   1HB   PRO 108          HB2       PRO 108  -3.413 -11.877 -12.421
  845   2HB   PRO 108          HB1       PRO 108  -2.253 -10.681 -13.018
  846   1HG   PRO 108          HG2       PRO 108  -2.323 -12.098 -10.382
  847   2HG   PRO 108          HG1       PRO 108  -0.936 -11.753 -11.429
  848   1HD   PRO 108          HD2       PRO 108  -1.727 -10.231  -9.222
  849   2HD   PRO 108          HD1       PRO 108  -0.633  -9.714 -10.515
  850    H    CYS 109           HN       CYS 109  -3.565 -11.073  -9.286
  851    HA   CYS 109           HA       CYS 109  -5.891 -12.568  -9.305
  852   1HB   CYS 109          HB2       CYS 109  -4.660 -11.397  -6.804
  853   2HB   CYS 109          HB1       CYS 109  -5.610 -12.868  -6.944
  854    HG   CYS 109           HG       CYS 109  -3.648 -14.456  -7.360
  855    H    LEU 110           HN       LEU 110  -7.248 -11.920  -6.906
  856    HA   LEU 110           HA       LEU 110  -9.431 -10.557  -7.706
  857   1HB   LEU 110          HB2       LEU 110  -8.201 -10.692  -4.967
  858   2HB   LEU 110          HB1       LEU 110  -9.741  -9.905  -5.249
  859    HG   LEU 110           HG       LEU 110 -10.130 -12.132  -4.430
  860   1HD1  LEU 110          1HD1      LEU 110 -10.702 -12.294  -7.369
  861   2HD1  LEU 110          2HD1      LEU 110 -11.527 -11.134  -6.326
  862   3HD1  LEU 110          3HD1      LEU 110 -11.677 -12.863  -6.013
  863   1HD2  LEU 110          1HD2      LEU 110  -9.253 -14.094  -5.346
  864   2HD2  LEU 110          2HD2      LEU 110  -7.884 -12.983  -5.310
  865   3HD2  LEU 110          3HD2      LEU 110  -8.736 -13.283  -6.824
  866    H    LEU 111           HN       LEU 111 -10.295  -8.409  -6.969
  867    HA   LEU 111           HA       LEU 111  -8.217  -6.348  -6.940
  868   1HB   LEU 111          HB2       LEU 111  -9.430  -5.014  -8.595
  869   2HB   LEU 111          HB1       LEU 111  -8.870  -6.535  -9.244
  870    HG   LEU 111           HG       LEU 111 -11.064  -6.015 -10.109
  871   1HD1  LEU 111          1HD1      LEU 111 -10.326  -8.408  -9.164
  872   2HD1  LEU 111          2HD1      LEU 111 -11.856  -8.115  -9.990
  873   3HD1  LEU 111          3HD1      LEU 111 -11.800  -8.159  -8.228
  874   1HD2  LEU 111          1HD2      LEU 111 -12.452  -6.331  -7.532
  875   2HD2  LEU 111          2HD2      LEU 111 -12.839  -5.314  -8.917
  876   3HD2  LEU 111          3HD2      LEU 111 -11.598  -4.808  -7.772
  877    H    ARG 112           HN       ARG 112 -11.357  -7.398  -5.946
  878    HA   ARG 112           HA       ARG 112 -12.363  -4.929  -4.998
  879   1HB   ARG 112          HB2       ARG 112 -12.978  -7.722  -4.013
  880   2HB   ARG 112          HB1       ARG 112 -13.948  -6.285  -3.719
  881   1HG   ARG 112          HG2       ARG 112 -14.354  -6.092  -6.136
  882   2HG   ARG 112          HG1       ARG 112 -13.435  -7.577  -6.389
  883   1HD   ARG 112          HD2       ARG 112 -15.830  -8.026  -6.366
  884   2HD   ARG 112          HD1       ARG 112 -15.026  -8.805  -5.005
  885    HE   ARG 112           HE       ARG 112 -15.955  -6.305  -4.165
  886   1HH1  ARG 112          HH11      ARG 112 -17.222  -9.390  -5.194
  887   2HH1  ARG 112          HH12      ARG 112 -18.672  -9.248  -4.258
  888   1HH2  ARG 112          HH21      ARG 112 -17.863  -6.116  -2.933
  889   2HH2  ARG 112          HH22      ARG 112 -19.037  -7.390  -2.975
  890    H    HIS 113           HN       HIS 113 -12.272  -3.960  -2.989
  891    HA   HIS 113           HA       HIS 113 -10.808  -5.252  -0.840
  892   1HB   HIS 113          HB2       HIS 113  -9.268  -3.293  -0.574
  893   2HB   HIS 113          HB1       HIS 113  -8.970  -4.263  -2.016
  894    HD1  HIS 113           HD1      HIS 113  -7.739  -1.827  -2.564
  895    HD2  HIS 113           HD2      HIS 113 -11.879  -2.030  -2.801
  896    HE1  HIS 113           HE1      HIS 113  -8.429   0.152  -3.949
  897    HE2  HIS 113           HE2      HIS 113 -10.944   0.050  -4.020
  898    H    CYS 114           HN       CYS 114 -11.047  -4.213   1.219
  899    HA   CYS 114           HA       CYS 114 -12.994  -2.029   1.323
  900   1HB   CYS 114          HB2       CYS 114 -14.314  -4.071   1.499
  901   2HB   CYS 114          HB1       CYS 114 -13.292  -4.642   2.817
  902    HG   CYS 114           HG       CYS 114 -15.858  -3.749   3.718
  903    H    CYS 115           HN       CYS 115 -11.719  -4.182   3.851
  904    HA   CYS 115           HA       CYS 115 -10.189  -1.930   4.969
  905   1HB   CYS 115          HB2       CYS 115 -12.523  -2.323   6.032
  906   2HB   CYS 115          HB1       CYS 115 -11.804  -3.768   6.730
  907    HG   CYS 115           HG       CYS 115 -11.308  -2.389   8.859
  908    H    THR 116           HN       THR 116  -8.970  -3.023   7.090
  909    HA   THR 116           HA       THR 116  -7.490  -5.272   5.932
  910    HB   THR 116           HB       THR 116  -6.769  -3.459   8.244
  911    HG1  THR 116           HG1      THR 116  -6.818  -2.534   6.063
  912   1HG2  THR 116          1HG2      THR 116  -5.091  -5.474   6.771
  913   2HG2  THR 116          2HG2      THR 116  -5.619  -5.573   8.450
  914   3HG2  THR 116          3HG2      THR 116  -4.495  -4.309   7.951
  915    H    ARG 117           HN       ARG 117  -6.745  -7.012   7.389
  916    HA   ARG 117           HA       ARG 117  -8.724  -7.547   9.512
  917   1HB   ARG 117          HB2       ARG 117  -9.012  -9.049   7.601
  918   2HB   ARG 117          HB1       ARG 117  -7.322  -9.523   7.701
  919   1HG   ARG 117          HG2       ARG 117  -8.766 -11.218   8.666
  920   2HG   ARG 117          HG1       ARG 117  -7.722 -10.509   9.898
  921   1HD   ARG 117          HD2       ARG 117  -9.565  -9.068  10.623
  922   2HD   ARG 117          HD1       ARG 117 -10.607  -9.784   9.394
  923    HE   ARG 117           HE       ARG 117  -9.589 -11.842  10.991
  924   1HH1  ARG 117          HH11      ARG 117 -11.753  -9.115  11.248
  925   2HH1  ARG 117          HH12      ARG 117 -12.718  -9.839  12.490
  926   1HH2  ARG 117          HH21      ARG 117 -10.857 -12.795  12.625
  927   2HH2  ARG 117          HH22      ARG 117 -12.209 -11.928  13.273
  928    H    VAL 118           HN       VAL 118  -7.140  -6.356  10.862
  929    HA   VAL 118           HA       VAL 118  -5.324  -8.252  12.095
  930    HB   VAL 118           HB       VAL 118  -3.514  -6.429  12.192
  931   1HG1  VAL 118          1HG1      VAL 118  -2.394  -7.584  10.601
  932   2HG1  VAL 118          2HG1      VAL 118  -3.678  -7.391   9.407
  933   3HG1  VAL 118          3HG1      VAL 118  -3.817  -8.623  10.661
  934   1HG2  VAL 118          1HG2      VAL 118  -3.824  -5.317   9.682
  935   2HG2  VAL 118          2HG2      VAL 118  -4.052  -4.490  11.223
  936   3HG2  VAL 118          3HG2      VAL 118  -5.435  -5.197  10.389
  937    H    ALA 119           HN       ALA 119  -5.788  -4.710  12.274
  938    HA   ALA 119           HA       ALA 119  -5.702  -4.687  15.103
  939   1HB   ALA 119          HB1       ALA 119  -6.990  -2.470  13.584
  940   2HB   ALA 119          HB2       ALA 119  -5.272  -2.788  13.345
  941   3HB   ALA 119          HB3       ALA 119  -5.882  -2.404  14.953
  942    H    LEU 120           HN       LEU 120  -7.749  -3.072  15.932
  943    HA   LEU 120           HA       LEU 120  -9.798  -4.888  16.489
  944   1HB   LEU 120          HB2       LEU 120  -9.880  -1.872  16.607
  945   2HB   LEU 120          HB1       LEU 120 -11.027  -2.950  17.380
  946    HG   LEU 120           HG       LEU 120  -8.090  -2.723  18.042
  947   1HD1  LEU 120          1HD1      LEU 120  -8.662  -1.498  19.896
  948   2HD1  LEU 120          2HD1      LEU 120 -10.317  -2.108  19.924
  949   3HD1  LEU 120          3HD1      LEU 120  -9.841  -0.904  18.726
  950   1HD2  LEU 120          1HD2      LEU 120  -8.642  -4.226  19.917
  951   2HD2  LEU 120          2HD2      LEU 120  -8.849  -4.999  18.344
  952   3HD2  LEU 120          3HD2      LEU 120 -10.258  -4.439  19.244
  953    HA   PRO1135           HA       PRO1135  13.591 -10.302  -9.587
  954   1HB   PRO1135          HB2       PRO1135  11.506 -10.875  -7.534
  955   2HB   PRO1135          HB1       PRO1135  11.323 -10.544  -9.260
  956   1HG   PRO1135          HG2       PRO1135  11.079 -13.023  -8.323
  957   2HG   PRO1135          HG1       PRO1135  11.885 -12.710  -9.871
  958   1HD   PRO1135          HD2       PRO1135  13.068 -13.403  -7.223
  959   2HD   PRO1135          HD1       PRO1135  13.606 -13.851  -8.853
  960    H    GLN1136           HN       GLN1136  14.963  -8.702  -8.837
  961    HA   GLN1136           HA       GLN1136  15.291  -7.909  -6.182
  962   1HB   GLN1136          HB2       GLN1136  15.561  -6.243  -8.689
  963   2HB   GLN1136          HB1       GLN1136  16.182  -5.799  -7.106
  964   1HG   GLN1136          HG2       GLN1136  17.655  -7.739  -7.132
  965   2HG   GLN1136          HG1       GLN1136  17.025  -8.200  -8.714
  966    HA   PRO1137           HA       PRO1137  11.839  -4.482  -7.401
  967   1HB   PRO1137          HB2       PRO1137  10.146  -6.584  -8.694
  968   2HB   PRO1137          HB1       PRO1137  10.225  -4.848  -9.021
  969   1HG   PRO1137          HG2       PRO1137  11.421  -6.572 -10.647
  970   2HG   PRO1137          HG1       PRO1137  12.199  -5.032 -10.233
  971   1HD   PRO1137          HD2       PRO1137  12.820  -7.786  -9.286
  972   2HD   PRO1137          HD1       PRO1137  13.907  -6.410  -9.553
  973    H    GLU1138           HN       GLU1138  11.134  -4.276  -5.364
  974    HA   GLU1138           HA       GLU1138   9.447  -6.423  -4.276
  975   1HB   GLU1138          HB2       GLU1138  10.341  -5.560  -1.989
  976   2HB   GLU1138          HB1       GLU1138  11.305  -6.677  -2.938
  977   1HG   GLU1138          HG2       GLU1138  12.691  -4.936  -2.015
  978   2HG   GLU1138          HG1       GLU1138  12.644  -4.808  -3.771
  979   2HN   PTR1139          HN        PTR1139   9.398  -3.321  -5.349
  980   2HN   PTR1139          HN        PTR1139   9.398  -3.321  -5.349
  981    HA   PTR1139           HA       PTR1139   7.365  -2.522  -3.413
  982    HA   PTR1139           HA       PTR1139   7.365  -2.522  -3.413
  983   1HB   PTR1139          HB1       PTR1139   7.891  -0.234  -4.763
  984   1HB   PTR1139          HB1       PTR1139   7.891  -0.234  -4.763
  985   2HB   PTR1139          HB2       PTR1139   9.465  -1.033  -4.755
  986   2HB   PTR1139          HB2       PTR1139   9.465  -1.033  -4.755
  987    HD1  PTR1139           HD1      PTR1139   6.624  -0.299  -2.475
  988    HD1  PTR1139           HD1      PTR1139   6.624  -0.299  -2.475
  989    HD2  PTR1139           HD2      PTR1139  10.819  -0.720  -2.908
  990    HD2  PTR1139           HD2      PTR1139  10.819  -0.720  -2.908
  991    HE1  PTR1139           HE1      PTR1139   6.912   0.401  -0.146
  992    HE1  PTR1139           HE1      PTR1139   6.912   0.401  -0.146
  993    HE2  PTR1139           HE2      PTR1139  11.137  -0.012  -0.535
  994    HE2  PTR1139           HE2      PTR1139  11.137  -0.012  -0.535
  995    H    VAL1140           HN       VAL1140   8.063  -2.246  -6.856
  996    HA   VAL1140           HA       VAL1140   6.569  -2.777  -8.594
  997    HB   VAL1140           HB       VAL1140   4.276  -2.310  -6.665
  998   1HG1  VAL1140          1HG1      VAL1140   3.046  -3.666  -8.413
  999   2HG1  VAL1140          2HG1      VAL1140   4.450  -3.425  -9.452
 1000   3HG1  VAL1140          3HG1      VAL1140   3.524  -2.035  -8.885
 1001   1HG2  VAL1140          1HG2      VAL1140   4.726  -5.067  -7.507
 1002   2HG2  VAL1140          2HG2      VAL1140   4.411  -4.412  -5.900
 1003   3HG2  VAL1140          3HG2      VAL1140   6.054  -4.420  -6.543
 1004    H    ASN1141           HN       ASN1141   5.407  -1.626  -9.972
 1005    HA   ASN1141           HA       ASN1141   4.462   0.313 -10.930
 1006   1HB   ASN1141          HB2       ASN1141   5.984   1.875  -8.800
 1007   2HB   ASN1141          HB1       ASN1141   4.888   2.525 -10.009
 1008   1HD2  ASN1141          1HD2      ASN1141   5.131   2.000  -6.877
 1009   2HD2  ASN1141          2HD2      ASN1141   3.479   1.738  -6.471
 1010    H    GLN1142           HN       GLN1142   7.407  -0.317  -9.324
 1011    HA   GLN1142           HA       GLN1142   8.969  -0.655 -11.600
 1012   1HB   GLN1142          HB2       GLN1142   9.506   1.705  -9.794
 1013   2HB   GLN1142          HB1       GLN1142  10.733   1.025 -10.836
 1014   1HG   GLN1142          HG2       GLN1142  10.084   2.507 -12.358
 1015   2HG   GLN1142          HG1       GLN1142   8.647   1.513 -12.569
 1016    HA   PRO1143           HA       PRO1143  11.295  -3.249  -8.829
 1017   1HB   PRO1143          HB2       PRO1143  13.572  -1.299  -8.801
 1018   2HB   PRO1143          HB1       PRO1143  13.605  -3.053  -9.030
 1019   1HG   PRO1143          HG2       PRO1143  13.886  -1.410 -11.109
 1020   2HG   PRO1143          HG1       PRO1143  12.951  -2.909 -11.253
 1021   1HD   PRO1143          HD2       PRO1143  12.006  -0.094 -11.081
 1022   2HD   PRO1143          HD1       PRO1143  11.285  -1.476 -11.929
 1023    H    ASP1144           HN       ASP1144  11.207   0.186  -8.336
 1024    HA   ASP1144           HA       ASP1144   9.866   0.388  -6.078
 1025   1HB   ASP1144          HB2       ASP1144  11.540   0.642  -4.230
 1026   2HB   ASP1144          HB1       ASP1144  11.422  -1.005  -4.830