*HEADER    TRANSCRIPTION                           23-JUL-01   1JN7              
*TITLE     SOLUTION STRUCTURE OF A CCHH MUTANT OF THE NINTH CCHC ZINC            
*TITLE    2 FINGER OF U-SHAPED                                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: U-SHAPED TRANSCRIPTIONAL COFACTOR;                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: NINTH ZINC-FINGER DOMAIN;                                  
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER;                        
*SOURCE   3 ORGANISM_COMMON: FRUIT FLY;                                          
*SOURCE   4 GENE: U-SHAPED;                                                      
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PGEX-2T                                   
*KEYWDS    ZINC FINGER, PROTEIN-PROTEIN INTERACTION, TRANSCRIPTION               
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    K.KOWALSKI, J.P.MACKAY                                                
*REVDAT   1   25-SEP-02 1JN7    0                                                
remark input file: noe.cfm                                           
remark output file: noe.tbl                                           
set echo=false end
set wrnlev=0 end
! range |i-j| =     0
assign (resid   5 and name HN    )(resid   5 and name HG*   )  0.00  0.00  5.69
assign (resid   6 and name HN    )(resid   6 and name HB    )  0.00  0.00  2.74
assign (resid   6 and name HN    )(resid   6 and name HG*   )  0.00  0.00  4.31
assign (resid   7 and name HN    )(resid   7 and name HA    )  0.00  0.00  2.86
assign (resid   7 and name HN    )(resid   7 and name HG*   )  0.00  0.00  5.64
assign (resid   8 and name HN    )(resid   8 and name HA    )  0.00  0.00  2.90
assign (resid   8 and name HN    )(resid   8 and name HG*   )  0.00  0.00  5.48
assign (resid   8 and name HA    )(resid   8 and name HD*   )  0.00  0.00  5.91
assign (resid   9 and name HN    )(resid   9 and name HB2   )  0.00  0.00  3.92
assign (resid   9 and name HN    )(resid   9 and name HB1   )  0.00  0.00  3.92
assign (resid   9 and name HN    )(resid   9 and name HB*   )  0.00  0.00  3.61
assign (resid   9 and name HN    )(resid   9 and name HG*   )  0.00  0.00  5.01
assign (resid   9 and name HN    )(resid   9 and name HD*   )  0.00  0.00  4.89
assign (resid  10 and name HN    )(resid  10 and name HB2   )  0.00  0.00  3.74
assign (resid  10 and name HN    )(resid  10 and name HB1   )  0.00  0.00  3.46
assign (resid  11 and name HN    )(resid  11 and name HB1   )  0.00  0.00  3.49
assign (resid  12 and name HN    )(resid  12 and name HB2   )  0.00  0.00  4.05
assign (resid  12 and name HN    )(resid  12 and name HB1   )  0.00  0.00  4.05
assign (resid  12 and name HN    )(resid  12 and name HB*   )  0.00  0.00  3.71
assign (resid  13 and name HN    )(resid  13 and name HA    )  0.00  0.00  2.86
assign (resid  13 and name HN    )(resid  13 and name HB    )  0.00  0.00  2.74
assign (resid  13 and name HN    )(resid  13 and name HG2*  )  0.00  0.00  4.88
assign (resid  14 and name HN    )(resid  14 and name HB2   )  0.00  0.00  3.52
assign (resid  14 and name HN    )(resid  14 and name HB1   )  0.00  0.00  3.74
assign (resid  15 and name HN    )(resid  15 and name HB2   )  0.00  0.00  3.46
assign (resid  15 and name HN    )(resid  15 and name HB1   )  0.00  0.00  3.95
assign (resid  16 and name HN    )(resid  16 and name HB    )  0.00  0.00  3.14
assign (resid  16 and name HN    )(resid  16 and name HG12  )  0.00  0.00  4.91
assign (resid  16 and name HN    )(resid  16 and name HG11  )  0.00  0.00  4.91
assign (resid  16 and name HN    )(resid  16 and name HD*   )  0.00  0.00  5.35
assign (resid  16 and name HA    )(resid  16 and name HB    )  0.00  0.00  3.02
assign (resid  16 and name HA    )(resid  16 and name HG12  )  0.00  0.00  3.83
assign (resid  16 and name HA    )(resid  16 and name HG11  )  0.00  0.00  3.83
assign (resid  16 and name HA    )(resid  16 and name HD*   )  0.00  0.00  4.76
assign (resid  17 and name HN    )(resid  17 and name HB2   )  0.00  0.00  3.61
assign (resid  17 and name HN    )(resid  17 and name HB1   )  0.00  0.00  3.61
assign (resid  17 and name HN    )(resid  17 and name HB*   )  0.00  0.00  3.40
assign (resid  18 and name HN    )(resid  18 and name HB2   )  0.00  0.00  3.46
assign (resid  18 and name HN    )(resid  18 and name HB1   )  0.00  0.00  3.71
assign (resid  18 and name HN    )(resid  18 and name HE*   )  0.00  0.00  7.62
assign (resid  19 and name HN    )(resid  19 and name HB2   )  0.00  0.00  3.46
assign (resid  19 and name HN    )(resid  19 and name HB1   )  0.00  0.00  3.86
assign (resid  19 and name HN    )(resid  19 and name HD21  )  0.00  0.00  5.50
assign (resid  19 and name HN    )(resid  19 and name HD22  )  0.00  0.00  5.50
assign (resid  19 and name HA    )(resid  19 and name HD21  )  0.00  0.00  5.50
assign (resid  19 and name HA    )(resid  19 and name HD22  )  0.00  0.00  5.50
assign (resid  20 and name HN    )(resid  20 and name HB2   )  0.00  0.00  3.52
assign (resid  20 and name HN    )(resid  20 and name HB1   )  0.00  0.00  3.83
assign (resid  21 and name HN    )(resid  21 and name HB    )  0.00  0.00  2.80
assign (resid  21 and name HN    )(resid  21 and name HG*   )  0.00  0.00  4.25
assign (resid  22 and name HN    )(resid  22 and name HD2   )  0.00  0.00  5.10
assign (resid  22 and name HN    )(resid  22 and name HD1   )  0.00  0.00  5.10
assign (resid  22 and name HN    )(resid  22 and name HD*   )  0.00  0.00  4.41
assign (resid  23 and name HN    )(resid  23 and name HB    )  0.00  0.00  2.96
assign (resid  24 and name HN    )(resid  24 and name HB2   )  0.00  0.00  3.46
assign (resid  24 and name HN    )(resid  24 and name HB1   )  0.00  0.00  3.46
assign (resid  24 and name HN    )(resid  24 and name HB*   )  0.00  0.00  3.22
assign (resid  25 and name HN    )(resid  25 and name HD1*  )  0.00  0.00  5.32
assign (resid  25 and name HN    )(resid  25 and name HD2*  )  0.00  0.00  5.32
assign (resid  25 and name HN    )(resid  25 and name HD*   )  0.00  0.00  4.92
assign (resid  25 and name HA    )(resid  25 and name HD1*  )  0.00  0.00  5.26
assign (resid  25 and name HA    )(resid  25 and name HD2*  )  0.00  0.00  5.26
assign (resid  25 and name HA    )(resid  25 and name HD*   )  0.00  0.00  4.22
assign (resid  26 and name HN    )(resid  26 and name HA    )  0.00  0.00  2.74
assign (resid  27 and name HN    )(resid  27 and name HB2   )  0.00  0.00  3.27
assign (resid  27 and name HN    )(resid  27 and name HB1   )  0.00  0.00  3.12
assign (resid  27 and name HA    )(resid  27 and name HD2   )  0.00  0.00  5.50
assign (resid  28 and name HN    )(resid  28 and name HB2   )  0.00  0.00  3.67
assign (resid  28 and name HN    )(resid  28 and name HB1   )  0.00  0.00  3.67
assign (resid  28 and name HN    )(resid  28 and name HB*   )  0.00  0.00  3.44
assign (resid  28 and name HN    )(resid  28 and name HG*   )  0.00  0.00  5.63
assign (resid  28 and name HA    )(resid  28 and name HD*   )  0.00  0.00  6.38
assign (resid  29 and name HN    )(resid  29 and name HB2   )  0.00  0.00  3.30
assign (resid  29 and name HN    )(resid  29 and name HB1   )  0.00  0.00  3.36
assign (resid  29 and name HN    )(resid  29 and name HG*   )  0.00  0.00  5.76
assign (resid  29 and name HA    )(resid  29 and name HG2   )  0.00  0.00  4.14
assign (resid  29 and name HA    )(resid  29 and name HG1   )  0.00  0.00  4.14
assign (resid  29 and name HA    )(resid  29 and name HG*   )  0.00  0.00  3.91
assign (resid  30 and name HN    )(resid  30 and name HB2   )  0.00  0.00  3.43
assign (resid  30 and name HN    )(resid  30 and name HB1   )  0.00  0.00  3.55
assign (resid  31 and name HN    )(resid  31 and name HB2   )  0.00  0.00  3.49
assign (resid  32 and name HN    )(resid  32 and name HB2   )  0.00  0.00  3.67
assign (resid  32 and name HN    )(resid  32 and name HB1   )  0.00  0.00  4.02
assign (resid  32 and name HN    )(resid  32 and name HD2   )  0.00  0.00  4.60
assign (resid  32 and name HA    )(resid  32 and name HD2   )  0.00  0.00  5.50
assign (resid  32 and name HA    )(resid  32 and name HE1   )  0.00  0.00  5.50
assign (resid  33 and name HN    )(resid  33 and name HG*   )  0.00  0.00  5.04
assign (resid  33 and name HA    )(resid  33 and name HD*   )  0.00  0.00  6.38
assign (resid  34 and name HN    )(resid  34 and name HB2   )  0.00  0.00  4.20
assign (resid  34 and name HN    )(resid  34 and name HB1   )  0.00  0.00  4.20
assign (resid  35 and name HA    )(resid  35 and name HD*   )  0.00  0.00  6.38
! total in this range:     91
! range |i-j| =     1
assign (resid   2 and name HA    )(resid   3 and name HN    )  0.00  0.00  3.08
assign (resid   3 and name HN    )(resid   4 and name HN    )  0.00  0.00  3.76
assign (resid   3 and name HA    )(resid   4 and name HN    )  0.00  0.00  2.99
assign (resid   5 and name HN    )(resid   6 and name HN    )  0.00  0.00  2.49
assign (resid   5 and name HA    )(resid   6 and name HN    )  0.00  0.00  2.62
assign (resid   5 and name HG*   )(resid   6 and name HN    )  0.00  0.00  6.38
assign (resid   6 and name HG1*  )(resid   7 and name HN    )  0.00  0.00  5.16
assign (resid   6 and name HG2*  )(resid   7 and name HN    )  0.00  0.00  5.16
assign (resid   7 and name HA    )(resid   8 and name HN    )  0.00  0.00  2.49
assign (resid   7 and name HG*   )(resid   8 and name HN    )  0.00  0.00  6.22
assign (resid   8 and name HB*   )(resid   9 and name HN    )  0.00  0.00  4.83
assign (resid   8 and name HG*   )(resid   9 and name HN    )  0.00  0.00  6.38
assign (resid   9 and name HN    )(resid  10 and name HN    )  0.00  0.00  2.83
assign (resid   9 and name HA    )(resid  10 and name HN    )  0.00  0.00  2.74
assign (resid   9 and name HB*   )(resid  10 and name HN    )  0.00  0.00  5.42
assign (resid  10 and name HA    )(resid  11 and name HN    )  0.00  0.00  2.46
assign (resid  10 and name HB1   )(resid  11 and name HN    )  0.00  0.00  4.48
assign (resid  10 and name HD*   )(resid  11 and name HN    )  0.00  0.00  7.24
assign (resid  10 and name HE*   )(resid  11 and name HN    )  0.00  0.00  7.63
assign (resid  11 and name HB2   )(resid  12 and name HN    )  0.00  0.00  4.36
assign (resid  11 and name HB1   )(resid  12 and name HN    )  0.00  0.00  4.85
assign (resid  12 and name HN    )(resid  13 and name HN    )  0.00  0.00  2.93
assign (resid  12 and name HN    )(resid  13 and name HB    )  0.00  0.00  4.91
assign (resid  12 and name HN    )(resid  13 and name HG2*  )  0.00  0.00  6.53
assign (resid  13 and name HN    )(resid  14 and name HN    )  0.00  0.00  2.49
assign (resid  13 and name HB    )(resid  14 and name HN    )  0.00  0.00  2.74
assign (resid  14 and name HB1   )(resid  15 and name HN    )  0.00  0.00  4.33
assign (resid  15 and name HN    )(resid  16 and name HN    )  0.00  0.00  2.90
assign (resid  15 and name HN    )(resid  16 and name HG2*  )  0.00  0.00  6.53
assign (resid  15 and name HN    )(resid  16 and name HG12  )  0.00  0.00  5.50
assign (resid  15 and name HN    )(resid  16 and name HG11  )  0.00  0.00  5.50
assign (resid  15 and name HN    )(resid  16 and name HD*   )  0.00  0.00  6.53
assign (resid  15 and name HA    )(resid  16 and name HN    )  0.00  0.00  2.77
assign (resid  15 and name HB2   )(resid  16 and name HN    )  0.00  0.00  4.36
assign (resid  15 and name HB1   )(resid  16 and name HN    )  0.00  0.00  4.85
assign (resid  16 and name HA    )(resid  17 and name HN    )  0.00  0.00  2.40
assign (resid  16 and name HB    )(resid  17 and name HN    )  0.00  0.00  3.36
assign (resid  16 and name HG2*  )(resid  17 and name HN    )  0.00  0.00  4.30
assign (resid  16 and name HG2*  )(resid  17 and name HA    )  0.00  0.00  6.53
assign (resid  16 and name HG12  )(resid  17 and name HN    )  0.00  0.00  5.50
assign (resid  16 and name HG11  )(resid  17 and name HN    )  0.00  0.00  5.50
assign (resid  16 and name HG1*  )(resid  17 and name HN    )  0.00  0.00  5.20
assign (resid  16 and name HD*   )(resid  17 and name HN    )  0.00  0.00  6.19
assign (resid  17 and name HA    )(resid  18 and name HN    )  0.00  0.00  2.52
assign (resid  17 and name HA    )(resid  18 and name HB2   )  0.00  0.00  4.57
assign (resid  17 and name HA    )(resid  18 and name HD*   )  0.00  0.00  6.57
assign (resid  17 and name HA    )(resid  18 and name HE*   )  0.00  0.00  7.62
assign (resid  17 and name HB2   )(resid  18 and name HN    )  0.00  0.00  4.02
assign (resid  17 and name HB1   )(resid  18 and name HN    )  0.00  0.00  4.02
assign (resid  18 and name HN    )(resid  19 and name HN    )  0.00  0.00  4.23
assign (resid  18 and name HA    )(resid  19 and name HN    )  0.00  0.00  2.62
assign (resid  18 and name HB2   )(resid  19 and name HN    )  0.00  0.00  4.20
assign (resid  18 and name HB1   )(resid  19 and name HN    )  0.00  0.00  3.80
assign (resid  18 and name HD*   )(resid  19 and name HN    )  0.00  0.00  7.62
assign (resid  19 and name HN    )(resid  20 and name HN    )  0.00  0.00  2.99
assign (resid  19 and name HA    )(resid  20 and name HE*   )  0.00  0.00  7.63
assign (resid  19 and name HB2   )(resid  20 and name HN    )  0.00  0.00  4.26
assign (resid  19 and name HB2   )(resid  20 and name HD*   )  0.00  0.00  7.92
assign (resid  19 and name HB2   )(resid  20 and name HE*   )  0.00  0.00  8.13
assign (resid  19 and name HB1   )(resid  20 and name HN    )  0.00  0.00  4.20
assign (resid  19 and name HB1   )(resid  20 and name HD*   )  0.00  0.00  8.14
assign (resid  19 and name HB1   )(resid  20 and name HE*   )  0.00  0.00  8.13
assign (resid  20 and name HN    )(resid  21 and name HN    )  0.00  0.00  4.48
assign (resid  20 and name HA    )(resid  21 and name HN    )  0.00  0.00  2.59
assign (resid  20 and name HA    )(resid  21 and name HG1*  )  0.00  0.00  6.53
assign (resid  20 and name HA    )(resid  21 and name HG2*  )  0.00  0.00  6.53
assign (resid  20 and name HA    )(resid  21 and name HG*   )  0.00  0.00  5.92
assign (resid  20 and name HB2   )(resid  21 and name HN    )  0.00  0.00  4.36
assign (resid  20 and name HB1   )(resid  21 and name HN    )  0.00  0.00  3.83
assign (resid  20 and name HD*   )(resid  21 and name HN    )  0.00  0.00  7.64
assign (resid  20 and name HD*   )(resid  21 and name HG1*  )  0.00  0.00  8.67
assign (resid  20 and name HD*   )(resid  21 and name HG2*  )  0.00  0.00  8.67
assign (resid  20 and name HE*   )(resid  21 and name HN    )  0.00  0.00  7.63
assign (resid  21 and name HN    )(resid  22 and name HN    )  0.00  0.00  3.08
assign (resid  21 and name HN    )(resid  22 and name HA    )  0.00  0.00  5.41
assign (resid  21 and name HB    )(resid  22 and name HN    )  0.00  0.00  2.93
assign (resid  21 and name HG1*  )(resid  22 and name HN    )  0.00  0.00  5.85
assign (resid  21 and name HG2*  )(resid  22 and name HN    )  0.00  0.00  5.85
assign (resid  21 and name HG*   )(resid  22 and name HN    )  0.00  0.00  4.97
assign (resid  22 and name HN    )(resid  23 and name HN    )  0.00  0.00  3.05
assign (resid  22 and name HA    )(resid  23 and name HN    )  0.00  0.00  3.55
assign (resid  22 and name HB2   )(resid  23 and name HN    )  0.00  0.00  4.08
assign (resid  22 and name HB1   )(resid  23 and name HN    )  0.00  0.00  4.08
assign (resid  22 and name HB*   )(resid  23 and name HN    )  0.00  0.00  3.87
assign (resid  22 and name HG*   )(resid  23 and name HN    )  0.00  0.00  6.38
assign (resid  22 and name HD2   )(resid  23 and name HN    )  0.00  0.00  5.50
assign (resid  22 and name HD1   )(resid  23 and name HN    )  0.00  0.00  5.50
assign (resid  22 and name HD*   )(resid  23 and name HN    )  0.00  0.00  5.12
assign (resid  23 and name HN    )(resid  24 and name HN    )  0.00  0.00  2.77
assign (resid  23 and name HN    )(resid  24 and name HB2   )  0.00  0.00  6.00
assign (resid  23 and name HN    )(resid  24 and name HB1   )  0.00  0.00  6.00
assign (resid  23 and name HN    )(resid  24 and name HB*   )  0.00  0.00  5.69
assign (resid  23 and name HA    )(resid  24 and name HN    )  0.00  0.00  3.61
assign (resid  23 and name HB    )(resid  24 and name HN    )  0.00  0.00  3.30
assign (resid  23 and name HG2*  )(resid  24 and name HN    )  0.00  0.00  5.85
assign (resid  24 and name HN    )(resid  25 and name HN    )  0.00  0.00  2.93
assign (resid  24 and name HN    )(resid  25 and name HB2   )  0.00  0.00  5.07
assign (resid  24 and name HN    )(resid  25 and name HG    )  0.00  0.00  5.50
assign (resid  24 and name HB2   )(resid  25 and name HN    )  0.00  0.00  3.92
assign (resid  24 and name HB1   )(resid  25 and name HN    )  0.00  0.00  3.92
assign (resid  24 and name HB*   )(resid  25 and name HN    )  0.00  0.00  3.61
assign (resid  24 and name HD*   )(resid  25 and name HN    )  0.00  0.00  7.27
assign (resid  24 and name HD*   )(resid  25 and name HA    )  0.00  0.00  7.64
assign (resid  24 and name HD*   )(resid  25 and name HB2   )  0.00  0.00  8.14
assign (resid  24 and name HD*   )(resid  25 and name HG    )  0.00  0.00  6.37
assign (resid  24 and name HD*   )(resid  25 and name HD1*  )  0.00  0.00  8.67
assign (resid  24 and name HD*   )(resid  25 and name HD2*  )  0.00  0.00  8.67
assign (resid  24 and name HD*   )(resid  25 and name HD*   )  0.00  0.00  7.79
assign (resid  24 and name HE*   )(resid  25 and name HN    )  0.00  0.00  7.63
assign (resid  24 and name HE*   )(resid  25 and name HA    )  0.00  0.00  7.63
assign (resid  24 and name HE*   )(resid  25 and name HB2   )  0.00  0.00  8.13
assign (resid  24 and name HE*   )(resid  25 and name HD1*  )  0.00  0.00  8.66
assign (resid  24 and name HE*   )(resid  25 and name HD2*  )  0.00  0.00  8.66
assign (resid  24 and name HE*   )(resid  25 and name HD*   )  0.00  0.00  7.83
assign (resid  25 and name HN    )(resid  26 and name HN    )  0.00  0.00  2.96
assign (resid  25 and name HB2   )(resid  26 and name HN    )  0.00  0.00  3.61
assign (resid  25 and name HB1   )(resid  26 and name HN    )  0.00  0.00  3.83
assign (resid  25 and name HG    )(resid  26 and name HN    )  0.00  0.00  5.50
assign (resid  25 and name HD1*  )(resid  26 and name HN    )  0.00  0.00  6.53
assign (resid  25 and name HD2*  )(resid  26 and name HN    )  0.00  0.00  6.53
assign (resid  27 and name HN    )(resid  28 and name HN    )  0.00  0.00  3.14
assign (resid  27 and name HB2   )(resid  28 and name HN    )  0.00  0.00  4.36
assign (resid  27 and name HB1   )(resid  28 and name HN    )  0.00  0.00  3.71
assign (resid  27 and name HD2   )(resid  28 and name HN    )  0.00  0.00  5.25
assign (resid  27 and name HD2   )(resid  28 and name HA    )  0.00  0.00  4.20
assign (resid  27 and name HD2   )(resid  28 and name HB2   )  0.00  0.00  6.00
assign (resid  27 and name HD2   )(resid  28 and name HB1   )  0.00  0.00  6.00
assign (resid  27 and name HD2   )(resid  28 and name HB*   )  0.00  0.00  5.74
assign (resid  27 and name HD2   )(resid  28 and name HG*   )  0.00  0.00  6.38
assign (resid  28 and name HN    )(resid  29 and name HN    )  0.00  0.00  3.30
assign (resid  28 and name HB2   )(resid  29 and name HN    )  0.00  0.00  3.80
assign (resid  28 and name HB1   )(resid  29 and name HN    )  0.00  0.00  3.80
assign (resid  28 and name HB*   )(resid  29 and name HN    )  0.00  0.00  3.59
assign (resid  29 and name HA    )(resid  30 and name HN    )  0.00  0.00  3.61
assign (resid  29 and name HB2   )(resid  30 and name HN    )  0.00  0.00  3.89
assign (resid  29 and name HB2   )(resid  30 and name HD*   )  0.00  0.00  8.12
assign (resid  29 and name HB1   )(resid  30 and name HN    )  0.00  0.00  3.67
assign (resid  29 and name HB1   )(resid  30 and name HD*   )  0.00  0.00  8.12
assign (resid  29 and name HG*   )(resid  30 and name HN    )  0.00  0.00  6.38
assign (resid  29 and name HG*   )(resid  30 and name HD*   )  0.00  0.00  8.50
assign (resid  30 and name HN    )(resid  31 and name HN    )  0.00  0.00  2.93
assign (resid  30 and name HB2   )(resid  31 and name HN    )  0.00  0.00  4.45
assign (resid  30 and name HB1   )(resid  31 and name HN    )  0.00  0.00  3.74
assign (resid  30 and name HB1   )(resid  31 and name HE*   )  0.00  0.00  8.13
assign (resid  30 and name HD*   )(resid  31 and name HN    )  0.00  0.00  7.62
assign (resid  30 and name HD*   )(resid  31 and name HA    )  0.00  0.00  7.62
assign (resid  31 and name HN    )(resid  32 and name HN    )  0.00  0.00  2.90
assign (resid  31 and name HA    )(resid  32 and name HN    )  0.00  0.00  3.61
assign (resid  31 and name HB2   )(resid  32 and name HN    )  0.00  0.00  4.26
assign (resid  31 and name HB1   )(resid  32 and name HN    )  0.00  0.00  4.33
assign (resid  31 and name HD*   )(resid  32 and name HA    )  0.00  0.00  7.64
assign (resid  31 and name HD*   )(resid  32 and name HB2   )  0.00  0.00  7.80
assign (resid  31 and name HD*   )(resid  32 and name HB1   )  0.00  0.00  8.14
assign (resid  31 and name HE*   )(resid  32 and name HE1   )  0.00  0.00  7.63
assign (resid  32 and name HN    )(resid  33 and name HN    )  0.00  0.00  3.11
assign (resid  32 and name HA    )(resid  33 and name HN    )  0.00  0.00  3.05
assign (resid  32 and name HB2   )(resid  33 and name HN    )  0.00  0.00  4.76
assign (resid  33 and name HN    )(resid  34 and name HN    )  0.00  0.00  3.02
assign (resid  33 and name HA    )(resid  34 and name HN    )  0.00  0.00  2.74
assign (resid  33 and name HB*   )(resid  34 and name HN    )  0.00  0.00  5.02
assign (resid  33 and name HG*   )(resid  34 and name HN    )  0.00  0.00  5.69
assign (resid  34 and name HN    )(resid  35 and name HN    )  0.00  0.00  3.17
assign (resid  34 and name HA    )(resid  35 and name HN    )  0.00  0.00  3.08
assign (resid  34 and name HB2   )(resid  35 and name HN    )  0.00  0.00  5.07
assign (resid  34 and name HB1   )(resid  35 and name HN    )  0.00  0.00  5.07
assign (resid  35 and name HA    )(resid  36 and name HD2   )  0.00  0.00  3.45
assign (resid  35 and name HA    )(resid  36 and name HD1   )  0.00  0.00  3.45
assign (resid  35 and name HA    )(resid  36 and name HD*   )  0.00  0.00  3.26
! total in this range:    168
! range |i-j| =     2
assign (resid   4 and name HB*   )(resid   6 and name HN    )  0.00  0.00  7.03
assign (resid   6 and name HG*   )(resid   8 and name HN    )  0.00  0.00  7.93
assign (resid  10 and name HD*   )(resid  12 and name HN    )  0.00  0.00  7.64
assign (resid  10 and name HD*   )(resid  12 and name HA    )  0.00  0.00  7.24
assign (resid  10 and name HD*   )(resid  12 and name HB2   )  0.00  0.00  7.89
assign (resid  10 and name HD*   )(resid  12 and name HB1   )  0.00  0.00  7.89
assign (resid  10 and name HD*   )(resid  12 and name HB*   )  0.00  0.00  7.77
assign (resid  10 and name HE*   )(resid  12 and name HN    )  0.00  0.00  7.63
assign (resid  10 and name HE*   )(resid  12 and name HA    )  0.00  0.00  5.68
assign (resid  10 and name HE*   )(resid  12 and name HB2   )  0.00  0.00  6.52
assign (resid  10 and name HE*   )(resid  12 and name HB1   )  0.00  0.00  6.52
assign (resid  10 and name HE*   )(resid  12 and name HB*   )  0.00  0.00  6.39
assign (resid  12 and name HN    )(resid  14 and name HN    )  0.00  0.00  4.23
assign (resid  13 and name HG2*  )(resid  15 and name HN    )  0.00  0.00  6.53
assign (resid  14 and name HN    )(resid  16 and name HN    )  0.00  0.00  4.04
assign (resid  14 and name HN    )(resid  16 and name HG1*  )  0.00  0.00  6.38
assign (resid  14 and name HB2   )(resid  16 and name HN    )  0.00  0.00  4.29
assign (resid  14 and name HB2   )(resid  16 and name HB    )  0.00  0.00  4.51
assign (resid  14 and name HB2   )(resid  16 and name HG2*  )  0.00  0.00  6.75
assign (resid  14 and name HB2   )(resid  16 and name HG12  )  0.00  0.00  4.73
assign (resid  14 and name HB2   )(resid  16 and name HG11  )  0.00  0.00  4.73
assign (resid  14 and name HB2   )(resid  16 and name HG1*  )  0.00  0.00  4.16
assign (resid  14 and name HB2   )(resid  16 and name HD*   )  0.00  0.00  5.26
assign (resid  14 and name HB1   )(resid  16 and name HN    )  0.00  0.00  5.10
assign (resid  14 and name HB1   )(resid  16 and name HB    )  0.00  0.00  5.13
assign (resid  14 and name HB1   )(resid  16 and name HG2*  )  0.00  0.00  6.22
assign (resid  14 and name HB1   )(resid  16 and name HG12  )  0.00  0.00  4.70
assign (resid  14 and name HB1   )(resid  16 and name HG11  )  0.00  0.00  4.70
assign (resid  14 and name HB1   )(resid  16 and name HG1*  )  0.00  0.00  4.06
assign (resid  14 and name HB1   )(resid  16 and name HD*   )  0.00  0.00  4.95
assign (resid  16 and name HB    )(resid  18 and name HD*   )  0.00  0.00  7.62
assign (resid  16 and name HB    )(resid  18 and name HE*   )  0.00  0.00  6.78
assign (resid  16 and name HB    )(resid  18 and name HZ    )  0.00  0.00  4.88
assign (resid  16 and name HG2*  )(resid  18 and name HN    )  0.00  0.00  6.53
assign (resid  16 and name HG2*  )(resid  18 and name HA    )  0.00  0.00  6.53
assign (resid  16 and name HG2*  )(resid  18 and name HD*   )  0.00  0.00  8.31
assign (resid  16 and name HG2*  )(resid  18 and name HE*   )  0.00  0.00  7.35
assign (resid  16 and name HG2*  )(resid  18 and name HZ    )  0.00  0.00  5.01
assign (resid  16 and name HG1*  )(resid  18 and name HD*   )  0.00  0.00  8.50
assign (resid  16 and name HG1*  )(resid  18 and name HE*   )  0.00  0.00  7.70
assign (resid  16 and name HG1*  )(resid  18 and name HZ    )  0.00  0.00  4.64
assign (resid  16 and name HD*   )(resid  18 and name HE*   )  0.00  0.00  8.65
assign (resid  16 and name HD*   )(resid  18 and name HZ    )  0.00  0.00  6.53
assign (resid  18 and name HA    )(resid  20 and name HN    )  0.00  0.00  3.83
assign (resid  18 and name HB2   )(resid  20 and name HN    )  0.00  0.00  4.02
assign (resid  18 and name HB1   )(resid  20 and name HN    )  0.00  0.00  3.58
assign (resid  20 and name HA    )(resid  22 and name HN    )  0.00  0.00  4.07
assign (resid  20 and name HB1   )(resid  22 and name HN    )  0.00  0.00  3.89
assign (resid  20 and name HD*   )(resid  22 and name HN    )  0.00  0.00  7.64
assign (resid  21 and name HN    )(resid  23 and name HN    )  0.00  0.00  4.72
assign (resid  21 and name HA    )(resid  23 and name HN    )  0.00  0.00  4.45
assign (resid  21 and name HG*   )(resid  23 and name HN    )  0.00  0.00  8.09
assign (resid  22 and name HA    )(resid  24 and name HN    )  0.00  0.00  4.42
assign (resid  23 and name HA    )(resid  25 and name HN    )  0.00  0.00  3.92
assign (resid  24 and name HN    )(resid  26 and name HN    )  0.00  0.00  4.35
assign (resid  25 and name HN    )(resid  27 and name HN    )  0.00  0.00  4.20
assign (resid  25 and name HA    )(resid  27 and name HN    )  0.00  0.00  4.42
assign (resid  25 and name HB1   )(resid  27 and name HN    )  0.00  0.00  5.66
assign (resid  26 and name HN    )(resid  28 and name HN    )  0.00  0.00  4.51
assign (resid  30 and name HN    )(resid  32 and name HN    )  0.00  0.00  4.66
! total in this range:     60
! range |i-j| =     3
assign (resid  11 and name HN    )(resid  14 and name HB2   )  0.00  0.00  5.97
assign (resid  11 and name HB2   )(resid  14 and name HN    )  0.00  0.00  3.92
assign (resid  11 and name HB2   )(resid  14 and name HB2   )  0.00  0.00  5.38
assign (resid  11 and name HB1   )(resid  14 and name HN    )  0.00  0.00  4.20
assign (resid  11 and name HB1   )(resid  14 and name HB2   )  0.00  0.00  4.05
assign (resid  20 and name HN    )(resid  23 and name HG2*  )  0.00  0.00  6.06
assign (resid  20 and name HA    )(resid  23 and name HN    )  0.00  0.00  4.42
assign (resid  20 and name HB2   )(resid  23 and name HN    )  0.00  0.00  3.33
assign (resid  20 and name HB1   )(resid  23 and name HN    )  0.00  0.00  3.67
assign (resid  20 and name HD*   )(resid  23 and name HG2*  )  0.00  0.00  7.99
assign (resid  21 and name HA    )(resid  24 and name HN    )  0.00  0.00  3.30
assign (resid  21 and name HA    )(resid  24 and name HB2   )  0.00  0.00  3.86
assign (resid  21 and name HA    )(resid  24 and name HB1   )  0.00  0.00  3.86
assign (resid  21 and name HA    )(resid  24 and name HB*   )  0.00  0.00  3.54
assign (resid  21 and name HA    )(resid  24 and name HD*   )  0.00  0.00  7.64
assign (resid  21 and name HG1*  )(resid  24 and name HN    )  0.00  0.00  6.53
assign (resid  21 and name HG1*  )(resid  24 and name HB2   )  0.00  0.00  8.78
assign (resid  21 and name HG1*  )(resid  24 and name HB1   )  0.00  0.00  8.78
assign (resid  21 and name HG1*  )(resid  24 and name HD*   )  0.00  0.00  8.67
assign (resid  21 and name HG1*  )(resid  24 and name HE*   )  0.00  0.00  8.66
assign (resid  21 and name HG2*  )(resid  24 and name HN    )  0.00  0.00  6.53
assign (resid  21 and name HG2*  )(resid  24 and name HB2   )  0.00  0.00  8.78
assign (resid  21 and name HG2*  )(resid  24 and name HB1   )  0.00  0.00  8.78
assign (resid  21 and name HG2*  )(resid  24 and name HD*   )  0.00  0.00  8.67
assign (resid  21 and name HG2*  )(resid  24 and name HE*   )  0.00  0.00  8.66
assign (resid  21 and name HG*   )(resid  24 and name HB*   )  0.00  0.00  7.75
assign (resid  21 and name HG*   )(resid  24 and name HD*   )  0.00  0.00  8.17
assign (resid  22 and name HA    )(resid  25 and name HD1*  )  0.00  0.00  6.43
assign (resid  22 and name HA    )(resid  25 and name HD2*  )  0.00  0.00  6.43
assign (resid  22 and name HA    )(resid  25 and name HD*   )  0.00  0.00  5.38
assign (resid  24 and name HA    )(resid  27 and name HN    )  0.00  0.00  3.39
assign (resid  24 and name HA    )(resid  27 and name HB1   )  0.00  0.00  3.64
assign (resid  24 and name HB*   )(resid  27 and name HN    )  0.00  0.00  5.89
assign (resid  24 and name HD*   )(resid  27 and name HN    )  0.00  0.00  7.64
assign (resid  25 and name HA    )(resid  28 and name HN    )  0.00  0.00  3.83
assign (resid  25 and name HA    )(resid  28 and name HB2   )  0.00  0.00  3.67
assign (resid  25 and name HA    )(resid  28 and name HB1   )  0.00  0.00  3.67
assign (resid  26 and name HA    )(resid  29 and name HN    )  0.00  0.00  3.48
assign (resid  26 and name HA    )(resid  29 and name HB2   )  0.00  0.00  3.89
assign (resid  26 and name HA    )(resid  29 and name HB1   )  0.00  0.00  4.11
assign (resid  26 and name HB*   )(resid  29 and name HN    )  0.00  0.00  7.03
assign (resid  27 and name HA    )(resid  30 and name HN    )  0.00  0.00  4.14
assign (resid  27 and name HA    )(resid  30 and name HB1   )  0.00  0.00  4.57
! total in this range:     44
! range |i-j| =     4
assign (resid  10 and name HE*   )(resid  14 and name HN    )  0.00  0.00  7.63
assign (resid  11 and name HB2   )(resid  15 and name HN    )  0.00  0.00  5.57
assign (resid  11 and name HB1   )(resid  15 and name HN    )  0.00  0.00  4.67
assign (resid  18 and name HB1   )(resid  22 and name HN    )  0.00  0.00  5.78
assign (resid  21 and name HN    )(resid  25 and name HD*   )  0.00  0.00  8.10
assign (resid  21 and name HG1*  )(resid  25 and name HB2   )  0.00  0.00  6.87
assign (resid  21 and name HG1*  )(resid  25 and name HG    )  0.00  0.00  6.53
assign (resid  21 and name HG2*  )(resid  25 and name HB2   )  0.00  0.00  6.87
assign (resid  21 and name HG2*  )(resid  25 and name HG    )  0.00  0.00  6.53
assign (resid  21 and name HG*   )(resid  25 and name HB2   )  0.00  0.00  6.20
assign (resid  21 and name HG*   )(resid  25 and name HG    )  0.00  0.00  5.42
assign (resid  22 and name HA    )(resid  26 and name HN    )  0.00  0.00  4.14
assign (resid  24 and name HA    )(resid  28 and name HN    )  0.00  0.00  5.00
assign (resid  24 and name HD*   )(resid  28 and name HG*   )  0.00  0.00  8.52
assign (resid  24 and name HE*   )(resid  28 and name HB2   )  0.00  0.00  8.13
assign (resid  24 and name HE*   )(resid  28 and name HB1   )  0.00  0.00  8.13
assign (resid  24 and name HE*   )(resid  28 and name HB*   )  0.00  0.00  7.64
assign (resid  24 and name HE*   )(resid  28 and name HG*   )  0.00  0.00  8.51
assign (resid  25 and name HA    )(resid  29 and name HN    )  0.00  0.00  4.14
assign (resid  26 and name HA    )(resid  30 and name HN    )  0.00  0.00  4.38
assign (resid  26 and name HA    )(resid  30 and name HD*   )  0.00  0.00  7.62
assign (resid  26 and name HA    )(resid  30 and name HE*   )  0.00  0.00  7.62
assign (resid  26 and name HB*   )(resid  30 and name HD*   )  0.00  0.00  9.15
assign (resid  26 and name HB*   )(resid  30 and name HE*   )  0.00  0.00  9.15
assign (resid  27 and name HA    )(resid  31 and name HD*   )  0.00  0.00  6.24
assign (resid  27 and name HA    )(resid  31 and name HE*   )  0.00  0.00  7.63
assign (resid  27 and name HD2   )(resid  31 and name HN    )  0.00  0.00  5.50
assign (resid  27 and name HD2   )(resid  31 and name HB1   )  0.00  0.00  6.00
assign (resid  27 and name HE1   )(resid  31 and name HN    )  0.00  0.00  5.50
assign (resid  27 and name HE1   )(resid  31 and name HB2   )  0.00  0.00  6.00
assign (resid  27 and name HE1   )(resid  31 and name HB1   )  0.00  0.00  6.00
assign (resid  28 and name HA    )(resid  32 and name HN    )  0.00  0.00  3.64
assign (resid  28 and name HA    )(resid  32 and name HB2   )  0.00  0.00  3.71
assign (resid  28 and name HA    )(resid  32 and name HB1   )  0.00  0.00  3.98
assign (resid  28 and name HA    )(resid  32 and name HD2   )  0.00  0.00  3.05
assign (resid  28 and name HB2   )(resid  32 and name HB2   )  0.00  0.00  6.00
assign (resid  28 and name HB2   )(resid  32 and name HD2   )  0.00  0.00  6.00
assign (resid  28 and name HB1   )(resid  32 and name HB2   )  0.00  0.00  6.00
assign (resid  28 and name HB1   )(resid  32 and name HD2   )  0.00  0.00  6.00
assign (resid  28 and name HB*   )(resid  32 and name HB1   )  0.00  0.00  6.88
assign (resid  28 and name HB*   )(resid  32 and name HD2   )  0.00  0.00  5.72
assign (resid  28 and name HG*   )(resid  32 and name HB2   )  0.00  0.00  6.78
assign (resid  28 and name HG*   )(resid  32 and name HB1   )  0.00  0.00  6.88
assign (resid  28 and name HG*   )(resid  32 and name HD2   )  0.00  0.00  6.10
assign (resid  29 and name HA    )(resid  33 and name HN    )  0.00  0.00  5.38
! total in this range:     45
! range |i-j| =     5
assign (resid  10 and name HD*   )(resid  15 and name HB2   )  0.00  0.00  8.14
assign (resid  10 and name HE*   )(resid  15 and name HN    )  0.00  0.00  7.63
assign (resid  10 and name HE*   )(resid  15 and name HB2   )  0.00  0.00  8.13
assign (resid  10 and name HE*   )(resid  15 and name HB1   )  0.00  0.00  8.13
assign (resid  11 and name HN    )(resid  16 and name HN    )  0.00  0.00  3.39
assign (resid  11 and name HN    )(resid  16 and name HG2*  )  0.00  0.00  6.53
assign (resid  11 and name HB2   )(resid  16 and name HN    )  0.00  0.00  5.26
assign (resid  11 and name HB2   )(resid  16 and name HB    )  0.00  0.00  5.66
assign (resid  11 and name HB2   )(resid  16 and name HG2*  )  0.00  0.00  7.03
assign (resid  11 and name HB2   )(resid  16 and name HG1*  )  0.00  0.00  6.88
assign (resid  11 and name HB1   )(resid  16 and name HN    )  0.00  0.00  4.42
assign (resid  11 and name HB1   )(resid  16 and name HB    )  0.00  0.00  4.54
assign (resid  11 and name HB1   )(resid  16 and name HG2*  )  0.00  0.00  6.90
assign (resid  11 and name HB1   )(resid  16 and name HG12  )  0.00  0.00  6.00
assign (resid  11 and name HB1   )(resid  16 and name HG11  )  0.00  0.00  6.00
assign (resid  11 and name HB1   )(resid  16 and name HG1*  )  0.00  0.00  5.49
assign (resid  11 and name HB1   )(resid  16 and name HD*   )  0.00  0.00  7.03
assign (resid  18 and name HB2   )(resid  23 and name HB    )  0.00  0.00  4.85
assign (resid  18 and name HB1   )(resid  23 and name HB    )  0.00  0.00  4.26
assign (resid  18 and name HB1   )(resid  23 and name HG2*  )  0.00  0.00  5.85
assign (resid  18 and name HD*   )(resid  23 and name HA    )  0.00  0.00  7.62
assign (resid  18 and name HD*   )(resid  23 and name HB    )  0.00  0.00  6.20
assign (resid  18 and name HD*   )(resid  23 and name HG2*  )  0.00  0.00  6.79
assign (resid  18 and name HE*   )(resid  23 and name HB    )  0.00  0.00  7.62
assign (resid  18 and name HE*   )(resid  23 and name HG2*  )  0.00  0.00  7.44
assign (resid  18 and name HZ    )(resid  23 and name HG2*  )  0.00  0.00  6.53
assign (resid  27 and name HE1   )(resid  32 and name HD2   )  0.00  0.00  4.14
! total in this range:     28
! range |i-j| =     6
assign (resid  10 and name HA    )(resid  16 and name HN    )  0.00  0.00  4.82
assign (resid  10 and name HD*   )(resid  16 and name HA    )  0.00  0.00  7.64
assign (resid  10 and name HE*   )(resid  16 and name HA    )  0.00  0.00  7.63
assign (resid  10 and name HE*   )(resid  16 and name HG2*  )  0.00  0.00  8.66
assign (resid  11 and name HN    )(resid  17 and name HA    )  0.00  0.00  3.36
assign (resid  18 and name HN    )(resid  24 and name HD*   )  0.00  0.00  7.64
assign (resid  18 and name HB2   )(resid  24 and name HN    )  0.00  0.00  5.84
assign (resid  18 and name HB2   )(resid  24 and name HB*   )  0.00  0.00  5.55
assign (resid  18 and name HB2   )(resid  24 and name HD*   )  0.00  0.00  8.14
assign (resid  18 and name HB1   )(resid  24 and name HN    )  0.00  0.00  5.41
assign (resid  18 and name HB1   )(resid  24 and name HB2   )  0.00  0.00  4.88
assign (resid  18 and name HB1   )(resid  24 and name HB1   )  0.00  0.00  4.88
assign (resid  18 and name HB1   )(resid  24 and name HB*   )  0.00  0.00  4.44
assign (resid  18 and name HB1   )(resid  24 and name HD*   )  0.00  0.00  8.05
assign (resid  18 and name HD*   )(resid  24 and name HN    )  0.00  0.00  7.31
assign (resid  18 and name HD*   )(resid  24 and name HA    )  0.00  0.00  6.07
assign (resid  18 and name HD*   )(resid  24 and name HB2   )  0.00  0.00  7.56
assign (resid  18 and name HD*   )(resid  24 and name HB1   )  0.00  0.00  7.56
assign (resid  18 and name HD*   )(resid  24 and name HB*   )  0.00  0.00  7.31
assign (resid  18 and name HD*   )(resid  24 and name HD*   )  0.00  0.00  9.11
assign (resid  18 and name HD*   )(resid  24 and name HE*   )  0.00  0.00  9.48
assign (resid  18 and name HE*   )(resid  24 and name HB2   )  0.00  0.00  8.12
assign (resid  18 and name HE*   )(resid  24 and name HB1   )  0.00  0.00  8.12
! total in this range:     23
! range |i-j| =     7
assign (resid  10 and name HA    )(resid  17 and name HN    )  0.00  0.00  5.38
assign (resid  10 and name HA    )(resid  17 and name HA    )  0.00  0.00  3.95
assign (resid  10 and name HB2   )(resid  17 and name HA    )  0.00  0.00  4.92
assign (resid  10 and name HB1   )(resid  17 and name HA    )  0.00  0.00  5.69
assign (resid  10 and name HD*   )(resid  17 and name HN    )  0.00  0.00  7.64
assign (resid  10 and name HD*   )(resid  17 and name HA    )  0.00  0.00  5.72
assign (resid  10 and name HD*   )(resid  17 and name HB2   )  0.00  0.00  7.92
assign (resid  10 and name HD*   )(resid  17 and name HB1   )  0.00  0.00  7.92
assign (resid  10 and name HE*   )(resid  17 and name HN    )  0.00  0.00  7.63
assign (resid  10 and name HE*   )(resid  17 and name HA    )  0.00  0.00  7.63
assign (resid  10 and name HE*   )(resid  17 and name HB2   )  0.00  0.00  8.13
assign (resid  10 and name HE*   )(resid  17 and name HB1   )  0.00  0.00  8.13
assign (resid  11 and name HN    )(resid  18 and name HD*   )  0.00  0.00  7.09
assign (resid  11 and name HN    )(resid  18 and name HE*   )  0.00  0.00  6.66
assign (resid  11 and name HB2   )(resid  18 and name HE*   )  0.00  0.00  5.98
assign (resid  11 and name HB2   )(resid  18 and name HZ    )  0.00  0.00  4.98
assign (resid  11 and name HB1   )(resid  18 and name HD*   )  0.00  0.00  8.12
assign (resid  11 and name HB1   )(resid  18 and name HE*   )  0.00  0.00  6.23
assign (resid  11 and name HB1   )(resid  18 and name HZ    )  0.00  0.00  5.91
! total in this range:     19
! range |i-j| =     8
assign (resid  10 and name HA    )(resid  18 and name HN    )  0.00  0.00  3.45
assign (resid  10 and name HA    )(resid  18 and name HD*   )  0.00  0.00  6.75
assign (resid  10 and name HA    )(resid  18 and name HE*   )  0.00  0.00  7.62
! total in this range:      3
! range |i-j| =     9
assign (resid   9 and name HB2   )(resid  18 and name HN    )  0.00  0.00  4.95
assign (resid   9 and name HB2   )(resid  18 and name HB2   )  0.00  0.00  4.76
assign (resid   9 and name HB2   )(resid  18 and name HB1   )  0.00  0.00  5.32
assign (resid   9 and name HB1   )(resid  18 and name HN    )  0.00  0.00  4.95
assign (resid   9 and name HB1   )(resid  18 and name HB2   )  0.00  0.00  4.76
assign (resid   9 and name HB1   )(resid  18 and name HB1   )  0.00  0.00  5.32
assign (resid   9 and name HB*   )(resid  18 and name HB2   )  0.00  0.00  4.49
assign (resid   9 and name HB*   )(resid  18 and name HB1   )  0.00  0.00  4.96
assign (resid   9 and name HB*   )(resid  18 and name HD*   )  0.00  0.00  9.00
assign (resid   9 and name HG*   )(resid  18 and name HD*   )  0.00  0.00  8.50
assign (resid  18 and name HE*   )(resid  27 and name HN    )  0.00  0.00  7.62
assign (resid  18 and name HE*   )(resid  27 and name HA    )  0.00  0.00  7.62
assign (resid  18 and name HE*   )(resid  27 and name HE1   )  0.00  0.00  7.62
assign (resid  18 and name HZ    )(resid  27 and name HB2   )  0.00  0.00  5.91
assign (resid  18 and name HZ    )(resid  27 and name HB1   )  0.00  0.00  5.29
assign (resid  18 and name HZ    )(resid  27 and name HD2   )  0.00  0.00  4.79
assign (resid  18 and name HZ    )(resid  27 and name HE1   )  0.00  0.00  4.72
! total in this range:     17
! range |i-j| =    10
assign (resid   9 and name HB*   )(resid  19 and name HN    )  0.00  0.00  6.88
! total in this range:      1
! range |i-j| =    11
assign (resid   8 and name HG*   )(resid  19 and name HA    )  0.00  0.00  6.38
assign (resid   8 and name HD*   )(resid  19 and name HA    )  0.00  0.00  6.38
assign (resid   9 and name HB*   )(resid  20 and name HA    )  0.00  0.00  6.69
assign (resid  16 and name HB    )(resid  27 and name HD2   )  0.00  0.00  5.50
assign (resid  16 and name HG2*  )(resid  27 and name HD2   )  0.00  0.00  6.53
assign (resid  16 and name HG2*  )(resid  27 and name HE1   )  0.00  0.00  6.53
assign (resid  16 and name HG1*  )(resid  27 and name HD2   )  0.00  0.00  6.38
assign (resid  16 and name HG1*  )(resid  27 and name HE1   )  0.00  0.00  4.18
assign (resid  16 and name HD*   )(resid  27 and name HE1   )  0.00  0.00  6.53
! total in this range:      9
! range |i-j| =    12
assign (resid   8 and name HG*   )(resid  20 and name HN    )  0.00  0.00  6.38
assign (resid   9 and name HB*   )(resid  21 and name HN    )  0.00  0.00  6.45
assign (resid   9 and name HE*   )(resid  21 and name HG1*  )  0.00  0.00  7.40
assign (resid   9 and name HE*   )(resid  21 and name HG2*  )  0.00  0.00  7.40
assign (resid   9 and name HE*   )(resid  21 and name HG*   )  0.00  0.00  6.91
assign (resid  12 and name HN    )(resid  24 and name HE*   )  0.00  0.00  7.63
! total in this range:      6
! range |i-j| =    13
assign (resid   8 and name HN    )(resid  21 and name HG1*  )  0.00  0.00  6.53
assign (resid   8 and name HN    )(resid  21 and name HG2*  )  0.00  0.00  6.53
assign (resid  11 and name HB2   )(resid  24 and name HE*   )  0.00  0.00  6.15
assign (resid  11 and name HB1   )(resid  24 and name HD*   )  0.00  0.00  8.14
assign (resid  11 and name HB1   )(resid  24 and name HE*   )  0.00  0.00  7.82
assign (resid  14 and name HB2   )(resid  27 and name HE1   )  0.00  0.00  6.00
assign (resid  14 and name HB1   )(resid  27 and name HE1   )  0.00  0.00  6.00
assign (resid  18 and name HZ    )(resid  31 and name HD*   )  0.00  0.00  7.64
! total in this range:      9
! range |i-j| =    14
assign (resid  10 and name HA    )(resid  24 and name HE*   )  0.00  0.00  7.63
! total in this range:      1
! range |i-j| =    15
assign (resid   9 and name HN    )(resid  24 and name HD*   )  0.00  0.00  7.64
assign (resid   9 and name HA    )(resid  24 and name HA    )  0.00  0.00  4.07
assign (resid   9 and name HA    )(resid  24 and name HB2   )  0.00  0.00  5.10
assign (resid   9 and name HA    )(resid  24 and name HB1   )  0.00  0.00  5.10
assign (resid   9 and name HA    )(resid  24 and name HB*   )  0.00  0.00  4.72
assign (resid   9 and name HA    )(resid  24 and name HD*   )  0.00  0.00  7.17
assign (resid   9 and name HA    )(resid  24 and name HE*   )  0.00  0.00  7.63
assign (resid   9 and name HB2   )(resid  24 and name HB2   )  0.00  0.00  6.00
assign (resid   9 and name HB2   )(resid  24 and name HB1   )  0.00  0.00  6.00
assign (resid   9 and name HB2   )(resid  24 and name HD*   )  0.00  0.00  8.14
assign (resid   9 and name HB2   )(resid  24 and name HE*   )  0.00  0.00  8.13
assign (resid   9 and name HB1   )(resid  24 and name HB2   )  0.00  0.00  6.00
assign (resid   9 and name HB1   )(resid  24 and name HB1   )  0.00  0.00  6.00
assign (resid   9 and name HB1   )(resid  24 and name HD*   )  0.00  0.00  8.14
assign (resid   9 and name HB1   )(resid  24 and name HE*   )  0.00  0.00  8.13
assign (resid   9 and name HB*   )(resid  24 and name HB*   )  0.00  0.00  5.38
assign (resid   9 and name HB*   )(resid  24 and name HD*   )  0.00  0.00  7.71
assign (resid   9 and name HB*   )(resid  24 and name HE*   )  0.00  0.00  7.69
! total in this range:     18
! range |i-j| =    16
assign (resid   8 and name HN    )(resid  24 and name HD*   )  0.00  0.00  7.64
assign (resid   8 and name HA    )(resid  24 and name HE*   )  0.00  0.00  7.63
assign (resid  11 and name HB1   )(resid  27 and name HD2   )  0.00  0.00  4.64
! total in this range:      4
! range |i-j| =    18
assign (resid  14 and name HB1   )(resid  32 and name HE1   )  0.00  0.00  6.00
! total in this range:      2
! range |i-j| =    19
assign (resid  13 and name HA    )(resid  32 and name HE1   )  0.00  0.00  5.50
assign (resid  13 and name HB    )(resid  32 and name HE1   )  0.00  0.00  3.76
assign (resid  13 and name HG2*  )(resid  32 and name HE1   )  0.00  0.00  3.92
! total in this range:      3
! range |i-j| =    21
! total in this range:      1
! total constraints:      552
set echo=true end
set wrnlev=5 end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1HT       GLY   1 -13.782  -5.458  -9.330
    2   2H    GLY   1          2HT       GLY   1 -14.463  -6.718  -8.431
    3   3H    GLY   1          3HT       GLY   1 -13.436  -7.065  -9.729
    4   1HA   GLY   1          1HA       GLY   1 -12.767  -6.040  -7.053
    5   2HA   GLY   1          2HA       GLY   1 -12.056  -7.390  -7.924
    6    H    SER   2           H        SER   2 -11.899  -5.765 -10.415
    7    HA   SER   2           HA       SER   2 -10.256  -3.507  -9.938
    8   1HB   SER   2          2HB       SER   2  -8.675  -5.262  -9.192
    9   2HB   SER   2          1HB       SER   2  -8.798  -6.025 -10.777
   10    HG   SER   2           HG       SER   2  -7.002  -4.717 -10.793
   11    H    ALA   3           H        ALA   3  -8.696  -3.431 -12.169
   12    HA   ALA   3           HA       ALA   3  -8.745  -2.970 -14.395
   13   1HB   ALA   3          1HB       ALA   3  -8.946  -5.322 -14.739
   14   2HB   ALA   3          2HB       ALA   3 -10.065  -4.524 -15.843
   15   3HB   ALA   3          3HB       ALA   3 -10.670  -5.287 -14.373
   16    H    ALA   4           H        ALA   4 -10.100  -1.158 -13.013
   17    HA   ALA   4           HA       ALA   4 -11.921  -0.087 -14.873
   18   1HB   ALA   4          1HB       ALA   4 -13.118  -1.472 -12.496
   19   2HB   ALA   4          2HB       ALA   4 -13.572  -1.594 -14.195
   20   3HB   ALA   4          3HB       ALA   4 -13.936  -0.126 -13.288
   21    H    GLU   5           H        GLU   5 -11.933  -0.062 -11.310
   22    HA   GLU   5           HA       GLU   5 -10.357   2.075 -10.743
   23   1HB   GLU   5          2HB       GLU   5 -12.156   3.924 -10.520
   24   2HB   GLU   5          1HB       GLU   5 -11.450   3.628 -12.102
   25   1HG   GLU   5          2HG       GLU   5 -13.390   2.937 -12.982
   26   2HG   GLU   5          1HG       GLU   5 -13.861   2.064 -11.525
   27    H    VAL   6           H        VAL   6 -10.630   0.143  -9.190
   28    HA   VAL   6           HA       VAL   6 -12.529   0.927  -7.075
   29    HB   VAL   6           HB       VAL   6 -11.557  -1.884  -7.589
   30   1HG1  VAL   6          1HG1      VAL   6 -13.631  -2.333  -6.117
   31   2HG1  VAL   6          2HG1      VAL   6 -13.470  -0.641  -5.649
   32   3HG1  VAL   6          3HG1      VAL   6 -12.149  -1.770  -5.345
   33   1HG2  VAL   6          1HG2      VAL   6 -12.923  -1.620  -9.408
   34   2HG2  VAL   6          2HG2      VAL   6 -13.923  -0.400  -8.618
   35   3HG2  VAL   6          3HG2      VAL   6 -14.111  -2.102  -8.197
   36    H    MET   7           H        MET   7 -11.838   0.406  -4.880
   37    HA   MET   7           HA       MET   7 -10.357   0.455  -3.155
   38   1HB   MET   7          2HB       MET   7  -9.465  -1.558  -4.739
   39   2HB   MET   7          1HB       MET   7  -8.054  -0.508  -4.735
   40   1HG   MET   7          2HG       MET   7  -7.517  -1.643  -2.887
   41   2HG   MET   7          1HG       MET   7  -8.646  -0.538  -2.105
   42   1HE   MET   7          1HE       MET   7  -9.677  -4.665  -3.699
   43   2HE   MET   7          2HE       MET   7  -8.182  -4.613  -2.767
   44   3HE   MET   7          3HE       MET   7  -8.367  -3.593  -4.193
   45    H    LYS   8           H        LYS   8  -8.114   1.339  -2.521
   46    HA   LYS   8           HA       LYS   8  -7.153   3.432  -4.299
   47   1HB   LYS   8          2HB       LYS   8  -8.903   4.596  -3.127
   48   2HB   LYS   8          1HB       LYS   8  -8.350   3.975  -1.578
   49   1HG   LYS   8          2HG       LYS   8  -6.223   5.248  -1.927
   50   2HG   LYS   8          1HG       LYS   8  -6.976   5.989  -3.340
   51   1HD   LYS   8          2HD       LYS   8  -7.173   7.425  -1.370
   52   2HD   LYS   8          1HD       LYS   8  -8.757   6.884  -1.926
   53   1HE   LYS   8          2HE       LYS   8  -7.468   5.157   0.076
   54   2HE   LYS   8          1HE       LYS   8  -7.912   6.766   0.646
   55   1HZ   LYS   8          1HZ       LYS   8  -9.919   5.312  -0.890
   56   2HZ   LYS   8          2HZ       LYS   8 -10.108   6.329   0.448
   57   3HZ   LYS   8          3HZ       LYS   8  -9.590   4.734   0.666
   58    H    LYS   9           H        LYS   9  -6.832   2.955  -0.796
   59    HA   LYS   9           HA       LYS   9  -4.050   2.104  -1.188
   60   1HB   LYS   9          2HB       LYS   9  -4.938   4.269   0.731
   61   2HB   LYS   9          1HB       LYS   9  -3.311   3.621   0.603
   62   1HG   LYS   9          2HG       LYS   9  -2.809   4.917  -1.134
   63   2HG   LYS   9          1HG       LYS   9  -4.346   4.594  -1.937
   64   1HD   LYS   9          2HD       LYS   9  -4.414   6.887  -1.490
   65   2HD   LYS   9          1HD       LYS   9  -5.364   6.173  -0.186
   66   1HE   LYS   9          2HE       LYS   9  -3.059   6.144   1.060
   67   2HE   LYS   9          1HE       LYS   9  -2.643   7.396  -0.108
   68   1HZ   LYS   9          1HZ       LYS   9  -3.505   8.647   1.574
   69   2HZ   LYS   9          2HZ       LYS   9  -4.607   7.462   2.067
   70   3HZ   LYS   9          3HZ       LYS   9  -4.916   8.380   0.680
   71    H    TYR  10           H        TYR  10  -5.921   0.287  -0.668
   72    HA   TYR  10           HA       TYR  10  -5.201  -0.640   1.975
   73   1HB   TYR  10          2HB       TYR  10  -7.158   0.647   2.555
   74   2HB   TYR  10          1HB       TYR  10  -8.077  -0.066   1.235
   75    HD1  TYR  10           1HD      TYR  10  -7.169  -0.334   4.681
   76    HD2  TYR  10           2HD      TYR  10  -8.558  -2.576   1.345
   77    HE1  TYR  10           1HE      TYR  10  -7.976  -2.085   6.205
   78    HE2  TYR  10           2HE      TYR  10  -9.371  -4.335   2.859
   79    HH   TYR  10           HH       TYR  10 -10.059  -4.569   5.209
   80    H    CYS  11           H        CYS  11  -5.019  -2.815   2.017
   81    HA   CYS  11           HA       CYS  11  -5.816  -4.246  -0.412
   82   1HB   CYS  11          2HB       CYS  11  -3.426  -4.318   0.583
   83   2HB   CYS  11          1HB       CYS  11  -4.110  -5.422   1.765
   84    H    SER  12           H        SER  12  -7.512  -5.531  -0.432
   85    HA   SER  12           HA       SER  12  -8.960  -6.088   1.997
   86   1HB   SER  12          2HB       SER  12 -10.033  -5.540  -0.238
   87   2HB   SER  12          1HB       SER  12  -9.562  -7.156  -0.765
   88    HG   SER  12           HG       SER  12 -11.735  -6.542   0.485
   89    H    THR  13           H        THR  13  -6.666  -7.699  -0.009
   90    HA   THR  13           HA       THR  13  -7.313 -10.355   0.882
   91    HB   THR  13           HB       THR  13  -4.721  -9.546  -0.407
   92    HG1  THR  13           1HG      THR  13  -6.030  -8.690  -1.859
   93   1HG2  THR  13          1HG2      THR  13  -6.118 -11.908  -1.370
   94   2HG2  THR  13          2HG2      THR  13  -5.663 -12.002   0.332
   95   3HG2  THR  13          3HG2      THR  13  -4.432 -11.695  -0.895
   96    H    CYS  14           H        CYS  14  -4.843  -7.918   1.628
   97    HA   CYS  14           HA       CYS  14  -3.806  -9.656   3.750
   98   1HB   CYS  14          2HB       CYS  14  -2.692  -7.027   2.766
   99   2HB   CYS  14          1HB       CYS  14  -1.900  -8.176   3.839
  100    H    ASP  15           H        ASP  15  -6.158  -7.387   3.448
  101    HA   ASP  15           HA       ASP  15  -7.242  -5.966   4.847
  102   1HB   ASP  15          2HB       ASP  15  -6.032  -7.832   6.896
  103   2HB   ASP  15          1HB       ASP  15  -7.333  -6.691   7.216
  104    H    ILE  16           H        ILE  16  -4.772  -5.014   3.994
  105    HA   ILE  16           HA       ILE  16  -3.730  -3.628   6.376
  106    HB   ILE  16           HB       ILE  16  -2.312  -3.765   3.727
  107   1HG1  ILE  16          2HG1      ILE  16  -2.752  -6.074   4.517
  108   2HG1  ILE  16          1HG1      ILE  16  -1.040  -5.671   4.542
  109   1HG2  ILE  16          1HG2      ILE  16  -1.574  -3.023   6.530
  110   2HG2  ILE  16          2HG2      ILE  16  -1.341  -2.115   5.038
  111   3HG2  ILE  16          3HG2      ILE  16  -0.340  -3.527   5.377
  112   1HD1  ILE  16          1HD1      ILE  16  -2.825  -5.545   6.957
  113   2HD1  ILE  16          2HD1      ILE  16  -1.067  -5.407   6.908
  114   3HD1  ILE  16          3HD1      ILE  16  -1.843  -6.943   6.521
  115    H    SER  17           H        SER  17  -3.015  -1.370   6.001
  116    HA   SER  17           HA       SER  17  -4.638  -0.029   3.946
  117   1HB   SER  17          2HB       SER  17  -4.500   1.817   5.997
  118   2HB   SER  17          1HB       SER  17  -5.888   0.791   5.637
  119    HG   SER  17           HG       SER  17  -3.812   0.309   7.506
  120    H    PHE  18           H        PHE  18  -3.858   2.055   3.276
  121    HA   PHE  18           HA       PHE  18  -1.074   2.649   3.937
  122   1HB   PHE  18          2HB       PHE  18  -2.196   2.241   1.163
  123   2HB   PHE  18          1HB       PHE  18  -0.657   3.027   1.478
  124    HD1  PHE  18           1HD      PHE  18   1.019   1.638   2.947
  125    HD2  PHE  18           2HD      PHE  18  -2.249  -0.017   0.781
  126    HE1  PHE  18           1HE      PHE  18   2.117  -0.564   2.978
  127    HE2  PHE  18           2HE      PHE  18  -1.157  -2.221   0.809
  128    HZ   PHE  18           HZ       PHE  18   1.028  -2.498   1.909
  129    H    ASN  19           H        ASN  19  -0.706   4.775   4.179
  130    HA   ASN  19           HA       ASN  19  -2.930   6.599   3.724
  131   1HB   ASN  19          2HB       ASN  19  -0.479   6.618   5.408
  132   2HB   ASN  19          1HB       ASN  19  -1.099   8.178   4.877
  133   1HD2  ASN  19          1HD2      ASN  19  -0.971   7.018   7.549
  134   2HD2  ASN  19          2HD2      ASN  19  -2.593   7.010   8.144
  135    H    TYR  20           H        TYR  20  -0.853   5.496   1.658
  136    HA   TYR  20           HA       TYR  20  -0.731   7.953   0.151
  137   1HB   TYR  20          2HB       TYR  20   1.740   6.567   1.163
  138   2HB   TYR  20          1HB       TYR  20   1.770   7.524  -0.313
  139    HD1  TYR  20           1HD      TYR  20   1.269   9.966  -0.206
  140    HD2  TYR  20           2HD      TYR  20   1.730   7.604   3.302
  141    HE1  TYR  20           1HE      TYR  20   1.596  12.010   1.121
  142    HE2  TYR  20           2HE      TYR  20   2.057   9.641   4.638
  143    HH   TYR  20           HH       TYR  20   1.442  12.078   4.463
  144    H    VAL  21           H        VAL  21  -1.265   7.479  -1.871
  145    HA   VAL  21           HA       VAL  21  -1.829   4.975  -2.849
  146    HB   VAL  21           HB       VAL  21  -0.866   7.278  -4.549
  147   1HG1  VAL  21          1HG1      VAL  21  -2.207   6.304  -6.294
  148   2HG1  VAL  21          2HG1      VAL  21  -2.794   5.053  -5.199
  149   3HG1  VAL  21          3HG1      VAL  21  -1.097   5.080  -5.678
  150   1HG2  VAL  21          1HG2      VAL  21  -3.532   6.739  -3.273
  151   2HG2  VAL  21          2HG2      VAL  21  -3.367   7.753  -4.707
  152   3HG2  VAL  21          3HG2      VAL  21  -2.556   8.206  -3.207
  153    H    LYS  22           H        LYS  22   1.251   6.594  -2.698
  154    HA   LYS  22           HA       LYS  22   2.646   4.987  -4.557
  155   1HB   LYS  22          2HB       LYS  22   4.665   5.882  -3.574
  156   2HB   LYS  22          1HB       LYS  22   3.473   7.168  -3.707
  157   1HG   LYS  22          2HG       LYS  22   2.988   6.238  -1.197
  158   2HG   LYS  22          1HG       LYS  22   4.731   6.000  -1.338
  159   1HD   LYS  22          2HD       LYS  22   4.689   8.438  -2.281
  160   2HD   LYS  22          1HD       LYS  22   3.144   8.529  -1.433
  161   1HE   LYS  22          2HE       LYS  22   4.991   9.339  -0.042
  162   2HE   LYS  22          1HE       LYS  22   4.229   7.907   0.652
  163   1HZ   LYS  22          1HZ       LYS  22   6.061   6.648   0.301
  164   2HZ   LYS  22          2HZ       LYS  22   6.836   8.145   0.430
  165   3HZ   LYS  22          3HZ       LYS  22   6.528   7.481  -1.095
  166    H    THR  23           H        THR  23   1.867   4.605  -1.164
  167    HA   THR  23           HA       THR  23   3.615   2.386  -0.744
  168    HB   THR  23           HB       THR  23   1.218   2.662   0.973
  169    HG1  THR  23           1HG      THR  23   1.932   4.567   1.888
  170   1HG2  THR  23          1HG2      THR  23   4.168   2.472   1.515
  171   2HG2  THR  23          2HG2      THR  23   2.948   1.218   1.739
  172   3HG2  THR  23          3HG2      THR  23   2.936   2.652   2.765
  173    H    TYR  24           H        TYR  24   0.216   2.772  -1.577
  174    HA   TYR  24           HA       TYR  24  -0.495   0.048  -1.397
  175   1HB   TYR  24          2HB       TYR  24  -2.121   1.937  -1.537
  176   2HB   TYR  24          1HB       TYR  24  -1.677   2.149  -3.225
  177    HD1  TYR  24           1HD      TYR  24  -3.243   1.336  -4.699
  178    HD2  TYR  24           2HD      TYR  24  -2.617  -0.744  -1.042
  179    HE1  TYR  24           1HE      TYR  24  -4.939  -0.318  -5.357
  180    HE2  TYR  24           2HE      TYR  24  -4.310  -2.405  -1.689
  181    HH   TYR  24           HH       TYR  24  -5.579  -2.597  -4.860
  182    H    LEU  25           H        LEU  25   1.092   1.958  -3.826
  183    HA   LEU  25           HA       LEU  25   0.867   0.004  -5.920
  184   1HB   LEU  25          2HB       LEU  25   2.477   2.516  -5.553
  185   2HB   LEU  25          1HB       LEU  25   2.763   1.451  -6.915
  186    HG   LEU  25           HG       LEU  25  -0.026   2.377  -6.436
  187   1HD1  LEU  25          1HD1      LEU  25   1.802   4.297  -6.320
  188   2HD1  LEU  25          2HD1      LEU  25   0.263   4.513  -7.154
  189   3HD1  LEU  25          3HD1      LEU  25   1.718   4.127  -8.073
  190   1HD2  LEU  25          1HD2      LEU  25  -0.049   1.059  -8.277
  191   2HD2  LEU  25          2HD2      LEU  25   1.644   1.371  -8.658
  192   3HD2  LEU  25          3HD2      LEU  25   0.413   2.566  -9.068
  193    H    ALA  26           H        ALA  26   3.323   0.994  -3.593
  194    HA   ALA  26           HA       ALA  26   5.358  -0.732  -4.472
  195   1HB   ALA  26          1HB       ALA  26   5.090   0.097  -1.611
  196   2HB   ALA  26          2HB       ALA  26   5.467   1.287  -2.857
  197   3HB   ALA  26          3HB       ALA  26   6.546  -0.083  -2.590
  198    H    HIS  27           H        HIS  27   2.589  -1.199  -2.378
  199    HA   HIS  27           HA       HIS  27   3.497  -3.653  -1.238
  200   1HB   HIS  27          2HB       HIS  27   1.823  -2.402  -0.052
  201   2HB   HIS  27          1HB       HIS  27   0.744  -2.421  -1.444
  202    HD1  HIS  27           1HD      HIS  27   2.213  -4.829   1.111
  203    HD2  HIS  27           2HD      HIS  27  -0.958  -4.521  -1.554
  204    HE1  HIS  27           1HE      HIS  27   0.751  -6.854   1.507
  205    H    LYS  28           H        LYS  28   1.458  -2.812  -4.001
  206    HA   LYS  28           HA       LYS  28   0.768  -5.511  -4.622
  207   1HB   LYS  28          2HB       LYS  28  -0.282  -3.162  -5.354
  208   2HB   LYS  28          1HB       LYS  28   0.749  -3.436  -6.752
  209   1HG   LYS  28          2HG       LYS  28  -0.388  -5.399  -7.345
  210   2HG   LYS  28          1HG       LYS  28  -1.173  -5.517  -5.769
  211   1HD   LYS  28          2HD       LYS  28  -2.652  -3.772  -6.244
  212   2HD   LYS  28          1HD       LYS  28  -1.656  -3.169  -7.571
  213   1HE   LYS  28          2HE       LYS  28  -2.672  -5.928  -7.844
  214   2HE   LYS  28          1HE       LYS  28  -3.877  -4.644  -7.925
  215   1HZ   LYS  28          1HZ       LYS  28  -2.677  -3.625  -9.716
  216   2HZ   LYS  28          2HZ       LYS  28  -2.950  -5.248 -10.107
  217   3HZ   LYS  28          3HZ       LYS  28  -1.420  -4.751  -9.589
  218    H    GLN  29           H        GLN  29   3.335  -3.324  -5.581
  219    HA   GLN  29           HA       GLN  29   4.326  -5.127  -7.617
  220   1HB   GLN  29          2HB       GLN  29   4.453  -2.454  -7.394
  221   2HB   GLN  29          1HB       GLN  29   5.999  -2.871  -6.665
  222   1HG   GLN  29          2HG       GLN  29   6.679  -2.696  -8.810
  223   2HG   GLN  29          1HG       GLN  29   6.172  -4.384  -8.841
  224   1HE2  GLN  29          1HE2      GLN  29   5.925  -1.459 -10.363
  225   2HE2  GLN  29          2HE2      GLN  29   4.500  -1.746 -11.296
  226    H    PHE  30           H        PHE  30   4.846  -4.569  -4.250
  227    HA   PHE  30           HA       PHE  30   7.351  -6.100  -4.326
  228   1HB   PHE  30          2HB       PHE  30   7.150  -3.835  -3.115
  229   2HB   PHE  30          1HB       PHE  30   6.244  -4.720  -1.893
  230    HD1  PHE  30           1HD      PHE  30   9.405  -3.586  -2.802
  231    HD2  PHE  30           2HD      PHE  30   7.446  -6.950  -1.082
  232    HE1  PHE  30           1HE      PHE  30  11.517  -4.268  -1.739
  233    HE2  PHE  30           2HE      PHE  30   9.553  -7.638  -0.016
  234    HZ   PHE  30           HZ       PHE  30  11.592  -6.297  -0.343
  235    H    TYR  31           H        TYR  31   4.296  -5.937  -2.491
  236    HA   TYR  31           HA       TYR  31   4.748  -8.457  -1.216
  237   1HB   TYR  31          2HB       TYR  31   3.275  -6.441  -0.447
  238   2HB   TYR  31          1HB       TYR  31   2.036  -7.196  -1.444
  239    HD1  TYR  31           1HD      TYR  31   3.940  -7.398   1.648
  240    HD2  TYR  31           2HD      TYR  31   1.157  -9.422  -0.852
  241    HE1  TYR  31           1HE      TYR  31   3.379  -8.908   3.506
  242    HE2  TYR  31           2HE      TYR  31   0.586 -10.937   0.999
  243    HH   TYR  31           HH       TYR  31   0.684 -10.852   3.545
  244    H    HIS  32           H        HIS  32   2.471  -7.372  -3.735
  245    HA   HIS  32           HA       HIS  32   1.915 -10.169  -4.389
  246   1HB   HIS  32          2HB       HIS  32   0.587  -7.632  -5.366
  247   2HB   HIS  32          1HB       HIS  32   0.074  -9.270  -5.757
  248    HD1  HIS  32           1HD      HIS  32  -1.443 -10.432  -4.073
  249    HD2  HIS  32           2HD      HIS  32   0.203  -6.900  -2.632
  250    HE1  HIS  32           1HE      HIS  32  -2.612  -9.942  -1.881
  251    H    LYS  33           H        LYS  33   4.480  -9.219  -5.039
  252    HA   LYS  33           HA       LYS  33   4.710 -10.035  -7.706
  253   1HB   LYS  33          2HB       LYS  33   4.277  -7.161  -7.297
  254   2HB   LYS  33          1HB       LYS  33   5.705  -7.534  -8.252
  255   1HG   LYS  33          2HG       LYS  33   3.356  -9.060  -9.055
  256   2HG   LYS  33          1HG       LYS  33   3.145  -7.316  -9.202
  257   1HD   LYS  33          2HD       LYS  33   4.176  -7.542 -11.179
  258   2HD   LYS  33          1HD       LYS  33   5.656  -7.687 -10.231
  259   1HE   LYS  33          2HE       LYS  33   3.917  -9.995 -11.094
  260   2HE   LYS  33          1HE       LYS  33   5.397  -9.487 -11.906
  261   1HZ   LYS  33          1HZ       LYS  33   6.326 -10.996 -10.552
  262   2HZ   LYS  33          2HZ       LYS  33   5.054 -10.964  -9.438
  263   3HZ   LYS  33          3HZ       LYS  33   6.249  -9.768  -9.390
  264    H    ASN  34           H        ASN  34   6.185 -11.222  -6.239
  265    HA   ASN  34           HA       ASN  34   8.655  -9.757  -5.636
  266   1HB   ASN  34          2HB       ASN  34   9.241 -11.714  -4.243
  267   2HB   ASN  34          1HB       ASN  34   7.709 -10.990  -3.760
  268   1HD2  ASN  34          1HD2      ASN  34   8.596 -13.637  -3.199
  269   2HD2  ASN  34          2HD2      ASN  34   7.482 -14.723  -3.948
  270    H    LYS  35           H        LYS  35   7.930 -10.525  -8.339
  271    HA   LYS  35           HA       LYS  35  10.392 -11.537  -9.218
  272   1HB   LYS  35          2HB       LYS  35   8.942 -13.592  -8.238
  273   2HB   LYS  35          1HB       LYS  35   8.357 -13.579  -9.897
  274   1HG   LYS  35          2HG       LYS  35  10.165 -15.105  -9.796
  275   2HG   LYS  35          1HG       LYS  35  10.743 -13.670 -10.646
  276   1HD   LYS  35          2HD       LYS  35  12.465 -14.248  -9.143
  277   2HD   LYS  35          1HD       LYS  35  11.633 -12.879  -8.401
  278   1HE   LYS  35          2HE       LYS  35  11.792 -14.292  -6.604
  279   2HE   LYS  35          1HE       LYS  35  10.224 -14.773  -7.251
  280   1HZ   LYS  35          1HZ       LYS  35  12.093 -16.520  -6.676
  281   2HZ   LYS  35          2HZ       LYS  35  12.580 -16.175  -8.259
  282   3HZ   LYS  35          3HZ       LYS  35  11.020 -16.757  -7.963
  283    HA   PRO  36           HA       PRO  36   7.374  -9.551 -12.268
  284   1HB   PRO  36          2HB       PRO  36   8.683  -7.195 -12.567
  285   2HB   PRO  36          1HB       PRO  36   7.451  -7.455 -11.326
  286   1HG   PRO  36          2HG       PRO  36  10.434  -7.538 -11.081
  287   2HG   PRO  36          1HG       PRO  36   9.243  -6.800  -9.994
  288   1HD   PRO  36          2HD       PRO  36  10.376  -9.209  -9.497
  289   2HD   PRO  36          1HD       PRO  36   8.719  -8.811  -8.998
  Start of MODEL    2
    1   1H    GLY   1          1HT       GLY   1 -23.098  -1.365   2.352
    2   2H    GLY   1          2HT       GLY   1 -23.407  -0.806   0.785
    3   3H    GLY   1          3HT       GLY   1 -24.163  -0.072   2.109
    4   1HA   GLY   1          1HA       GLY   1 -22.484   1.418   1.587
    5   2HA   GLY   1          2HA       GLY   1 -21.836   0.485   2.926
    6    H    SER   2           H        SER   2 -21.476  -1.891   1.169
    7    HA   SER   2           HA       SER   2 -19.336  -0.957  -0.602
    8   1HB   SER   2          2HB       SER   2 -19.030  -2.643   1.825
    9   2HB   SER   2          1HB       SER   2 -18.114  -3.133   0.400
   10    HG   SER   2           HG       SER   2 -18.004  -0.681   1.802
   11    H    ALA   3           H        ALA   3 -19.739  -1.762  -2.543
   12    HA   ALA   3           HA       ALA   3 -21.196  -4.296  -2.772
   13   1HB   ALA   3          1HB       ALA   3 -20.959  -1.876  -4.454
   14   2HB   ALA   3          2HB       ALA   3 -22.354  -2.909  -4.138
   15   3HB   ALA   3          3HB       ALA   3 -21.126  -3.416  -5.298
   16    H    ALA   4           H        ALA   4 -18.350  -4.162  -2.093
   17    HA   ALA   4           HA       ALA   4 -16.398  -5.212  -2.608
   18   1HB   ALA   4          1HB       ALA   4 -17.733  -6.773  -4.769
   19   2HB   ALA   4          2HB       ALA   4 -18.233  -7.016  -3.094
   20   3HB   ALA   4          3HB       ALA   4 -16.555  -7.294  -3.564
   21    H    GLU   5           H        GLU   5 -15.114  -3.665  -3.470
   22    HA   GLU   5           HA       GLU   5 -14.098  -3.787  -5.983
   23   1HB   GLU   5          2HB       GLU   5 -15.185  -1.678  -7.020
   24   2HB   GLU   5          1HB       GLU   5 -16.047  -3.206  -7.128
   25   1HG   GLU   5          2HG       GLU   5 -17.748  -2.478  -5.876
   26   2HG   GLU   5          1HG       GLU   5 -16.686  -1.644  -4.742
   27    H    VAL   6           H        VAL   6 -12.685  -3.367  -3.972
   28    HA   VAL   6           HA       VAL   6 -12.386  -0.544  -3.331
   29    HB   VAL   6           HB       VAL   6 -12.207  -2.206  -1.525
   30   1HG1  VAL   6          1HG1      VAL   6  -9.524  -3.106  -2.308
   31   2HG1  VAL   6          2HG1      VAL   6 -10.840  -3.740  -3.296
   32   3HG1  VAL   6          3HG1      VAL   6 -10.847  -3.994  -1.551
   33   1HG2  VAL   6          1HG2      VAL   6  -9.735  -0.604  -2.147
   34   2HG2  VAL   6          2HG2      VAL   6 -10.010  -1.405  -0.600
   35   3HG2  VAL   6          3HG2      VAL   6 -11.106  -0.135  -1.143
   36    H    MET   7           H        MET   7 -10.555   0.682  -3.774
   37    HA   MET   7           HA       MET   7  -8.224  -0.301  -5.016
   38   1HB   MET   7          2HB       MET   7 -10.007  -0.541  -6.853
   39   2HB   MET   7          1HB       MET   7  -9.970   1.215  -6.941
   40   1HG   MET   7          2HG       MET   7  -7.409  -0.286  -7.125
   41   2HG   MET   7          1HG       MET   7  -8.488  -0.257  -8.518
   42   1HE   MET   7          1HE       MET   7  -5.267   1.765  -7.479
   43   2HE   MET   7          2HE       MET   7  -6.314   1.376  -6.114
   44   3HE   MET   7          3HE       MET   7  -6.095   3.055  -6.607
   45    H    LYS   8           H        LYS   8  -7.547   1.098  -3.267
   46    HA   LYS   8           HA       LYS   8  -7.058   3.790  -4.216
   47   1HB   LYS   8          2HB       LYS   8  -9.110   4.182  -3.046
   48   2HB   LYS   8          1HB       LYS   8  -8.578   3.229  -1.668
   49   1HG   LYS   8          2HG       LYS   8  -6.836   4.912  -1.212
   50   2HG   LYS   8          1HG       LYS   8  -7.457   5.882  -2.550
   51   1HD   LYS   8          2HD       LYS   8  -9.355   5.009  -0.430
   52   2HD   LYS   8          1HD       LYS   8  -8.225   6.314  -0.060
   53   1HE   LYS   8          2HE       LYS   8  -9.018   7.457  -2.149
   54   2HE   LYS   8          1HE       LYS   8 -10.271   6.223  -2.270
   55   1HZ   LYS   8          1HZ       LYS   8 -11.195   8.108  -1.188
   56   2HZ   LYS   8          2HZ       LYS   8  -9.911   8.204  -0.091
   57   3HZ   LYS   8          3HZ       LYS   8 -10.998   6.911  -0.009
   58    H    LYS   9           H        LYS   9  -6.872   2.652  -0.875
   59    HA   LYS   9           HA       LYS   9  -4.009   2.163  -1.124
   60   1HB   LYS   9          2HB       LYS   9  -5.206   4.316   0.622
   61   2HB   LYS   9          1HB       LYS   9  -3.603   3.652   0.890
   62   1HG   LYS   9          2HG       LYS   9  -2.792   5.145  -0.520
   63   2HG   LYS   9          1HG       LYS   9  -3.690   4.361  -1.819
   64   1HD   LYS   9          2HD       LYS   9  -5.029   6.129  -2.007
   65   2HD   LYS   9          1HD       LYS   9  -5.471   6.015  -0.304
   66   1HE   LYS   9          2HE       LYS   9  -2.832   7.107  -0.545
   67   2HE   LYS   9          1HE       LYS   9  -3.944   8.014  -1.568
   68   1HZ   LYS   9          1HZ       LYS   9  -4.036   7.617   1.354
   69   2HZ   LYS   9          2HZ       LYS   9  -5.430   8.044   0.496
   70   3HZ   LYS   9          3HZ       LYS   9  -4.080   9.063   0.477
   71    H    TYR  10           H        TYR  10  -5.937   0.280  -0.692
   72    HA   TYR  10           HA       TYR  10  -5.182  -0.712   1.921
   73   1HB   TYR  10          2HB       TYR  10  -7.307   0.665   2.220
   74   2HB   TYR  10          1HB       TYR  10  -8.121  -0.559   1.251
   75    HD1  TYR  10           1HD      TYR  10  -7.281   0.420   4.519
   76    HD2  TYR  10           2HD      TYR  10  -7.783  -3.038   2.092
   77    HE1  TYR  10           1HE      TYR  10  -7.622  -0.939   6.538
   78    HE2  TYR  10           2HE      TYR  10  -8.127  -4.408   4.105
   79    HH   TYR  10           HH       TYR  10  -7.237  -3.737   6.961
   80    H    CYS  11           H        CYS  11  -4.973  -2.890   1.911
   81    HA   CYS  11           HA       CYS  11  -5.566  -4.244  -0.595
   82   1HB   CYS  11          2HB       CYS  11  -3.334  -4.442   0.599
   83   2HB   CYS  11          1HB       CYS  11  -4.162  -5.433   1.794
   84    H    SER  12           H        SER  12  -7.220  -5.535  -0.908
   85    HA   SER  12           HA       SER  12  -9.019  -6.154   1.280
   86   1HB   SER  12          2HB       SER  12  -9.504  -5.450  -1.284
   87   2HB   SER  12          1HB       SER  12  -9.588  -7.206  -1.430
   88    HG   SER  12           HG       SER  12 -11.054  -7.054   0.459
   89    H    THR  13           H        THR  13  -6.320  -7.510   0.843
   90    HA   THR  13           HA       THR  13  -7.327 -10.244   1.096
   91    HB   THR  13           HB       THR  13  -4.851  -9.440  -0.438
   92    HG1  THR  13           1HG      THR  13  -6.841  -9.033  -1.535
   93   1HG2  THR  13          1HG2      THR  13  -4.310 -11.602  -0.748
   94   2HG2  THR  13          2HG2      THR  13  -5.986 -12.146  -0.691
   95   3HG2  THR  13          3HG2      THR  13  -5.124 -11.786   0.804
   96    H    CYS  14           H        CYS  14  -4.834  -7.879   1.828
   97    HA   CYS  14           HA       CYS  14  -3.750  -9.669   3.890
   98   1HB   CYS  14          2HB       CYS  14  -2.628  -7.057   2.862
   99   2HB   CYS  14          1HB       CYS  14  -1.838  -8.160   3.982
  100    H    ASP  15           H        ASP  15  -6.103  -7.416   3.675
  101    HA   ASP  15           HA       ASP  15  -7.169  -6.028   5.118
  102   1HB   ASP  15          2HB       ASP  15  -5.807  -7.839   7.119
  103   2HB   ASP  15          1HB       ASP  15  -7.112  -6.722   7.500
  104    H    ILE  16           H        ILE  16  -4.793  -4.998   4.128
  105    HA   ILE  16           HA       ILE  16  -3.728  -3.508   6.439
  106    HB   ILE  16           HB       ILE  16  -2.281  -3.779   3.818
  107   1HG1  ILE  16          2HG1      ILE  16  -2.707  -6.049   4.696
  108   2HG1  ILE  16          1HG1      ILE  16  -1.000  -5.630   4.754
  109   1HG2  ILE  16          1HG2      ILE  16  -0.323  -3.419   5.422
  110   2HG2  ILE  16          2HG2      ILE  16  -1.545  -2.948   6.604
  111   3HG2  ILE  16          3HG2      ILE  16  -1.379  -2.044   5.099
  112   1HD1  ILE  16          1HD1      ILE  16  -1.937  -6.826   6.763
  113   2HD1  ILE  16          2HD1      ILE  16  -2.815  -5.339   7.124
  114   3HD1  ILE  16          3HD1      ILE  16  -1.051  -5.336   7.087
  115    H    SER  17           H        SER  17  -3.041  -1.278   5.950
  116    HA   SER  17           HA       SER  17  -4.576  -0.064   3.757
  117   1HB   SER  17          2HB       SER  17  -5.700   0.152   6.047
  118   2HB   SER  17          1HB       SER  17  -4.361   1.214   6.485
  119    HG   SER  17           HG       SER  17  -5.186   2.741   5.291
  120    H    PHE  18           H        PHE  18  -3.841   2.181   3.267
  121    HA   PHE  18           HA       PHE  18  -1.071   2.712   4.009
  122   1HB   PHE  18          2HB       PHE  18  -2.115   2.456   1.185
  123   2HB   PHE  18          1HB       PHE  18  -0.564   3.174   1.594
  124    HD1  PHE  18           1HD      PHE  18   1.091   1.701   2.907
  125    HD2  PHE  18           2HD      PHE  18  -2.299   0.181   0.832
  126    HE1  PHE  18           1HE      PHE  18   2.120  -0.534   2.870
  127    HE2  PHE  18           2HE      PHE  18  -1.277  -2.056   0.792
  128    HZ   PHE  18           HZ       PHE  18   0.934  -2.417   1.813
  129    H    ASN  19           H        ASN  19  -0.590   4.840   4.169
  130    HA   ASN  19           HA       ASN  19  -2.805   6.711   3.869
  131   1HB   ASN  19          2HB       ASN  19  -0.987   6.434   5.856
  132   2HB   ASN  19          1HB       ASN  19  -0.201   7.680   4.892
  133   1HD2  ASN  19          1HD2      ASN  19  -2.942   6.872   6.855
  134   2HD2  ASN  19          2HD2      ASN  19  -3.539   8.481   7.046
  135    H    TYR  20           H        TYR  20  -0.805   5.571   1.718
  136    HA   TYR  20           HA       TYR  20  -0.752   8.010   0.175
  137   1HB   TYR  20          2HB       TYR  20   1.744   6.698   1.193
  138   2HB   TYR  20          1HB       TYR  20   1.755   7.492  -0.377
  139    HD1  TYR  20           1HD      TYR  20   1.461   9.917  -0.547
  140    HD2  TYR  20           2HD      TYR  20   1.590   7.974   3.236
  141    HE1  TYR  20           1HE      TYR  20   1.826  12.088   0.550
  142    HE2  TYR  20           2HE      TYR  20   1.956  10.139   4.343
  143    HH   TYR  20           HH       TYR  20   2.841  12.918   2.697
  144    H    VAL  21           H        VAL  21  -1.260   7.537  -1.862
  145    HA   VAL  21           HA       VAL  21  -1.893   5.012  -2.774
  146    HB   VAL  21           HB       VAL  21  -0.937   7.252  -4.557
  147   1HG1  VAL  21          1HG1      VAL  21  -1.245   5.443  -5.949
  148   2HG1  VAL  21          2HG1      VAL  21  -2.849   6.175  -5.976
  149   3HG1  VAL  21          3HG1      VAL  21  -2.540   4.766  -4.961
  150   1HG2  VAL  21          1HG2      VAL  21  -3.437   7.794  -4.630
  151   2HG2  VAL  21          2HG2      VAL  21  -2.536   8.291  -3.197
  152   3HG2  VAL  21          3HG2      VAL  21  -3.555   6.852  -3.144
  153    H    LYS  22           H        LYS  22   1.197   6.622  -2.741
  154    HA   LYS  22           HA       LYS  22   2.541   4.966  -4.592
  155   1HB   LYS  22          2HB       LYS  22   3.368   6.855  -2.437
  156   2HB   LYS  22          1HB       LYS  22   4.575   5.744  -3.071
  157   1HG   LYS  22          2HG       LYS  22   2.940   7.592  -4.792
  158   2HG   LYS  22          1HG       LYS  22   4.538   7.988  -4.157
  159   1HD   LYS  22          2HD       LYS  22   5.350   5.855  -5.266
  160   2HD   LYS  22          1HD       LYS  22   3.792   5.809  -6.094
  161   1HE   LYS  22          2HE       LYS  22   5.674   8.161  -6.188
  162   2HE   LYS  22          1HE       LYS  22   5.657   6.873  -7.392
  163   1HZ   LYS  22          1HZ       LYS  22   4.279   9.044  -7.742
  164   2HZ   LYS  22          2HZ       LYS  22   3.144   8.254  -6.769
  165   3HZ   LYS  22          3HZ       LYS  22   3.652   7.546  -8.219
  166    H    THR  23           H        THR  23   1.918   4.708  -1.144
  167    HA   THR  23           HA       THR  23   3.652   2.490  -0.719
  168    HB   THR  23           HB       THR  23   1.296   2.812   1.047
  169    HG1  THR  23           1HG      THR  23   1.875   4.764   1.799
  170   1HG2  THR  23          1HG2      THR  23   3.103   1.377   1.747
  171   2HG2  THR  23          2HG2      THR  23   2.997   2.781   2.808
  172   3HG2  THR  23          3HG2      THR  23   4.254   2.701   1.574
  173    H    TYR  24           H        TYR  24   0.228   2.838  -1.469
  174    HA   TYR  24           HA       TYR  24  -0.446   0.106  -1.205
  175   1HB   TYR  24          2HB       TYR  24  -2.080   2.012  -1.314
  176   2HB   TYR  24          1HB       TYR  24  -1.742   2.134  -3.035
  177    HD1  TYR  24           1HD      TYR  24  -3.667   1.458  -4.142
  178    HD2  TYR  24           2HD      TYR  24  -2.252  -0.860  -0.867
  179    HE1  TYR  24           1HE      TYR  24  -5.392  -0.234  -4.602
  180    HE2  TYR  24           2HE      TYR  24  -3.973  -2.559  -1.318
  181    HH   TYR  24           HH       TYR  24  -5.702  -2.713  -4.163
  182    H    LEU  25           H        LEU  25   1.040   1.984  -3.717
  183    HA   LEU  25           HA       LEU  25   0.719   0.011  -5.781
  184   1HB   LEU  25          2HB       LEU  25   2.419   2.484  -5.518
  185   2HB   LEU  25          1HB       LEU  25   2.534   1.421  -6.907
  186    HG   LEU  25           HG       LEU  25   0.088   2.961  -6.038
  187   1HD1  LEU  25          1HD1      LEU  25   0.487   3.939  -8.392
  188   2HD1  LEU  25          2HD1      LEU  25   2.129   3.328  -8.194
  189   3HD1  LEU  25          3HD1      LEU  25   1.483   4.508  -7.054
  190   1HD2  LEU  25          1HD2      LEU  25   0.509   0.831  -8.087
  191   2HD2  LEU  25          2HD2      LEU  25  -0.661   2.118  -8.385
  192   3HD2  LEU  25          3HD2      LEU  25  -0.840   1.071  -6.977
  193    H    ALA  26           H        ALA  26   3.265   0.992  -3.550
  194    HA   ALA  26           HA       ALA  26   5.265  -0.734  -4.494
  195   1HB   ALA  26          1HB       ALA  26   5.224   1.267  -2.703
  196   2HB   ALA  26          2HB       ALA  26   6.529   0.085  -2.813
  197   3HB   ALA  26          3HB       ALA  26   5.254  -0.119  -1.612
  198    H    HIS  27           H        HIS  27   2.556  -1.222  -2.325
  199    HA   HIS  27           HA       HIS  27   3.492  -3.670  -1.211
  200   1HB   HIS  27          2HB       HIS  27   1.805  -2.424  -0.026
  201   2HB   HIS  27          1HB       HIS  27   0.715  -2.492  -1.407
  202    HD1  HIS  27           1HD      HIS  27   2.267  -4.824   1.169
  203    HD2  HIS  27           2HD      HIS  27  -0.940  -4.628  -1.462
  204    HE1  HIS  27           1HE      HIS  27   0.851  -6.872   1.618
  205    H    LYS  28           H        LYS  28   1.408  -2.870  -3.957
  206    HA   LYS  28           HA       LYS  28   0.793  -5.597  -4.566
  207   1HB   LYS  28          2HB       LYS  28  -0.408  -3.325  -5.237
  208   2HB   LYS  28          1HB       LYS  28   0.629  -3.468  -6.650
  209   1HG   LYS  28          2HG       LYS  28  -1.131  -4.614  -7.457
  210   2HG   LYS  28          1HG       LYS  28  -0.370  -5.951  -6.592
  211   1HD   LYS  28          2HD       LYS  28  -1.821  -5.612  -4.697
  212   2HD   LYS  28          1HD       LYS  28  -2.509  -4.165  -5.437
  213   1HE   LYS  28          2HE       LYS  28  -2.825  -7.030  -6.289
  214   2HE   LYS  28          1HE       LYS  28  -4.079  -5.890  -5.801
  215   1HZ   LYS  28          1HZ       LYS  28  -2.484  -5.843  -8.302
  216   2HZ   LYS  28          2HZ       LYS  28  -3.488  -4.573  -7.813
  217   3HZ   LYS  28          3HZ       LYS  28  -4.151  -6.092  -8.150
  218    H    GLN  29           H        GLN  29   3.236  -3.295  -5.584
  219    HA   GLN  29           HA       GLN  29   4.243  -5.044  -7.659
  220   1HB   GLN  29          2HB       GLN  29   4.277  -2.353  -7.370
  221   2HB   GLN  29          1HB       GLN  29   5.882  -2.751  -6.774
  222   1HG   GLN  29          2HG       GLN  29   6.250  -2.379  -9.016
  223   2HG   GLN  29          1HG       GLN  29   6.097  -4.133  -8.939
  224   1HE2  GLN  29          1HE2      GLN  29   5.753  -3.383 -11.328
  225   2HE2  GLN  29          2HE2      GLN  29   4.099  -3.234 -11.800
  226    H    PHE  30           H        PHE  30   4.701  -4.713  -4.303
  227    HA   PHE  30           HA       PHE  30   7.301  -6.088  -4.475
  228   1HB   PHE  30          2HB       PHE  30   7.117  -3.817  -3.273
  229   2HB   PHE  30          1HB       PHE  30   6.274  -4.706  -2.008
  230    HD1  PHE  30           1HD      PHE  30   9.395  -4.978  -4.039
  231    HD2  PHE  30           2HD      PHE  30   7.525  -5.465  -0.247
  232    HE1  PHE  30           1HE      PHE  30  11.558  -5.623  -3.059
  233    HE2  PHE  30           2HE      PHE  30   9.684  -6.111   0.740
  234    HZ   PHE  30           HZ       PHE  30  11.705  -6.191  -0.667
  235    H    TYR  31           H        TYR  31   4.313  -5.960  -2.530
  236    HA   TYR  31           HA       TYR  31   4.857  -8.457  -1.243
  237   1HB   TYR  31          2HB       TYR  31   3.292  -6.389  -0.577
  238   2HB   TYR  31          1HB       TYR  31   2.078  -7.404  -1.347
  239    HD1  TYR  31           1HD      TYR  31   4.610  -7.332   1.359
  240    HD2  TYR  31           2HD      TYR  31   1.170  -9.270  -0.226
  241    HE1  TYR  31           1HE      TYR  31   4.401  -8.641   3.430
  242    HE2  TYR  31           2HE      TYR  31   0.950 -10.583   1.841
  243    HH   TYR  31           HH       TYR  31   1.993  -9.948   4.545
  244    H    HIS  32           H        HIS  32   2.464  -7.444  -3.683
  245    HA   HIS  32           HA       HIS  32   1.924 -10.253  -4.284
  246   1HB   HIS  32          2HB       HIS  32   0.556  -7.737  -5.258
  247   2HB   HIS  32          1HB       HIS  32   0.047  -9.379  -5.632
  248    HD1  HIS  32           1HD      HIS  32  -1.445 -10.534  -3.920
  249    HD2  HIS  32           2HD      HIS  32   0.242  -7.008  -2.511
  250    HE1  HIS  32           1HE      HIS  32  -2.572 -10.038  -1.706
  251    H    LYS  33           H        LYS  33   4.459  -9.422  -5.023
  252    HA   LYS  33           HA       LYS  33   4.519 -10.152  -7.749
  253   1HB   LYS  33          2HB       LYS  33   3.904  -7.521  -7.517
  254   2HB   LYS  33          1HB       LYS  33   5.659  -7.432  -7.548
  255   1HG   LYS  33          2HG       LYS  33   3.892  -8.696  -9.633
  256   2HG   LYS  33          1HG       LYS  33   4.773  -7.173  -9.776
  257   1HD   LYS  33          2HD       LYS  33   6.167  -9.777  -9.224
  258   2HD   LYS  33          1HD       LYS  33   5.813  -9.235 -10.865
  259   1HE   LYS  33          2HE       LYS  33   7.239  -7.407 -10.702
  260   2HE   LYS  33          1HE       LYS  33   7.225  -7.431  -8.939
  261   1HZ   LYS  33          1HZ       LYS  33   8.829  -8.997  -8.856
  262   2HZ   LYS  33          2HZ       LYS  33   9.235  -8.370 -10.374
  263   3HZ   LYS  33          3HZ       LYS  33   8.314  -9.784 -10.263
  264    H    ASN  34           H        ASN  34   5.739 -11.147  -5.502
  265    HA   ASN  34           HA       ASN  34   8.434 -11.297  -6.308
  266   1HB   ASN  34          2HB       ASN  34   8.459  -9.022  -5.256
  267   2HB   ASN  34          1HB       ASN  34   8.020  -9.777  -3.727
  268   1HD2  ASN  34          1HD2      ASN  34  10.021  -8.775  -3.002
  269   2HD2  ASN  34          2HD2      ASN  34  11.512  -9.612  -3.249
  270    H    LYS  35           H        LYS  35   6.301 -13.059  -5.648
  271    HA   LYS  35           HA       LYS  35   5.912 -15.017  -4.559
  272   1HB   LYS  35          2HB       LYS  35   8.531 -15.042  -5.080
  273   2HB   LYS  35          1HB       LYS  35   8.618 -15.038  -3.324
  274   1HG   LYS  35          2HG       LYS  35   8.692 -17.297  -4.027
  275   2HG   LYS  35          1HG       LYS  35   7.094 -17.025  -3.333
  276   1HD   LYS  35          2HD       LYS  35   6.145 -16.784  -5.560
  277   2HD   LYS  35          1HD       LYS  35   7.745 -16.981  -6.279
  278   1HE   LYS  35          2HE       LYS  35   7.089 -19.133  -6.462
  279   2HE   LYS  35          1HE       LYS  35   7.636 -19.213  -4.788
  280   1HZ   LYS  35          1HZ       LYS  35   4.860 -18.926  -5.779
  281   2HZ   LYS  35          2HZ       LYS  35   5.283 -18.643  -4.166
  282   3HZ   LYS  35          3HZ       LYS  35   5.507 -20.177  -4.842
  283    HA   PRO  36           HA       PRO  36   5.136 -12.810  -0.583
  284   1HB   PRO  36          2HB       PRO  36   2.544 -13.586  -0.379
  285   2HB   PRO  36          1HB       PRO  36   3.052 -12.177  -1.318
  286   1HG   PRO  36          2HG       PRO  36   2.402 -14.945  -2.257
  287   2HG   PRO  36          1HG       PRO  36   1.941 -13.386  -2.966
  288   1HD   PRO  36          2HD       PRO  36   3.985 -14.877  -3.931
  289   2HD   PRO  36          1HD       PRO  36   3.987 -13.103  -3.989
  Start of MODEL    3
    1   1H    GLY   1          1HT       GLY   1 -13.850   5.367 -14.690
    2   2H    GLY   1          2HT       GLY   1 -15.056   4.699 -15.669
    3   3H    GLY   1          3HT       GLY   1 -14.440   3.815 -14.364
    4   1HA   GLY   1          1HA       GLY   1 -16.084   6.281 -14.233
    5   2HA   GLY   1          2HA       GLY   1 -16.575   4.665 -13.751
    6    H    SER   2           H        SER   2 -16.128   3.959 -11.727
    7    HA   SER   2           HA       SER   2 -14.084   5.082 -10.090
    8   1HB   SER   2          2HB       SER   2 -16.239   6.709 -10.174
    9   2HB   SER   2          1HB       SER   2 -16.723   5.637  -8.860
   10    HG   SER   2           HG       SER   2 -15.025   7.660  -8.766
   11    H    ALA   3           H        ALA   3 -14.997   2.487 -10.943
   12    HA   ALA   3           HA       ALA   3 -15.492   1.295  -8.299
   13   1HB   ALA   3          1HB       ALA   3 -17.561   1.236  -9.641
   14   2HB   ALA   3          2HB       ALA   3 -16.942  -0.375  -9.276
   15   3HB   ALA   3          3HB       ALA   3 -16.706   0.318 -10.881
   16    H    ALA   4           H        ALA   4 -12.975   1.704  -9.507
   17    HA   ALA   4           HA       ALA   4 -12.151  -1.090  -9.904
   18   1HB   ALA   4          1HB       ALA   4 -11.027  -0.699 -11.827
   19   2HB   ALA   4          2HB       ALA   4 -10.606   0.953 -11.374
   20   3HB   ALA   4          3HB       ALA   4 -12.218   0.591 -11.991
   21    H    GLU   5           H        GLU   5 -12.038  -0.050  -7.452
   22    HA   GLU   5           HA       GLU   5  -9.516  -0.427  -6.526
   23   1HB   GLU   5          2HB       GLU   5  -9.779   2.239  -7.708
   24   2HB   GLU   5          1HB       GLU   5  -9.212   2.279  -6.045
   25   1HG   GLU   5          2HG       GLU   5  -7.898   0.318  -7.803
   26   2HG   GLU   5          1HG       GLU   5  -7.602   2.016  -8.174
   27    H    VAL   6           H        VAL   6 -11.532  -1.248  -5.317
   28    HA   VAL   6           HA       VAL   6 -13.035   0.414  -3.644
   29    HB   VAL   6           HB       VAL   6 -12.208  -2.417  -3.001
   30   1HG1  VAL   6          1HG1      VAL   6 -14.719  -2.228  -2.135
   31   2HG1  VAL   6          2HG1      VAL   6 -14.253  -0.534  -1.977
   32   3HG1  VAL   6          3HG1      VAL   6 -13.336  -1.783  -1.134
   33   1HG2  VAL   6          1HG2      VAL   6 -14.431  -2.958  -4.149
   34   2HG2  VAL   6          2HG2      VAL   6 -13.051  -2.582  -5.181
   35   3HG2  VAL   6          3HG2      VAL   6 -14.291  -1.363  -4.889
   36    H    MET   7           H        MET   7 -12.477   1.605  -1.949
   37    HA   MET   7           HA       MET   7 -11.331   2.446  -0.174
   38   1HB   MET   7          2HB       MET   7 -10.225  -0.335   0.208
   39   2HB   MET   7          1HB       MET   7 -10.433   0.914   1.427
   40   1HG   MET   7          2HG       MET   7 -12.691   0.567   1.600
   41   2HG   MET   7          1HG       MET   7 -12.825  -0.086  -0.032
   42   1HE   MET   7          1HE       MET   7 -11.069  -2.415   3.545
   43   2HE   MET   7          2HE       MET   7 -11.757  -0.798   3.678
   44   3HE   MET   7          3HE       MET   7 -10.255  -1.046   2.788
   45    H    LYS   8           H        LYS   8  -9.971   3.762  -1.407
   46    HA   LYS   8           HA       LYS   8  -7.646   2.954  -2.717
   47   1HB   LYS   8          2HB       LYS   8  -7.186   5.201  -3.019
   48   2HB   LYS   8          1HB       LYS   8  -8.920   5.228  -2.743
   49   1HG   LYS   8          2HG       LYS   8  -6.796   5.845  -0.697
   50   2HG   LYS   8          1HG       LYS   8  -7.800   7.023  -1.544
   51   1HD   LYS   8          2HD       LYS   8  -8.965   4.822   0.144
   52   2HD   LYS   8          1HD       LYS   8  -8.516   6.392   0.812
   53   1HE   LYS   8          2HE       LYS   8 -10.236   7.468  -0.203
   54   2HE   LYS   8          1HE       LYS   8 -10.197   6.419  -1.620
   55   1HZ   LYS   8          1HZ       LYS   8 -11.517   5.966   0.978
   56   2HZ   LYS   8          2HZ       LYS   8 -11.107   4.657  -0.013
   57   3HZ   LYS   8          3HZ       LYS   8 -12.165   5.848  -0.581
   58    H    LYS   9           H        LYS   9  -5.548   2.696  -2.123
   59    HA   LYS   9           HA       LYS   9  -3.760   2.268  -0.794
   60   1HB   LYS   9          2HB       LYS   9  -4.860   4.139   1.278
   61   2HB   LYS   9          1HB       LYS   9  -3.188   3.853   0.822
   62   1HG   LYS   9          2HG       LYS   9  -3.296   5.242  -0.998
   63   2HG   LYS   9          1HG       LYS   9  -5.041   5.054  -1.176
   64   1HD   LYS   9          2HD       LYS   9  -5.184   6.272   1.090
   65   2HD   LYS   9          1HD       LYS   9  -3.516   6.750   0.771
   66   1HE   LYS   9          2HE       LYS   9  -4.099   8.159  -0.906
   67   2HE   LYS   9          1HE       LYS   9  -5.444   7.148  -1.433
   68   1HZ   LYS   9          1HZ       LYS   9  -5.377   9.189   0.685
   69   2HZ   LYS   9          2HZ       LYS   9  -6.495   7.923   0.785
   70   3HZ   LYS   9          3HZ       LYS   9  -6.512   8.963  -0.550
   71    H    TYR  10           H        TYR  10  -5.735   0.414  -0.601
   72    HA   TYR  10           HA       TYR  10  -5.280  -0.638   2.052
   73   1HB   TYR  10          2HB       TYR  10  -7.402   0.815   2.131
   74   2HB   TYR  10          1HB       TYR  10  -8.143  -0.432   1.134
   75    HD1  TYR  10           1HD      TYR  10  -7.681   0.657   4.412
   76    HD2  TYR  10           2HD      TYR  10  -7.781  -2.906   2.090
   77    HE1  TYR  10           1HE      TYR  10  -8.201  -0.639   6.435
   78    HE2  TYR  10           2HE      TYR  10  -8.302  -4.212   4.107
   79    HH   TYR  10           HH       TYR  10  -8.000  -2.955   7.241
   80    H    CYS  11           H        CYS  11  -4.886  -2.756   1.874
   81    HA   CYS  11           HA       CYS  11  -5.433  -4.063  -0.654
   82   1HB   CYS  11          2HB       CYS  11  -3.254  -4.301   0.631
   83   2HB   CYS  11          1HB       CYS  11  -4.134  -5.317   1.764
   84    H    SER  12           H        SER  12  -7.068  -5.355  -1.069
   85    HA   SER  12           HA       SER  12  -8.979  -5.982   1.017
   86   1HB   SER  12          2HB       SER  12  -9.389  -5.214  -1.499
   87   2HB   SER  12          1HB       SER  12  -9.348  -6.956  -1.776
   88    HG   SER  12           HG       SER  12 -11.006  -5.639   0.116
   89    H    THR  13           H        THR  13  -6.268  -7.370   0.684
   90    HA   THR  13           HA       THR  13  -7.328 -10.087   0.901
   91    HB   THR  13           HB       THR  13  -4.792  -9.321  -0.555
   92    HG1  THR  13           1HG      THR  13  -6.845  -8.939  -1.652
   93   1HG2  THR  13          1HG2      THR  13  -6.027 -11.987   0.032
   94   2HG2  THR  13          2HG2      THR  13  -4.375 -11.446   0.327
   95   3HG2  THR  13          3HG2      THR  13  -4.927 -11.733  -1.323
   96    H    CYS  14           H        CYS  14  -4.817  -7.765   1.714
   97    HA   CYS  14           HA       CYS  14  -3.804  -9.575   3.790
   98   1HB   CYS  14          2HB       CYS  14  -2.695  -6.930   2.831
   99   2HB   CYS  14          1HB       CYS  14  -1.933  -8.004   3.998
  100    H    ASP  15           H        ASP  15  -6.123  -7.236   3.500
  101    HA   ASP  15           HA       ASP  15  -7.266  -5.921   4.959
  102   1HB   ASP  15          2HB       ASP  15  -6.635  -8.310   6.297
  103   2HB   ASP  15          1HB       ASP  15  -6.308  -7.024   7.453
  104    H    ILE  16           H        ILE  16  -4.757  -4.994   4.106
  105    HA   ILE  16           HA       ILE  16  -3.790  -3.528   6.472
  106    HB   ILE  16           HB       ILE  16  -2.266  -3.780   3.891
  107   1HG1  ILE  16          2HG1      ILE  16  -2.739  -6.054   4.737
  108   2HG1  ILE  16          1HG1      ILE  16  -1.030  -5.651   4.854
  109   1HG2  ILE  16          1HG2      ILE  16  -0.352  -3.455   5.556
  110   2HG2  ILE  16          2HG2      ILE  16  -1.603  -2.979   6.704
  111   3HG2  ILE  16          3HG2      ILE  16  -1.383  -2.066   5.212
  112   1HD1  ILE  16          1HD1      ILE  16  -2.124  -6.850   6.822
  113   2HD1  ILE  16          2HD1      ILE  16  -2.876  -5.296   7.181
  114   3HD1  ILE  16          3HD1      ILE  16  -1.119  -5.443   7.171
  115    H    SER  17           H        SER  17  -3.051  -1.299   6.047
  116    HA   SER  17           HA       SER  17  -4.533  -0.020   3.853
  117   1HB   SER  17          2HB       SER  17  -4.657   1.919   5.723
  118   2HB   SER  17          1HB       SER  17  -5.919   0.704   5.519
  119    HG   SER  17           HG       SER  17  -3.728   0.484   7.311
  120    H    PHE  18           H        PHE  18  -3.732   2.173   3.341
  121    HA   PHE  18           HA       PHE  18  -0.953   2.644   4.098
  122   1HB   PHE  18          2HB       PHE  18  -2.007   2.408   1.278
  123   2HB   PHE  18          1HB       PHE  18  -0.454   3.128   1.675
  124    HD1  PHE  18           1HD      PHE  18   1.322   1.713   2.708
  125    HD2  PHE  18           2HD      PHE  18  -2.302   0.077   1.192
  126    HE1  PHE  18           1HE      PHE  18   2.354  -0.520   2.659
  127    HE2  PHE  18           2HE      PHE  18  -1.277  -2.159   1.142
  128    HZ   PHE  18           HZ       PHE  18   1.053  -2.461   1.875
  129    H    ASN  19           H        ASN  19  -0.434   4.759   4.293
  130    HA   ASN  19           HA       ASN  19  -2.595   6.672   4.169
  131   1HB   ASN  19          2HB       ASN  19   0.147   6.612   5.315
  132   2HB   ASN  19          1HB       ASN  19  -0.515   8.191   4.902
  133   1HD2  ASN  19          1HD2      ASN  19  -0.138   8.234   7.345
  134   2HD2  ASN  19          2HD2      ASN  19  -1.503   7.826   8.321
  135    H    TYR  20           H        TYR  20  -0.622   5.505   1.853
  136    HA   TYR  20           HA       TYR  20  -0.941   7.884   0.222
  137   1HB   TYR  20          2HB       TYR  20   1.711   6.737   1.011
  138   2HB   TYR  20          1HB       TYR  20   1.521   7.457  -0.584
  139    HD1  TYR  20           1HD      TYR  20  -0.046   9.792  -0.247
  140    HD2  TYR  20           2HD      TYR  20   2.834   8.163   2.428
  141    HE1  TYR  20           1HE      TYR  20   0.316  12.026   0.715
  142    HE2  TYR  20           2HE      TYR  20   3.202  10.392   3.398
  143    HH   TYR  20           HH       TYR  20   1.392  12.722   3.398
  144    H    VAL  21           H        VAL  21  -1.563   7.352  -1.778
  145    HA   VAL  21           HA       VAL  21  -2.182   4.759  -2.537
  146    HB   VAL  21           HB       VAL  21  -1.511   6.902  -4.545
  147   1HG1  VAL  21          1HG1      VAL  21  -2.926   5.786  -5.991
  148   2HG1  VAL  21          2HG1      VAL  21  -3.802   4.988  -4.685
  149   3HG1  VAL  21          3HG1      VAL  21  -2.177   4.452  -5.113
  150   1HG2  VAL  21          1HG2      VAL  21  -2.886   8.158  -3.200
  151   2HG2  VAL  21          2HG2      VAL  21  -3.779   6.755  -2.616
  152   3HG2  VAL  21          3HG2      VAL  21  -4.076   7.375  -4.239
  153    H    LYS  22           H        LYS  22   0.807   6.519  -2.856
  154    HA   LYS  22           HA       LYS  22   2.052   4.865  -4.782
  155   1HB   LYS  22          2HB       LYS  22   3.223   6.614  -2.612
  156   2HB   LYS  22          1HB       LYS  22   4.180   5.822  -3.858
  157   1HG   LYS  22          2HG       LYS  22   1.969   7.787  -4.414
  158   2HG   LYS  22          1HG       LYS  22   3.681   8.207  -4.321
  159   1HD   LYS  22          2HD       LYS  22   3.946   6.300  -6.087
  160   2HD   LYS  22          1HD       LYS  22   2.229   6.591  -6.373
  161   1HE   LYS  22          2HE       LYS  22   3.921   8.997  -6.255
  162   2HE   LYS  22          1HE       LYS  22   4.232   7.922  -7.617
  163   1HZ   LYS  22          1HZ       LYS  22   1.445   8.558  -7.043
  164   2HZ   LYS  22          2HZ       LYS  22   2.222   8.345  -8.529
  165   3HZ   LYS  22          3HZ       LYS  22   2.392   9.803  -7.688
  166    H    THR  23           H        THR  23   1.803   4.723  -1.274
  167    HA   THR  23           HA       THR  23   3.656   2.608  -0.920
  168    HB   THR  23           HB       THR  23   1.398   2.848   0.985
  169    HG1  THR  23           1HG      THR  23   2.064   4.834   1.729
  170   1HG2  THR  23          1HG2      THR  23   4.378   2.961   1.375
  171   2HG2  THR  23          2HG2      THR  23   3.368   1.526   1.550
  172   3HG2  THR  23          3HG2      THR  23   3.158   2.891   2.647
  173    H    TYR  24           H        TYR  24   0.167   2.737  -1.396
  174    HA   TYR  24           HA       TYR  24  -0.341  -0.012  -1.043
  175   1HB   TYR  24          2HB       TYR  24  -2.058   1.820  -1.095
  176   2HB   TYR  24          1HB       TYR  24  -1.854   1.890  -2.840
  177    HD1  TYR  24           1HD      TYR  24  -3.927   1.171  -3.654
  178    HD2  TYR  24           2HD      TYR  24  -1.963  -1.119  -0.655
  179    HE1  TYR  24           1HE      TYR  24  -5.602  -0.609  -3.925
  180    HE2  TYR  24           2HE      TYR  24  -3.630  -2.907  -0.919
  181    HH   TYR  24           HH       TYR  24  -5.700  -3.122  -3.512
  182    H    LEU  25           H        LEU  25   0.890   1.862  -3.696
  183    HA   LEU  25           HA       LEU  25   0.527  -0.177  -5.686
  184   1HB   LEU  25          2HB       LEU  25   1.967   2.443  -5.551
  185   2HB   LEU  25          1HB       LEU  25   2.352   1.325  -6.845
  186    HG   LEU  25           HG       LEU  25  -0.515   1.988  -6.393
  187   1HD1  LEU  25          1HD1      LEU  25   1.154   3.806  -8.074
  188   2HD1  LEU  25          2HD1      LEU  25   0.975   4.114  -6.348
  189   3HD1  LEU  25          3HD1      LEU  25  -0.449   4.069  -7.388
  190   1HD2  LEU  25          1HD2      LEU  25  -0.270   0.472  -8.109
  191   2HD2  LEU  25          2HD2      LEU  25   1.255   1.171  -8.653
  192   3HD2  LEU  25          3HD2      LEU  25  -0.265   2.000  -8.988
  193    H    ALA  26           H        ALA  26   3.181   0.993  -3.677
  194    HA   ALA  26           HA       ALA  26   5.181  -0.693  -4.680
  195   1HB   ALA  26          1HB       ALA  26   5.185   1.356  -2.955
  196   2HB   ALA  26          2HB       ALA  26   6.510   0.199  -3.079
  197   3HB   ALA  26          3HB       ALA  26   5.293   0.015  -1.814
  198    H    HIS  27           H        HIS  27   2.628  -1.202  -2.340
  199    HA   HIS  27           HA       HIS  27   3.691  -3.602  -1.232
  200   1HB   HIS  27          2HB       HIS  27   2.084  -2.439   0.085
  201   2HB   HIS  27          1HB       HIS  27   0.925  -2.391  -1.240
  202    HD1  HIS  27           1HD      HIS  27   2.452  -4.870   1.202
  203    HD2  HIS  27           2HD      HIS  27  -0.785  -4.495  -1.373
  204    HE1  HIS  27           1HE      HIS  27   0.982  -6.888   1.607
  205    H    LYS  28           H        LYS  28   1.472  -2.879  -3.879
  206    HA   LYS  28           HA       LYS  28   0.815  -5.613  -4.394
  207   1HB   LYS  28          2HB       LYS  28  -0.355  -3.304  -5.090
  208   2HB   LYS  28          1HB       LYS  28   0.572  -3.590  -6.556
  209   1HG   LYS  28          2HG       LYS  28  -0.669  -5.390  -7.161
  210   2HG   LYS  28          1HG       LYS  28  -1.013  -5.853  -5.494
  211   1HD   LYS  28          2HD       LYS  28  -2.856  -4.542  -5.369
  212   2HD   LYS  28          1HD       LYS  28  -2.160  -3.286  -6.395
  213   1HE   LYS  28          2HE       LYS  28  -2.612  -4.574  -8.373
  214   2HE   LYS  28          1HE       LYS  28  -3.142  -5.949  -7.407
  215   1HZ   LYS  28          1HZ       LYS  28  -5.118  -4.954  -6.902
  216   2HZ   LYS  28          2HZ       LYS  28  -4.860  -4.300  -8.440
  217   3HZ   LYS  28          3HZ       LYS  28  -4.515  -3.381  -7.063
  218    H    GLN  29           H        GLN  29   3.212  -3.347  -5.594
  219    HA   GLN  29           HA       GLN  29   4.130  -5.169  -7.647
  220   1HB   GLN  29          2HB       GLN  29   4.166  -2.474  -7.470
  221   2HB   GLN  29          1HB       GLN  29   5.794  -2.837  -6.913
  222   1HG   GLN  29          2HG       GLN  29   5.902  -4.326  -9.038
  223   2HG   GLN  29          1HG       GLN  29   4.551  -3.331  -9.579
  224   1HE2  GLN  29          1HE2      GLN  29   7.779  -3.016  -8.143
  225   2HE2  GLN  29          2HE2      GLN  29   8.237  -1.622  -9.056
  226    H    PHE  30           H        PHE  30   4.745  -4.684  -4.332
  227    HA   PHE  30           HA       PHE  30   7.349  -6.038  -4.553
  228   1HB   PHE  30          2HB       PHE  30   7.156  -3.765  -3.373
  229   2HB   PHE  30          1HB       PHE  30   6.335  -4.641  -2.086
  230    HD1  PHE  30           1HD      PHE  30   9.264  -5.594  -4.174
  231    HD2  PHE  30           2HD      PHE  30   7.784  -4.679  -0.291
  232    HE1  PHE  30           1HE      PHE  30  11.443  -6.201  -3.205
  233    HE2  PHE  30           2HE      PHE  30   9.961  -5.283   0.686
  234    HZ   PHE  30           HZ       PHE  30  11.793  -6.047  -0.772
  235    H    TYR  31           H        TYR  31   4.421  -5.951  -2.516
  236    HA   TYR  31           HA       TYR  31   5.045  -8.437  -1.244
  237   1HB   TYR  31          2HB       TYR  31   3.461  -6.381  -0.545
  238   2HB   TYR  31          1HB       TYR  31   2.246  -7.450  -1.239
  239    HD1  TYR  31           1HD      TYR  31   4.555  -6.917   1.528
  240    HD2  TYR  31           2HD      TYR  31   1.796  -9.642  -0.222
  241    HE1  TYR  31           1HE      TYR  31   4.485  -8.187   3.631
  242    HE2  TYR  31           2HE      TYR  31   1.718 -10.920   1.878
  243    HH   TYR  31           HH       TYR  31   3.666 -11.083   4.006
  244    H    HIS  32           H        HIS  32   2.631  -7.451  -3.667
  245    HA   HIS  32           HA       HIS  32   2.030 -10.262  -4.193
  246   1HB   HIS  32          2HB       HIS  32   0.723  -7.735  -5.220
  247   2HB   HIS  32          1HB       HIS  32   0.185  -9.370  -5.586
  248    HD1  HIS  32           1HD      HIS  32  -1.305 -10.510  -3.855
  249    HD2  HIS  32           2HD      HIS  32   0.356  -6.946  -2.509
  250    HE1  HIS  32           1HE      HIS  32  -2.454  -9.971  -1.665
  251    H    LYS  33           H        LYS  33   4.586  -9.501  -4.951
  252    HA   LYS  33           HA       LYS  33   4.596 -10.271  -7.683
  253   1HB   LYS  33          2HB       LYS  33   4.917  -7.390  -7.014
  254   2HB   LYS  33          1HB       LYS  33   5.987  -8.057  -8.239
  255   1HG   LYS  33          2HG       LYS  33   3.694  -9.003  -9.181
  256   2HG   LYS  33          1HG       LYS  33   3.063  -7.602  -8.314
  257   1HD   LYS  33          2HD       LYS  33   5.164  -6.480  -9.583
  258   2HD   LYS  33          1HD       LYS  33   4.731  -7.739 -10.741
  259   1HE   LYS  33          2HE       LYS  33   2.938  -5.576  -9.650
  260   2HE   LYS  33          1HE       LYS  33   3.551  -5.715 -11.297
  261   1HZ   LYS  33          1HZ       LYS  33   1.710  -7.638  -9.979
  262   2HZ   LYS  33          2HZ       LYS  33   2.280  -7.746 -11.567
  263   3HZ   LYS  33          3HZ       LYS  33   1.260  -6.473 -11.122
  264    H    ASN  34           H        ASN  34   5.734 -11.364  -5.438
  265    HA   ASN  34           HA       ASN  34   8.409 -11.716  -6.234
  266   1HB   ASN  34          2HB       ASN  34   8.225  -9.380  -4.903
  267   2HB   ASN  34          1HB       ASN  34   8.455 -10.473  -3.542
  268   1HD2  ASN  34          1HD2      ASN  34   9.755 -10.316  -6.841
  269   2HD2  ASN  34          2HD2      ASN  34  11.416 -10.375  -6.371
  270    H    LYS  35           H        LYS  35   6.155 -13.312  -5.570
  271    HA   LYS  35           HA       LYS  35   7.377 -15.294  -3.991
  272   1HB   LYS  35          2HB       LYS  35   6.828 -13.765  -2.144
  273   2HB   LYS  35          1HB       LYS  35   5.137 -13.788  -2.627
  274   1HG   LYS  35          2HG       LYS  35   5.543 -16.419  -2.329
  275   2HG   LYS  35          1HG       LYS  35   6.724 -15.801  -1.170
  276   1HD   LYS  35          2HD       LYS  35   3.805 -15.040  -1.241
  277   2HD   LYS  35          1HD       LYS  35   4.511 -16.237  -0.154
  278   1HE   LYS  35          2HE       LYS  35   5.822 -13.599  -0.177
  279   2HE   LYS  35          1HE       LYS  35   4.181 -13.629   0.470
  280   1HZ   LYS  35          1HZ       LYS  35   5.469 -14.061   2.313
  281   2HZ   LYS  35          2HZ       LYS  35   6.588 -15.004   1.465
  282   3HZ   LYS  35          3HZ       LYS  35   5.055 -15.625   1.819
  283    HA   PRO  36           HA       PRO  36   4.007 -16.755  -6.757
  284   1HB   PRO  36          2HB       PRO  36   5.332 -18.960  -7.612
  285   2HB   PRO  36          1HB       PRO  36   5.571 -17.363  -8.330
  286   1HG   PRO  36          2HG       PRO  36   7.241 -18.795  -6.299
  287   2HG   PRO  36          1HG       PRO  36   7.758 -17.868  -7.721
  288   1HD   PRO  36          2HD       PRO  36   7.803 -16.844  -5.212
  289   2HD   PRO  36          1HD       PRO  36   7.506 -15.844  -6.648
  Start of MODEL    4
    1   1H    GLY   1          1HT       GLY   1 -18.204  -4.317   8.505
    2   2H    GLY   1          2HT       GLY   1 -18.343  -3.478   7.043
    3   3H    GLY   1          3HT       GLY   1 -19.368  -3.101   8.335
    4   1HA   GLY   1          1HA       GLY   1 -17.758  -1.994   9.513
    5   2HA   GLY   1          2HA       GLY   1 -16.464  -2.865   8.704
    6    H    SER   2           H        SER   2 -19.229  -0.987   7.473
    7    HA   SER   2           HA       SER   2 -19.350   0.754   6.016
    8   1HB   SER   2          2HB       SER   2 -16.755   1.302   7.419
    9   2HB   SER   2          1HB       SER   2 -17.254   2.318   6.066
   10    HG   SER   2           HG       SER   2 -19.100   2.871   7.193
   11    H    ALA   3           H        ALA   3 -19.379  -0.643   4.206
   12    HA   ALA   3           HA       ALA   3 -16.826  -0.856   2.754
   13   1HB   ALA   3          1HB       ALA   3 -18.479  -2.880   3.397
   14   2HB   ALA   3          2HB       ALA   3 -17.436  -2.886   1.976
   15   3HB   ALA   3          3HB       ALA   3 -19.134  -2.436   1.820
   16    H    ALA   4           H        ALA   4 -18.220   1.579   2.734
   17    HA   ALA   4           HA       ALA   4 -19.567   1.662   0.134
   18   1HB   ALA   4          1HB       ALA   4 -19.887   4.140   0.917
   19   2HB   ALA   4          2HB       ALA   4 -19.499   3.472   2.502
   20   3HB   ALA   4          3HB       ALA   4 -20.879   2.851   1.596
   21    H    GLU   5           H        GLU   5 -16.650   1.292   0.453
   22    HA   GLU   5           HA       GLU   5 -15.651   2.657  -1.669
   23   1HB   GLU   5          2HB       GLU   5 -14.231   4.439  -0.443
   24   2HB   GLU   5          1HB       GLU   5 -15.912   4.807  -0.797
   25   1HG   GLU   5          2HG       GLU   5 -16.357   5.121   1.346
   26   2HG   GLU   5          1HG       GLU   5 -15.707   3.537   1.765
   27    H    VAL   6           H        VAL   6 -15.040   0.291  -1.170
   28    HA   VAL   6           HA       VAL   6 -12.678   0.056   0.522
   29    HB   VAL   6           HB       VAL   6 -14.401  -1.706   0.621
   30   1HG1  VAL   6          1HG1      VAL   6 -14.575  -1.449  -2.076
   31   2HG1  VAL   6          2HG1      VAL   6 -15.203  -2.817  -1.157
   32   3HG1  VAL   6          3HG1      VAL   6 -13.623  -2.925  -1.931
   33   1HG2  VAL   6          1HG2      VAL   6 -12.494  -2.667   1.365
   34   2HG2  VAL   6          2HG2      VAL   6 -11.578  -2.216  -0.073
   35   3HG2  VAL   6          3HG2      VAL   6 -12.656  -3.611  -0.116
   36    H    MET   7           H        MET   7 -11.904   1.711  -1.322
   37    HA   MET   7           HA       MET   7  -9.928   0.259  -2.804
   38   1HB   MET   7          2HB       MET   7 -11.906   0.083  -4.301
   39   2HB   MET   7          1HB       MET   7 -11.974   1.838  -4.374
   40   1HG   MET   7          2HG       MET   7  -9.679   1.824  -5.329
   41   2HG   MET   7          1HG       MET   7  -9.766   0.064  -5.387
   42   1HE   MET   7          1HE       MET   7 -10.802   3.070  -8.262
   43   2HE   MET   7          2HE       MET   7  -9.609   1.830  -8.653
   44   3HE   MET   7          3HE       MET   7  -9.476   2.738  -7.147
   45    H    LYS   8           H        LYS   8  -8.658   1.599  -1.402
   46    HA   LYS   8           HA       LYS   8  -7.635   3.890  -2.635
   47   1HB   LYS   8          2HB       LYS   8  -9.701   4.980  -1.953
   48   2HB   LYS   8          1HB       LYS   8  -9.459   4.458  -0.292
   49   1HG   LYS   8          2HG       LYS   8  -7.184   5.791  -0.601
   50   2HG   LYS   8          1HG       LYS   8  -8.148   6.641  -1.809
   51   1HD   LYS   8          2HD       LYS   8  -8.287   7.768   0.342
   52   2HD   LYS   8          1HD       LYS   8  -9.858   7.100  -0.108
   53   1HE   LYS   8          2HE       LYS   8  -9.726   5.399   1.472
   54   2HE   LYS   8          1HE       LYS   8  -7.974   5.535   1.612
   55   1HZ   LYS   8          1HZ       LYS   8  -9.813   7.687   2.485
   56   2HZ   LYS   8          2HZ       LYS   8  -8.173   7.502   2.861
   57   3HZ   LYS   8          3HZ       LYS   8  -9.315   6.442   3.518
   58    H    LYS   9           H        LYS   9  -5.750   2.717  -2.142
   59    HA   LYS   9           HA       LYS   9  -3.890   2.200  -0.939
   60   1HB   LYS   9          2HB       LYS   9  -4.782   4.082   1.219
   61   2HB   LYS   9          1HB       LYS   9  -3.159   3.774   0.621
   62   1HG   LYS   9          2HG       LYS   9  -3.622   4.988  -1.407
   63   2HG   LYS   9          1HG       LYS   9  -5.305   5.206  -0.926
   64   1HD   LYS   9          2HD       LYS   9  -4.363   6.370   1.154
   65   2HD   LYS   9          1HD       LYS   9  -2.837   6.432   0.269
   66   1HE   LYS   9          2HE       LYS   9  -3.579   8.015  -1.161
   67   2HE   LYS   9          1HE       LYS   9  -5.210   7.349  -1.215
   68   1HZ   LYS   9          1HZ       LYS   9  -5.252   8.257   1.231
   69   2HZ   LYS   9          2HZ       LYS   9  -5.590   9.269  -0.082
   70   3HZ   LYS   9          3HZ       LYS   9  -4.059   9.302   0.637
   71    H    TYR  10           H        TYR  10  -5.804   0.356  -0.632
   72    HA   TYR  10           HA       TYR  10  -5.267  -0.667   2.018
   73   1HB   TYR  10          2HB       TYR  10  -7.381   0.754   2.186
   74   2HB   TYR  10          1HB       TYR  10  -8.151  -0.447   1.156
   75    HD1  TYR  10           1HD      TYR  10  -7.633   0.518   4.463
   76    HD2  TYR  10           2HD      TYR  10  -7.797  -2.959   2.017
   77    HE1  TYR  10           1HE      TYR  10  -8.136  -0.846   6.446
   78    HE2  TYR  10           2HE      TYR  10  -8.302  -4.333   3.993
   79    HH   TYR  10           HH       TYR  10  -7.966  -3.170   7.175
   80    H    CYS  11           H        CYS  11  -4.861  -2.779   1.852
   81    HA   CYS  11           HA       CYS  11  -5.451  -4.116  -0.648
   82   1HB   CYS  11          2HB       CYS  11  -3.244  -4.313   0.600
   83   2HB   CYS  11          1HB       CYS  11  -4.091  -5.341   1.749
   84    H    SER  12           H        SER  12  -7.099  -5.402  -1.015
   85    HA   SER  12           HA       SER  12  -8.937  -6.059   1.128
   86   1HB   SER  12          2HB       SER  12  -9.388  -5.309  -1.419
   87   2HB   SER  12          1HB       SER  12  -9.435  -7.061  -1.620
   88    HG   SER  12           HG       SER  12 -10.954  -7.014   0.213
   89    H    THR  13           H        THR  13  -6.227  -7.411   0.713
   90    HA   THR  13           HA       THR  13  -7.241 -10.144   0.925
   91    HB   THR  13           HB       THR  13  -4.748  -9.329  -0.573
   92    HG1  THR  13           1HG      THR  13  -7.299 -10.183  -1.439
   93   1HG2  THR  13          1HG2      THR  13  -5.817 -11.960   0.248
   94   2HG2  THR  13          2HG2      THR  13  -4.151 -11.428   0.018
   95   3HG2  THR  13          3HG2      THR  13  -5.152 -11.820  -1.380
   96    H    CYS  14           H        CYS  14  -4.753  -7.790   1.709
   97    HA   CYS  14           HA       CYS  14  -3.661  -9.606   3.738
   98   1HB   CYS  14          2HB       CYS  14  -2.618  -6.938   2.769
   99   2HB   CYS  14          1HB       CYS  14  -1.815  -7.996   3.922
  100    H    ASP  15           H        ASP  15  -6.009  -7.275   3.523
  101    HA   ASP  15           HA       ASP  15  -7.146  -6.013   5.030
  102   1HB   ASP  15          2HB       ASP  15  -6.413  -8.399   6.330
  103   2HB   ASP  15          1HB       ASP  15  -6.110  -7.110   7.490
  104    H    ILE  16           H        ILE  16  -4.703  -4.998   4.119
  105    HA   ILE  16           HA       ILE  16  -3.726  -3.524   6.477
  106    HB   ILE  16           HB       ILE  16  -2.204  -3.766   3.896
  107   1HG1  ILE  16          2HG1      ILE  16  -2.640  -6.044   4.753
  108   2HG1  ILE  16          1HG1      ILE  16  -0.937  -5.613   4.866
  109   1HG2  ILE  16          1HG2      ILE  16  -0.291  -3.397   5.548
  110   2HG2  ILE  16          2HG2      ILE  16  -1.544  -2.947   6.705
  111   3HG2  ILE  16          3HG2      ILE  16  -1.353  -2.029   5.212
  112   1HD1  ILE  16          1HD1      ILE  16  -2.001  -6.819   6.840
  113   2HD1  ILE  16          2HD1      ILE  16  -2.790  -5.282   7.192
  114   3HD1  ILE  16          3HD1      ILE  16  -1.030  -5.388   7.183
  115    H    SER  17           H        SER  17  -3.025  -1.284   6.035
  116    HA   SER  17           HA       SER  17  -4.541  -0.047   3.839
  117   1HB   SER  17          2HB       SER  17  -4.674   1.901   5.707
  118   2HB   SER  17          1HB       SER  17  -5.929   0.680   5.495
  119    HG   SER  17           HG       SER  17  -3.794   0.643   7.361
  120    H    PHE  18           H        PHE  18  -3.793   2.168   3.324
  121    HA   PHE  18           HA       PHE  18  -1.022   2.711   4.056
  122   1HB   PHE  18          2HB       PHE  18  -2.071   2.402   1.240
  123   2HB   PHE  18          1HB       PHE  18  -0.530   3.154   1.625
  124    HD1  PHE  18           1HD      PHE  18   1.249   1.773   2.736
  125    HD2  PHE  18           2HD      PHE  18  -2.314   0.078   1.141
  126    HE1  PHE  18           1HE      PHE  18   2.312  -0.448   2.726
  127    HE2  PHE  18           2HE      PHE  18  -1.259  -2.144   1.129
  128    HZ   PHE  18           HZ       PHE  18   1.056  -2.410   1.922
  129    H    ASN  19           H        ASN  19  -0.574   4.848   4.233
  130    HA   ASN  19           HA       ASN  19  -2.801   6.690   3.979
  131   1HB   ASN  19          2HB       ASN  19  -0.129   6.749   5.307
  132   2HB   ASN  19          1HB       ASN  19  -0.890   8.284   4.900
  133   1HD2  ASN  19          1HD2      ASN  19  -0.448   6.257   7.340
  134   2HD2  ASN  19          2HD2      ASN  19  -1.906   6.499   8.235
  135    H    TYR  20           H        TYR  20  -0.887   5.550   1.724
  136    HA   TYR  20           HA       TYR  20  -1.020   7.951   0.130
  137   1HB   TYR  20          2HB       TYR  20   1.572   6.801   1.079
  138   2HB   TYR  20          1HB       TYR  20   1.488   7.479  -0.543
  139    HD1  TYR  20           1HD      TYR  20   0.794   9.891  -0.812
  140    HD2  TYR  20           2HD      TYR  20   1.745   8.197   2.972
  141    HE1  TYR  20           1HE      TYR  20   1.115  12.148   0.110
  142    HE2  TYR  20           2HE      TYR  20   2.067  10.449   3.905
  143    HH   TYR  20           HH       TYR  20   2.272  13.236   1.952
  144    H    VAL  21           H        VAL  21  -1.567   7.424  -1.892
  145    HA   VAL  21           HA       VAL  21  -2.135   4.836  -2.701
  146    HB   VAL  21           HB       VAL  21  -1.391   7.048  -4.612
  147   1HG1  VAL  21          1HG1      VAL  21  -3.409   4.825  -4.881
  148   2HG1  VAL  21          2HG1      VAL  21  -1.768   4.764  -5.524
  149   3HG1  VAL  21          3HG1      VAL  21  -2.907   5.969  -6.125
  150   1HG2  VAL  21          1HG2      VAL  21  -3.872   6.658  -2.973
  151   2HG2  VAL  21          2HG2      VAL  21  -3.915   7.512  -4.515
  152   3HG2  VAL  21          3HG2      VAL  21  -2.911   8.119  -3.198
  153    H    LYS  22           H        LYS  22   0.856   6.608  -2.848
  154    HA   LYS  22           HA       LYS  22   2.206   4.987  -4.732
  155   1HB   LYS  22          2HB       LYS  22   3.204   6.770  -2.509
  156   2HB   LYS  22          1HB       LYS  22   4.282   5.931  -3.616
  157   1HG   LYS  22          2HG       LYS  22   4.146   7.850  -4.773
  158   2HG   LYS  22          1HG       LYS  22   2.649   7.140  -5.380
  159   1HD   LYS  22          2HD       LYS  22   1.355   8.347  -3.750
  160   2HD   LYS  22          1HD       LYS  22   2.820   8.950  -2.974
  161   1HE   LYS  22          2HE       LYS  22   3.238   9.804  -5.490
  162   2HE   LYS  22          1HE       LYS  22   1.475   9.834  -5.449
  163   1HZ   LYS  22          1HZ       LYS  22   3.393  11.493  -4.031
  164   2HZ   LYS  22          2HZ       LYS  22   2.039  11.016  -3.138
  165   3HZ   LYS  22          3HZ       LYS  22   1.838  11.866  -4.587
  166    H    THR  23           H        THR  23   1.825   4.821  -1.233
  167    HA   THR  23           HA       THR  23   3.657   2.692  -0.839
  168    HB   THR  23           HB       THR  23   1.355   2.942   1.011
  169    HG1  THR  23           1HG      THR  23   3.239   5.031   0.664
  170   1HG2  THR  23          1HG2      THR  23   3.271   1.606   1.653
  171   2HG2  THR  23          2HG2      THR  23   3.103   3.009   2.709
  172   3HG2  THR  23          3HG2      THR  23   4.330   2.999   1.442
  173    H    TYR  24           H        TYR  24   0.186   2.847  -1.432
  174    HA   TYR  24           HA       TYR  24  -0.351   0.103  -1.082
  175   1HB   TYR  24          2HB       TYR  24  -2.056   1.956  -1.217
  176   2HB   TYR  24          1HB       TYR  24  -1.791   1.989  -2.955
  177    HD1  TYR  24           1HD      TYR  24  -3.839   1.266  -3.826
  178    HD2  TYR  24           2HD      TYR  24  -1.993  -0.974  -0.714
  179    HE1  TYR  24           1HE      TYR  24  -5.515  -0.509  -4.117
  180    HE2  TYR  24           2HE      TYR  24  -3.663  -2.755  -0.999
  181    HH   TYR  24           HH       TYR  24  -5.465  -3.197  -3.563
  182    H    LEU  25           H        LEU  25   0.975   1.957  -3.707
  183    HA   LEU  25           HA       LEU  25   0.698  -0.111  -5.683
  184   1HB   LEU  25          2HB       LEU  25   2.228   2.475  -5.551
  185   2HB   LEU  25          1HB       LEU  25   2.459   1.354  -6.878
  186    HG   LEU  25           HG       LEU  25  -0.237   2.488  -6.152
  187   1HD1  LEU  25          1HD1      LEU  25   1.441   3.474  -8.425
  188   2HD1  LEU  25          2HD1      LEU  25   1.587   4.183  -6.818
  189   3HD1  LEU  25          3HD1      LEU  25   0.040   4.227  -7.663
  190   1HD2  LEU  25          1HD2      LEU  25  -0.851   1.771  -8.383
  191   2HD2  LEU  25          2HD2      LEU  25  -0.211   0.407  -7.466
  192   3HD2  LEU  25          3HD2      LEU  25   0.792   1.202  -8.679
  193    H    ALA  26           H        ALA  26   3.263   1.113  -3.593
  194    HA   ALA  26           HA       ALA  26   5.323  -0.551  -4.496
  195   1HB   ALA  26          1HB       ALA  26   5.995   1.254  -3.177
  196   2HB   ALA  26          2HB       ALA  26   6.248  -0.146  -2.135
  197   3HB   ALA  26          3HB       ALA  26   4.830   0.878  -1.906
  198    H    HIS  27           H        HIS  27   2.676  -1.096  -2.263
  199    HA   HIS  27           HA       HIS  27   3.719  -3.497  -1.135
  200   1HB   HIS  27          2HB       HIS  27   2.046  -2.358   0.123
  201   2HB   HIS  27          1HB       HIS  27   0.938  -2.326  -1.245
  202    HD1  HIS  27           1HD      HIS  27   2.470  -4.838   1.170
  203    HD2  HIS  27           2HD      HIS  27  -0.777  -4.413  -1.385
  204    HE1  HIS  27           1HE      HIS  27   1.015  -6.876   1.522
  205    H    LYS  28           H        LYS  28   1.361  -2.834  -3.712
  206    HA   LYS  28           HA       LYS  28   0.861  -5.555  -4.317
  207   1HB   LYS  28          2HB       LYS  28  -0.395  -3.309  -4.984
  208   2HB   LYS  28          1HB       LYS  28   0.591  -3.472  -6.431
  209   1HG   LYS  28          2HG       LYS  28  -0.321  -5.770  -6.713
  210   2HG   LYS  28          1HG       LYS  28  -1.410  -5.448  -5.362
  211   1HD   LYS  28          2HD       LYS  28  -2.666  -4.994  -7.303
  212   2HD   LYS  28          1HD       LYS  28  -2.192  -3.416  -6.671
  213   1HE   LYS  28          2HE       LYS  28  -1.771  -3.244  -8.957
  214   2HE   LYS  28          1HE       LYS  28  -0.189  -3.604  -8.267
  215   1HZ   LYS  28          1HZ       LYS  28  -1.909  -5.792  -9.228
  216   2HZ   LYS  28          2HZ       LYS  28  -0.224  -5.742  -9.085
  217   3HZ   LYS  28          3HZ       LYS  28  -0.991  -4.895 -10.331
  218    H    GLN  29           H        GLN  29   3.344  -3.315  -5.267
  219    HA   GLN  29           HA       GLN  29   4.251  -4.949  -7.475
  220   1HB   GLN  29          2HB       GLN  29   4.417  -2.303  -7.010
  221   2HB   GLN  29          1HB       GLN  29   5.992  -2.806  -6.409
  222   1HG   GLN  29          2HG       GLN  29   6.624  -2.528  -8.534
  223   2HG   GLN  29          1HG       GLN  29   5.918  -4.128  -8.760
  224   1HE2  GLN  29          1HE2      GLN  29   3.262  -3.628  -8.730
  225   2HE2  GLN  29          2HE2      GLN  29   2.824  -2.612 -10.056
  226    H    PHE  30           H        PHE  30   4.785  -4.863  -4.099
  227    HA   PHE  30           HA       PHE  30   7.272  -6.411  -4.430
  228   1HB   PHE  30          2HB       PHE  30   6.416  -4.409  -2.409
  229   2HB   PHE  30          1HB       PHE  30   7.383  -5.762  -1.836
  230    HD1  PHE  30           1HD      PHE  30   7.438  -2.566  -3.374
  231    HD2  PHE  30           2HD      PHE  30   9.590  -6.222  -3.060
  232    HE1  PHE  30           1HE      PHE  30   9.479  -1.425  -4.138
  233    HE2  PHE  30           2HE      PHE  30  11.636  -5.088  -3.823
  234    HZ   PHE  30           HZ       PHE  30  11.582  -2.686  -4.364
  235    H    TYR  31           H        TYR  31   4.364  -6.151  -2.387
  236    HA   TYR  31           HA       TYR  31   4.761  -8.724  -1.205
  237   1HB   TYR  31          2HB       TYR  31   3.404  -6.615  -0.364
  238   2HB   TYR  31          1HB       TYR  31   2.082  -7.403  -1.220
  239    HD1  TYR  31           1HD      TYR  31   4.529  -7.803   1.523
  240    HD2  TYR  31           2HD      TYR  31   1.000  -9.313  -0.313
  241    HE1  TYR  31           1HE      TYR  31   4.144  -9.256   3.470
  242    HE2  TYR  31           2HE      TYR  31   0.606 -10.769   1.629
  243    HH   TYR  31           HH       TYR  31   1.943 -11.806   3.454
  244    H    HIS  32           H        HIS  32   2.846  -7.470  -3.876
  245    HA   HIS  32           HA       HIS  32   1.961 -10.218  -4.463
  246   1HB   HIS  32          2HB       HIS  32   0.701  -7.602  -5.312
  247   2HB   HIS  32          1HB       HIS  32   0.108  -9.205  -5.730
  248    HD1  HIS  32           1HD      HIS  32  -1.313 -10.420  -3.972
  249    HD2  HIS  32           2HD      HIS  32   0.356  -6.869  -2.602
  250    HE1  HIS  32           1HE      HIS  32  -2.424  -9.919  -1.753
  251    H    LYS  33           H        LYS  33   4.468  -9.761  -5.223
  252    HA   LYS  33           HA       LYS  33   4.249  -9.686  -8.131
  253   1HB   LYS  33          2HB       LYS  33   5.026  -7.415  -6.974
  254   2HB   LYS  33          1HB       LYS  33   6.577  -8.243  -6.964
  255   1HG   LYS  33          2HG       LYS  33   5.018  -8.170  -9.495
  256   2HG   LYS  33          1HG       LYS  33   5.861  -6.712  -8.968
  257   1HD   LYS  33          2HD       LYS  33   7.834  -8.475  -8.621
  258   2HD   LYS  33          1HD       LYS  33   6.946  -9.312  -9.896
  259   1HE   LYS  33          2HE       LYS  33   7.474  -7.767 -11.458
  260   2HE   LYS  33          1HE       LYS  33   7.383  -6.428 -10.316
  261   1HZ   LYS  33          1HZ       LYS  33   9.556  -6.609  -9.792
  262   2HZ   LYS  33          2HZ       LYS  33   9.661  -7.304 -11.330
  263   3HZ   LYS  33          3HZ       LYS  33   9.590  -8.293  -9.960
  264    H    ASN  34           H        ASN  34   4.458 -11.994  -6.918
  265    HA   ASN  34           HA       ASN  34   5.672 -13.912  -6.749
  266   1HB   ASN  34          2HB       ASN  34   7.250 -12.294  -8.707
  267   2HB   ASN  34          1HB       ASN  34   7.942 -13.794  -8.095
  268   1HD2  ASN  34          1HD2      ASN  34   5.929 -15.498  -7.941
  269   2HD2  ASN  34          2HD2      ASN  34   5.182 -15.744  -9.479
  270    H    LYS  35           H        LYS  35   5.948 -11.982  -4.676
  271    HA   LYS  35           HA       LYS  35   8.320 -13.003  -3.422
  272   1HB   LYS  35          2HB       LYS  35   8.801 -10.791  -4.878
  273   2HB   LYS  35          1HB       LYS  35   8.274 -10.037  -3.381
  274   1HG   LYS  35          2HG       LYS  35  10.709 -10.302  -3.501
  275   2HG   LYS  35          1HG       LYS  35  10.001 -11.184  -2.146
  276   1HD   LYS  35          2HD       LYS  35  10.505 -13.216  -3.032
  277   2HD   LYS  35          1HD       LYS  35  10.305 -12.661  -4.695
  278   1HE   LYS  35          2HE       LYS  35  12.462 -11.249  -4.091
  279   2HE   LYS  35          1HE       LYS  35  12.687 -12.548  -2.920
  280   1HZ   LYS  35          1HZ       LYS  35  13.719 -12.814  -5.222
  281   2HZ   LYS  35          2HZ       LYS  35  12.149 -13.134  -5.765
  282   3HZ   LYS  35          3HZ       LYS  35  12.858 -14.129  -4.595
  283    HA   PRO  36           HA       PRO  36   5.535 -12.473  -0.003
  284   1HB   PRO  36          2HB       PRO  36   7.259 -12.966   2.028
  285   2HB   PRO  36          1HB       PRO  36   6.630 -14.240   0.979
  286   1HG   PRO  36          2HG       PRO  36   9.267 -12.829   0.870
  287   2HG   PRO  36          1HG       PRO  36   8.915 -14.556   0.681
  288   1HD   PRO  36          2HD       PRO  36   9.353 -12.917  -1.431
  289   2HD   PRO  36          1HD       PRO  36   8.257 -14.311  -1.514
  Start of MODEL    5
    1   1H    GLY   1          1HT       GLY   1  -6.851   3.112  12.464
    2   2H    GLY   1          2HT       GLY   1  -8.077   1.950  12.383
    3   3H    GLY   1          3HT       GLY   1  -7.402   2.363  13.878
    4   1HA   GLY   1          1HA       GLY   1  -9.690   3.343  13.169
    5   2HA   GLY   1          2HA       GLY   1  -8.522   4.324  14.041
    6    H    SER   2           H        SER   2  -6.774   5.213  12.312
    7    HA   SER   2           HA       SER   2  -8.122   7.194  10.863
    8   1HB   SER   2          2HB       SER   2  -5.563   6.876  11.669
    9   2HB   SER   2          1HB       SER   2  -5.389   6.482   9.959
   10    HG   SER   2           HG       SER   2  -5.270   8.815  10.773
   11    H    ALA   3           H        ALA   3  -9.137   7.126   8.977
   12    HA   ALA   3           HA       ALA   3  -9.855   6.460   6.923
   13   1HB   ALA   3          1HB       ALA   3  -7.186   6.712   6.691
   14   2HB   ALA   3          2HB       ALA   3  -8.244   6.257   5.355
   15   3HB   ALA   3          3HB       ALA   3  -7.374   5.014   6.253
   16    H    ALA   4           H        ALA   4 -11.426   5.001   7.490
   17    HA   ALA   4           HA       ALA   4 -10.639   2.166   7.355
   18   1HB   ALA   4          1HB       ALA   4 -11.145   2.243   9.582
   19   2HB   ALA   4          2HB       ALA   4 -12.746   1.907   8.923
   20   3HB   ALA   4          3HB       ALA   4 -12.311   3.552   9.386
   21    H    GLU   5           H        GLU   5 -11.540   3.836   5.218
   22    HA   GLU   5           HA       GLU   5 -13.256   2.257   3.835
   23   1HB   GLU   5          2HB       GLU   5 -14.709   3.849   5.818
   24   2HB   GLU   5          1HB       GLU   5 -15.316   4.068   4.183
   25   1HG   GLU   5          2HG       GLU   5 -14.934   1.305   4.532
   26   2HG   GLU   5          1HG       GLU   5 -15.726   1.897   5.990
   27    H    VAL   6           H        VAL   6 -11.328   3.413   2.767
   28    HA   VAL   6           HA       VAL   6 -12.280   5.886   1.474
   29    HB   VAL   6           HB       VAL   6  -9.404   4.999   1.696
   30   1HG1  VAL   6          1HG1      VAL   6  -8.843   7.160   0.908
   31   2HG1  VAL   6          2HG1      VAL   6 -10.500   7.735   1.090
   32   3HG1  VAL   6          3HG1      VAL   6 -10.108   6.557  -0.163
   33   1HG2  VAL   6          1HG2      VAL   6 -10.924   6.963   3.411
   34   2HG2  VAL   6          2HG2      VAL   6  -9.176   6.728   3.439
   35   3HG2  VAL   6          3HG2      VAL   6 -10.250   5.417   3.929
   36    H    MET   7           H        MET   7 -10.713   2.767   0.983
   37    HA   MET   7           HA       MET   7 -10.478   1.443  -0.850
   38   1HB   MET   7          2HB       MET   7 -12.986   2.108  -0.972
   39   2HB   MET   7          1HB       MET   7 -12.485   3.137  -2.306
   40   1HG   MET   7          2HG       MET   7 -13.063   1.269  -3.456
   41   2HG   MET   7          1HG       MET   7 -11.362   0.915  -3.156
   42   1HE   MET   7          1HE       MET   7 -12.301  -1.858  -3.724
   43   2HE   MET   7          2HE       MET   7 -11.773  -2.590  -2.209
   44   3HE   MET   7          3HE       MET   7 -10.834  -1.283  -2.931
   45    H    LYS   8           H        LYS   8  -8.348   2.249  -1.178
   46    HA   LYS   8           HA       LYS   8  -7.810   3.116  -3.778
   47   1HB   LYS   8          2HB       LYS   8  -6.832   5.375  -3.234
   48   2HB   LYS   8          1HB       LYS   8  -8.588   5.291  -3.203
   49   1HG   LYS   8          2HG       LYS   8  -8.659   5.372  -0.860
   50   2HG   LYS   8          1HG       LYS   8  -6.940   5.001  -0.713
   51   1HD   LYS   8          2HD       LYS   8  -7.235   7.333  -0.262
   52   2HD   LYS   8          1HD       LYS   8  -6.451   7.178  -1.836
   53   1HE   LYS   8          2HE       LYS   8  -9.391   7.244  -1.897
   54   2HE   LYS   8          1HE       LYS   8  -8.619   8.730  -1.347
   55   1HZ   LYS   8          1HZ       LYS   8  -8.467   7.420  -3.968
   56   2HZ   LYS   8          2HZ       LYS   8  -7.149   8.341  -3.443
   57   3HZ   LYS   8          3HZ       LYS   8  -8.674   9.057  -3.594
   58    H    LYS   9           H        LYS   9  -6.705   3.050  -0.431
   59    HA   LYS   9           HA       LYS   9  -4.148   1.960  -1.374
   60   1HB   LYS   9          2HB       LYS   9  -3.794   3.477   1.066
   61   2HB   LYS   9          1HB       LYS   9  -2.906   3.578  -0.446
   62   1HG   LYS   9          2HG       LYS   9  -4.907   4.958  -1.284
   63   2HG   LYS   9          1HG       LYS   9  -5.326   5.109   0.423
   64   1HD   LYS   9          2HD       LYS   9  -2.629   5.693   0.373
   65   2HD   LYS   9          1HD       LYS   9  -3.235   6.430  -1.111
   66   1HE   LYS   9          2HE       LYS   9  -3.270   7.917   0.908
   67   2HE   LYS   9          1HE       LYS   9  -4.818   7.737   0.085
   68   1HZ   LYS   9          1HZ       LYS   9  -4.496   7.453   2.712
   69   2HZ   LYS   9          2HZ       LYS   9  -4.307   5.845   2.223
   70   3HZ   LYS   9          3HZ       LYS   9  -5.723   6.684   1.835
   71    H    TYR  10           H        TYR  10  -6.347   0.501  -0.516
   72    HA   TYR  10           HA       TYR  10  -5.304  -0.651   1.985
   73   1HB   TYR  10          2HB       TYR  10  -7.457   0.672   2.294
   74   2HB   TYR  10          1HB       TYR  10  -8.244  -0.547   1.298
   75    HD1  TYR  10           1HD      TYR  10  -7.609   0.415   4.573
   76    HD2  TYR  10           2HD      TYR  10  -7.721  -3.059   2.120
   77    HE1  TYR  10           1HE      TYR  10  -7.953  -0.978   6.570
   78    HE2  TYR  10           2HE      TYR  10  -8.067  -4.460   4.109
   79    HH   TYR  10           HH       TYR  10  -8.910  -3.197   7.125
   80    H    CYS  11           H        CYS  11  -4.936  -2.795   1.892
   81    HA   CYS  11           HA       CYS  11  -5.521  -4.151  -0.602
   82   1HB   CYS  11          2HB       CYS  11  -3.310  -4.343   0.636
   83   2HB   CYS  11          1HB       CYS  11  -4.151  -5.359   1.798
   84    H    SER  12           H        SER  12  -7.165  -5.441  -0.961
   85    HA   SER  12           HA       SER  12  -9.000  -6.092   1.186
   86   1HB   SER  12          2HB       SER  12  -9.104  -6.117  -1.793
   87   2HB   SER  12          1HB       SER  12 -10.194  -7.198  -0.923
   88    HG   SER  12           HG       SER  12  -9.964  -4.421  -0.398
   89    H    THR  13           H        THR  13  -6.291  -7.442   0.779
   90    HA   THR  13           HA       THR  13  -7.303 -10.176   0.999
   91    HB   THR  13           HB       THR  13  -4.810  -9.363  -0.502
   92    HG1  THR  13           1HG      THR  13  -7.353 -10.243  -1.366
   93   1HG2  THR  13          1HG2      THR  13  -4.127 -11.451  -0.304
   94   2HG2  THR  13          2HG2      THR  13  -5.578 -11.976  -1.157
   95   3HG2  THR  13          3HG2      THR  13  -5.574 -11.882   0.604
   96    H    CYS  14           H        CYS  14  -4.816  -7.818   1.776
   97    HA   CYS  14           HA       CYS  14  -3.757  -9.623   3.839
   98   1HB   CYS  14          2HB       CYS  14  -2.636  -6.996   2.848
   99   2HB   CYS  14          1HB       CYS  14  -1.858  -8.095   3.979
  100    H    ASP  15           H        ASP  15  -6.116  -7.371   3.610
  101    HA   ASP  15           HA       ASP  15  -7.200  -5.992   5.052
  102   1HB   ASP  15          2HB       ASP  15  -5.886  -7.838   7.054
  103   2HB   ASP  15          1HB       ASP  15  -7.196  -6.722   7.422
  104    H    ILE  16           H        ILE  16  -4.794  -4.973   4.120
  105    HA   ILE  16           HA       ILE  16  -3.747  -3.531   6.468
  106    HB   ILE  16           HB       ILE  16  -2.285  -3.755   3.850
  107   1HG1  ILE  16          2HG1      ILE  16  -2.722  -6.042   4.669
  108   2HG1  ILE  16          1HG1      ILE  16  -1.014  -5.629   4.768
  109   1HG2  ILE  16          1HG2      ILE  16  -0.333  -3.432   5.463
  110   2HG2  ILE  16          2HG2      ILE  16  -1.553  -2.997   6.661
  111   3HG2  ILE  16          3HG2      ILE  16  -1.391  -2.049   5.182
  112   1HD1  ILE  16          1HD1      ILE  16  -1.156  -5.314   7.125
  113   2HD1  ILE  16          2HD1      ILE  16  -1.899  -6.864   6.732
  114   3HD1  ILE  16          3HD1      ILE  16  -2.913  -5.466   7.091
  115    H    SER  17           H        SER  17  -3.042  -1.295   6.028
  116    HA   SER  17           HA       SER  17  -4.596  -0.031   3.874
  117   1HB   SER  17          2HB       SER  17  -4.678   1.912   5.738
  118   2HB   SER  17          1HB       SER  17  -5.932   0.683   5.587
  119    HG   SER  17           HG       SER  17  -4.589   1.174   7.713
  120    H    PHE  18           H        PHE  18  -3.825   2.178   3.346
  121    HA   PHE  18           HA       PHE  18  -1.024   2.657   4.019
  122   1HB   PHE  18          2HB       PHE  18  -2.159   2.389   1.235
  123   2HB   PHE  18          1HB       PHE  18  -0.606   3.140   1.572
  124    HD1  PHE  18           1HD      PHE  18   1.018   1.657   3.045
  125    HD2  PHE  18           2HD      PHE  18  -2.212   0.164   0.712
  126    HE1  PHE  18           1HE      PHE  18   2.082  -0.562   2.998
  127    HE2  PHE  18           2HE      PHE  18  -1.157  -2.058   0.664
  128    HZ   PHE  18           HZ       PHE  18   0.992  -2.423   1.807
  129    H    ASN  19           H        ASN  19  -0.537   4.762   4.267
  130    HA   ASN  19           HA       ASN  19  -2.704   6.682   4.023
  131   1HB   ASN  19          2HB       ASN  19  -0.090   6.589   5.450
  132   2HB   ASN  19          1HB       ASN  19  -0.739   8.173   5.036
  133   1HD2  ASN  19          1HD2      ASN  19  -0.432   7.672   7.614
  134   2HD2  ASN  19          2HD2      ASN  19  -1.948   7.378   8.390
  135    H    TYR  20           H        TYR  20  -0.786   5.536   1.787
  136    HA   TYR  20           HA       TYR  20  -0.766   7.988   0.269
  137   1HB   TYR  20          2HB       TYR  20   1.761   6.636   1.166
  138   2HB   TYR  20          1HB       TYR  20   1.713   7.502  -0.365
  139    HD1  TYR  20           1HD      TYR  20   1.133   9.956  -0.354
  140    HD2  TYR  20           2HD      TYR  20   1.970   7.792   3.212
  141    HE1  TYR  20           1HE      TYR  20   1.543  12.074   0.827
  142    HE2  TYR  20           2HE      TYR  20   2.382   9.903   4.404
  143    HH   TYR  20           HH       TYR  20   1.457  12.877   3.252
  144    H    VAL  21           H        VAL  21  -1.298   7.550  -1.776
  145    HA   VAL  21           HA       VAL  21  -1.984   5.032  -2.683
  146    HB   VAL  21           HB       VAL  21  -1.074   7.288  -4.471
  147   1HG1  VAL  21          1HG1      VAL  21  -3.027   5.030  -4.909
  148   2HG1  VAL  21          2HG1      VAL  21  -1.419   5.171  -5.619
  149   3HG1  VAL  21          3HG1      VAL  21  -2.678   6.324  -6.055
  150   1HG2  VAL  21          1HG2      VAL  21  -3.664   6.868  -3.008
  151   2HG2  VAL  21          2HG2      VAL  21  -3.564   7.844  -4.473
  152   3HG2  VAL  21          3HG2      VAL  21  -2.637   8.302  -3.043
  153    H    LYS  22           H        LYS  22   1.111   6.634  -2.738
  154    HA   LYS  22           HA       LYS  22   2.388   4.978  -4.638
  155   1HB   LYS  22          2HB       LYS  22   4.467   5.877  -3.783
  156   2HB   LYS  22          1HB       LYS  22   3.277   7.167  -3.901
  157   1HG   LYS  22          2HG       LYS  22   2.933   6.277  -1.333
  158   2HG   LYS  22          1HG       LYS  22   4.673   6.108  -1.573
  159   1HD   LYS  22          2HD       LYS  22   3.472   8.627  -2.535
  160   2HD   LYS  22          1HD       LYS  22   3.484   8.396  -0.785
  161   1HE   LYS  22          2HE       LYS  22   5.491   9.578  -1.743
  162   2HE   LYS  22          1HE       LYS  22   5.840   8.171  -0.740
  163   1HZ   LYS  22          1HZ       LYS  22   6.365   6.888  -2.604
  164   2HZ   LYS  22          2HZ       LYS  22   7.099   8.381  -2.911
  165   3HZ   LYS  22          3HZ       LYS  22   5.650   7.977  -3.685
  166    H    THR  23           H        THR  23   1.783   4.660  -1.206
  167    HA   THR  23           HA       THR  23   3.569   2.474  -0.808
  168    HB   THR  23           HB       THR  23   1.216   2.727   0.970
  169    HG1  THR  23           1HG      THR  23   1.768   4.680   1.754
  170   1HG2  THR  23          1HG2      THR  23   3.114   1.327   1.594
  171   2HG2  THR  23          2HG2      THR  23   2.881   2.658   2.728
  172   3HG2  THR  23          3HG2      THR  23   4.172   2.736   1.529
  173    H    TYR  24           H        TYR  24   0.130   2.770  -1.523
  174    HA   TYR  24           HA       TYR  24  -0.507   0.033  -1.295
  175   1HB   TYR  24          2HB       TYR  24  -2.196   1.841  -1.385
  176   2HB   TYR  24          1HB       TYR  24  -1.788   2.121  -3.072
  177    HD1  TYR  24           1HD      TYR  24  -3.576   1.458  -4.380
  178    HD2  TYR  24           2HD      TYR  24  -2.377  -1.021  -1.136
  179    HE1  TYR  24           1HE      TYR  24  -5.232  -0.229  -5.064
  180    HE2  TYR  24           2HE      TYR  24  -4.027  -2.714  -1.812
  181    HH   TYR  24           HH       TYR  24  -6.413  -2.479  -3.273
  182    H    LEU  25           H        LEU  25   0.947   1.954  -3.796
  183    HA   LEU  25           HA       LEU  25   0.691  -0.022  -5.865
  184   1HB   LEU  25          2HB       LEU  25   2.137   2.576  -5.558
  185   2HB   LEU  25          1HB       LEU  25   2.613   1.490  -6.850
  186    HG   LEU  25           HG       LEU  25  -0.276   2.165  -6.591
  187   1HD1  LEU  25          1HD1      LEU  25   0.996   4.309  -6.339
  188   2HD1  LEU  25          2HD1      LEU  25  -0.056   4.229  -7.753
  189   3HD1  LEU  25          3HD1      LEU  25   1.684   4.011  -7.935
  190   1HD2  LEU  25          1HD2      LEU  25   1.178   2.183  -9.158
  191   2HD2  LEU  25          2HD2      LEU  25  -0.388   1.485  -8.742
  192   3HD2  LEU  25          3HD2      LEU  25   1.099   0.635  -8.317
  193    H    ALA  26           H        ALA  26   3.196   1.019  -3.618
  194    HA   ALA  26           HA       ALA  26   5.237  -0.666  -4.567
  195   1HB   ALA  26          1HB       ALA  26   5.717   1.262  -3.173
  196   2HB   ALA  26          2HB       ALA  26   6.341  -0.207  -2.423
  197   3HB   ALA  26          3HB       ALA  26   4.852   0.524  -1.825
  198    H    HIS  27           H        HIS  27   2.561  -1.176  -2.366
  199    HA   HIS  27           HA       HIS  27   3.567  -3.592  -1.231
  200   1HB   HIS  27          2HB       HIS  27   1.906  -2.383   0.002
  201   2HB   HIS  27          1HB       HIS  27   0.785  -2.418  -1.356
  202    HD1  HIS  27           1HD      HIS  27   2.351  -4.789   1.174
  203    HD2  HIS  27           2HD      HIS  27  -0.880  -4.549  -1.424
  204    HE1  HIS  27           1HE      HIS  27   0.927  -6.834   1.616
  205    H    LYS  28           H        LYS  28   1.461  -2.837  -3.963
  206    HA   LYS  28           HA       LYS  28   0.824  -5.572  -4.519
  207   1HB   LYS  28          2HB       LYS  28  -0.417  -3.354  -5.199
  208   2HB   LYS  28          1HB       LYS  28   0.647  -3.426  -6.597
  209   1HG   LYS  28          2HG       LYS  28  -0.786  -5.915  -5.937
  210   2HG   LYS  28          1HG       LYS  28  -1.776  -4.569  -6.506
  211   1HD   LYS  28          2HD       LYS  28   0.713  -5.177  -8.005
  212   2HD   LYS  28          1HD       LYS  28  -0.635  -6.303  -8.172
  213   1HE   LYS  28          2HE       LYS  28  -0.624  -3.349  -8.766
  214   2HE   LYS  28          1HE       LYS  28  -0.803  -4.673  -9.917
  215   1HZ   LYS  28          1HZ       LYS  28  -2.756  -3.552  -8.053
  216   2HZ   LYS  28          2HZ       LYS  28  -2.843  -5.212  -8.368
  217   3HZ   LYS  28          3HZ       LYS  28  -2.968  -4.103  -9.639
  218    H    GLN  29           H        GLN  29   3.246  -3.284  -5.623
  219    HA   GLN  29           HA       GLN  29   4.238  -5.085  -7.662
  220   1HB   GLN  29          2HB       GLN  29   4.269  -2.374  -7.410
  221   2HB   GLN  29          1HB       GLN  29   5.899  -2.777  -6.891
  222   1HG   GLN  29          2HG       GLN  29   5.845  -4.251  -9.084
  223   2HG   GLN  29          1HG       GLN  29   4.623  -3.069  -9.551
  224   1HE2  GLN  29          1HE2      GLN  29   5.282  -0.757  -9.211
  225   2HE2  GLN  29          2HE2      GLN  29   6.904  -0.335  -9.628
  226    H    PHE  30           H        PHE  30   4.703  -4.715  -4.329
  227    HA   PHE  30           HA       PHE  30   7.326  -6.047  -4.491
  228   1HB   PHE  30          2HB       PHE  30   7.139  -3.758  -3.336
  229   2HB   PHE  30          1HB       PHE  30   6.295  -4.616  -2.051
  230    HD1  PHE  30           1HD      PHE  30   9.424  -4.913  -4.064
  231    HD2  PHE  30           2HD      PHE  30   7.539  -5.351  -0.273
  232    HE1  PHE  30           1HE      PHE  30  11.586  -5.531  -3.065
  233    HE2  PHE  30           2HE      PHE  30   9.697  -5.968   0.733
  234    HZ   PHE  30           HZ       PHE  30  11.725  -6.060  -0.662
  235    H    TYR  31           H        TYR  31   4.361  -5.906  -2.511
  236    HA   TYR  31           HA       TYR  31   4.938  -8.378  -1.192
  237   1HB   TYR  31          2HB       TYR  31   3.474  -6.393  -0.377
  238   2HB   TYR  31          1HB       TYR  31   2.200  -7.150  -1.325
  239    HD1  TYR  31           1HD      TYR  31   4.040  -7.203   1.763
  240    HD2  TYR  31           2HD      TYR  31   1.522  -9.519  -0.766
  241    HE1  TYR  31           1HE      TYR  31   3.549  -8.710   3.643
  242    HE2  TYR  31           2HE      TYR  31   1.024 -11.032   1.108
  243    HH   TYR  31           HH       TYR  31   1.041 -11.007   3.551
  244    H    HIS  32           H        HIS  32   2.608  -7.406  -3.700
  245    HA   HIS  32           HA       HIS  32   2.009 -10.228  -4.199
  246   1HB   HIS  32          2HB       HIS  32   0.681  -7.716  -5.236
  247   2HB   HIS  32          1HB       HIS  32   0.163  -9.357  -5.604
  248    HD1  HIS  32           1HD      HIS  32  -1.359 -10.487  -3.904
  249    HD2  HIS  32           2HD      HIS  32   0.328  -6.959  -2.502
  250    HE1  HIS  32           1HE      HIS  32  -2.509  -9.970  -1.708
  251    H    LYS  33           H        LYS  33   4.555  -9.497  -4.940
  252    HA   LYS  33           HA       LYS  33   4.407  -9.884  -7.826
  253   1HB   LYS  33          2HB       LYS  33   4.682  -7.441  -7.458
  254   2HB   LYS  33          1HB       LYS  33   6.171  -7.768  -6.582
  255   1HG   LYS  33          2HG       LYS  33   7.341  -8.264  -8.472
  256   2HG   LYS  33          1HG       LYS  33   5.916  -8.844  -9.336
  257   1HD   LYS  33          2HD       LYS  33   5.132  -6.420  -9.339
  258   2HD   LYS  33          1HD       LYS  33   6.773  -6.005  -8.839
  259   1HE   LYS  33          2HE       LYS  33   7.431  -7.506 -10.892
  260   2HE   LYS  33          1HE       LYS  33   5.795  -7.122 -11.425
  261   1HZ   LYS  33          1HZ       LYS  33   6.296  -4.923 -11.684
  262   2HZ   LYS  33          2HZ       LYS  33   7.796  -5.603 -12.067
  263   3HZ   LYS  33          3HZ       LYS  33   7.537  -4.936 -10.534
  264    H    ASN  34           H        ASN  34   4.955 -11.804  -5.945
  265    HA   ASN  34           HA       ASN  34   7.573 -12.650  -6.767
  266   1HB   ASN  34          2HB       ASN  34   8.008 -11.167  -4.767
  267   2HB   ASN  34          1HB       ASN  34   7.106 -12.330  -3.798
  268   1HD2  ASN  34          1HD2      ASN  34   8.716 -13.077  -2.539
  269   2HD2  ASN  34          2HD2      ASN  34  10.105 -13.916  -3.130
  270    H    LYS  35           H        LYS  35   4.988 -13.659  -7.182
  271    HA   LYS  35           HA       LYS  35   3.833 -15.617  -7.166
  272   1HB   LYS  35          2HB       LYS  35   6.546 -16.476  -6.236
  273   2HB   LYS  35          1HB       LYS  35   5.219 -17.630  -6.196
  274   1HG   LYS  35          2HG       LYS  35   5.348 -16.245  -8.731
  275   2HG   LYS  35          1HG       LYS  35   6.866 -17.058  -8.348
  276   1HD   LYS  35          2HD       LYS  35   4.444 -18.636  -7.817
  277   2HD   LYS  35          1HD       LYS  35   4.725 -18.255  -9.517
  278   1HE   LYS  35          2HE       LYS  35   5.817 -20.308  -9.138
  279   2HE   LYS  35          1HE       LYS  35   7.091 -19.091  -9.167
  280   1HZ   LYS  35          1HZ       LYS  35   7.275 -19.158  -6.831
  281   2HZ   LYS  35          2HZ       LYS  35   7.232 -20.773  -7.334
  282   3HZ   LYS  35          3HZ       LYS  35   5.855 -20.061  -6.655
  283    HA   PRO  36           HA       PRO  36   1.888 -15.900  -3.220
  284   1HB   PRO  36          2HB       PRO  36   0.660 -18.313  -3.387
  285   2HB   PRO  36          1HB       PRO  36   0.111 -16.895  -4.287
  286   1HG   PRO  36          2HG       PRO  36   1.790 -19.194  -5.214
  287   2HG   PRO  36          1HG       PRO  36   0.443 -18.387  -6.040
  288   1HD   PRO  36          2HD       PRO  36   3.035 -17.867  -6.629
  289   2HD   PRO  36          1HD       PRO  36   1.762 -16.636  -6.752
  Start of MODEL    6
    1   1H    GLY   1          1HT       GLY   1 -13.176   3.886  -7.070
    2   2H    GLY   1          2HT       GLY   1 -13.380   4.300  -5.443
    3   3H    GLY   1          3HT       GLY   1 -14.062   5.265  -6.652
    4   1HA   GLY   1          1HA       GLY   1 -15.296   3.098  -7.315
    5   2HA   GLY   1          2HA       GLY   1 -14.925   2.637  -5.661
    6    H    SER   2           H        SER   2 -15.344   4.681  -4.117
    7    HA   SER   2           HA       SER   2 -16.944   5.895  -3.051
    8   1HB   SER   2          2HB       SER   2 -17.987   7.603  -4.268
    9   2HB   SER   2          1HB       SER   2 -16.560   7.244  -5.238
   10    HG   SER   2           HG       SER   2 -19.250   6.560  -5.715
   11    H    ALA   3           H        ALA   3 -19.412   6.229  -2.883
   12    HA   ALA   3           HA       ALA   3 -21.454   5.297  -2.514
   13   1HB   ALA   3          1HB       ALA   3 -21.398   5.325  -5.044
   14   2HB   ALA   3          2HB       ALA   3 -22.511   4.174  -4.304
   15   3HB   ALA   3          3HB       ALA   3 -20.973   3.615  -4.961
   16    H    ALA   4           H        ALA   4 -19.692   4.263  -0.860
   17    HA   ALA   4           HA       ALA   4 -19.247   2.503   0.511
   18   1HB   ALA   4          1HB       ALA   4 -21.847   1.812  -0.709
   19   2HB   ALA   4          2HB       ALA   4 -21.390   1.958   0.988
   20   3HB   ALA   4          3HB       ALA   4 -20.976   0.500   0.087
   21    H    GLU   5           H        GLU   5 -17.309   2.377  -0.954
   22    HA   GLU   5           HA       GLU   5 -16.428  -0.158  -1.352
   23   1HB   GLU   5          2HB       GLU   5 -18.195   0.663  -3.539
   24   2HB   GLU   5          1HB       GLU   5 -16.614   0.132  -4.095
   25   1HG   GLU   5          2HG       GLU   5 -16.961  -2.014  -3.486
   26   2HG   GLU   5          1HG       GLU   5 -17.955  -1.577  -2.096
   27    H    VAL   6           H        VAL   6 -14.976   1.649  -0.439
   28    HA   VAL   6           HA       VAL   6 -13.353   2.798  -2.614
   29    HB   VAL   6           HB       VAL   6 -13.434   3.715   0.262
   30   1HG1  VAL   6          1HG1      VAL   6 -11.345   4.246  -0.805
   31   2HG1  VAL   6          2HG1      VAL   6 -12.304   5.721  -0.665
   32   3HG1  VAL   6          3HG1      VAL   6 -12.184   4.891  -2.217
   33   1HG2  VAL   6          1HG2      VAL   6 -15.478   4.026  -1.508
   34   2HG2  VAL   6          2HG2      VAL   6 -14.526   5.479  -1.813
   35   3HG2  VAL   6          3HG2      VAL   6 -15.116   5.137  -0.186
   36    H    MET   7           H        MET   7 -11.258   2.249  -2.789
   37    HA   MET   7           HA       MET   7  -9.738   1.207  -0.600
   38   1HB   MET   7          2HB       MET   7  -9.250  -0.943  -2.083
   39   2HB   MET   7          1HB       MET   7 -10.546  -0.910  -0.897
   40   1HG   MET   7          2HG       MET   7 -11.259  -1.909  -3.003
   41   2HG   MET   7          1HG       MET   7 -12.167  -0.444  -2.632
   42   1HE   MET   7          1HE       MET   7 -10.438  -2.063  -5.904
   43   2HE   MET   7          2HE       MET   7  -9.483  -2.163  -4.425
   44   3HE   MET   7          3HE       MET   7  -8.954  -1.121  -5.747
   45    H    LYS   8           H        LYS   8  -8.949   3.323  -1.697
   46    HA   LYS   8           HA       LYS   8  -7.426   2.970  -4.116
   47   1HB   LYS   8          2HB       LYS   8  -6.871   5.272  -3.926
   48   2HB   LYS   8          1HB       LYS   8  -8.542   5.127  -3.401
   49   1HG   LYS   8          2HG       LYS   8  -7.618   5.022  -1.030
   50   2HG   LYS   8          1HG       LYS   8  -6.094   5.572  -1.729
   51   1HD   LYS   8          2HD       LYS   8  -7.342   7.466  -0.887
   52   2HD   LYS   8          1HD       LYS   8  -7.256   7.542  -2.648
   53   1HE   LYS   8          2HE       LYS   8  -9.587   6.098  -1.619
   54   2HE   LYS   8          1HE       LYS   8  -9.537   7.802  -1.169
   55   1HZ   LYS   8          1HZ       LYS   8  -9.862   6.583  -3.794
   56   2HZ   LYS   8          2HZ       LYS   8  -8.941   7.999  -3.731
   57   3HZ   LYS   8          3HZ       LYS   8 -10.536   8.003  -3.168
   58    H    LYS   9           H        LYS   9  -6.826   2.900  -0.679
   59    HA   LYS   9           HA       LYS   9  -4.083   2.022  -1.215
   60   1HB   LYS   9          2HB       LYS   9  -3.406   3.378   0.853
   61   2HB   LYS   9          1HB       LYS   9  -3.654   4.254  -0.649
   62   1HG   LYS   9          2HG       LYS   9  -4.638   5.482   1.164
   63   2HG   LYS   9          1HG       LYS   9  -5.917   4.865   0.119
   64   1HD   LYS   9          2HD       LYS   9  -6.453   3.131   1.662
   65   2HD   LYS   9          1HD       LYS   9  -5.015   3.466   2.629
   66   1HE   LYS   9          2HE       LYS   9  -7.161   5.524   2.203
   67   2HE   LYS   9          1HE       LYS   9  -7.263   4.329   3.496
   68   1HZ   LYS   9          1HZ       LYS   9  -6.106   6.692   3.793
   69   2HZ   LYS   9          2HZ       LYS   9  -4.761   5.799   3.292
   70   3HZ   LYS   9          3HZ       LYS   9  -5.627   5.322   4.663
   71    H    TYR  10           H        TYR  10  -6.212   0.366  -0.653
   72    HA   TYR  10           HA       TYR  10  -5.392  -0.700   1.947
   73   1HB   TYR  10          2HB       TYR  10  -7.552   0.652   2.146
   74   2HB   TYR  10          1HB       TYR  10  -8.304  -0.596   1.160
   75    HD1  TYR  10           1HD      TYR  10  -7.781   0.458   4.426
   76    HD2  TYR  10           2HD      TYR  10  -7.792  -3.083   2.066
   77    HE1  TYR  10           1HE      TYR  10  -8.182  -0.883   6.449
   78    HE2  TYR  10           2HE      TYR  10  -8.193  -4.432   4.081
   79    HH   TYR  10           HH       TYR  10  -7.685  -3.410   7.110
   80    H    CYS  11           H        CYS  11  -4.986  -2.825   1.842
   81    HA   CYS  11           HA       CYS  11  -5.541  -4.206  -0.643
   82   1HB   CYS  11          2HB       CYS  11  -3.338  -4.368   0.610
   83   2HB   CYS  11          1HB       CYS  11  -4.180  -5.369   1.786
   84    H    SER  12           H        SER  12  -7.167  -5.524  -1.001
   85    HA   SER  12           HA       SER  12  -9.022  -6.153   1.135
   86   1HB   SER  12          2HB       SER  12 -10.191  -7.303  -0.956
   87   2HB   SER  12          1HB       SER  12 -10.253  -5.558  -0.713
   88    HG   SER  12           HG       SER  12  -9.144  -5.313  -2.473
   89    H    THR  13           H        THR  13  -6.295  -7.488   0.783
   90    HA   THR  13           HA       THR  13  -7.287 -10.225   1.051
   91    HB   THR  13           HB       THR  13  -4.784  -9.426  -0.440
   92    HG1  THR  13           1HG      THR  13  -6.795  -9.063  -1.558
   93   1HG2  THR  13          1HG2      THR  13  -4.196 -11.576  -0.655
   94   2HG2  THR  13          2HG2      THR  13  -5.866 -12.138  -0.725
   95   3HG2  THR  13          3HG2      THR  13  -5.121 -11.773   0.832
   96    H    CYS  14           H        CYS  14  -4.829  -7.829   1.803
   97    HA   CYS  14           HA       CYS  14  -3.758  -9.581   3.899
   98   1HB   CYS  14          2HB       CYS  14  -2.690  -6.946   2.871
   99   2HB   CYS  14          1HB       CYS  14  -1.900  -7.992   4.043
  100    H    ASP  15           H        ASP  15  -6.087  -7.245   3.570
  101    HA   ASP  15           HA       ASP  15  -7.230  -5.914   5.013
  102   1HB   ASP  15          2HB       ASP  15  -6.555  -8.268   6.403
  103   2HB   ASP  15          1HB       ASP  15  -6.265  -6.945   7.527
  104    H    ILE  16           H        ILE  16  -4.744  -4.978   4.121
  105    HA   ILE  16           HA       ILE  16  -3.776  -3.454   6.450
  106    HB   ILE  16           HB       ILE  16  -2.242  -3.760   3.881
  107   1HG1  ILE  16          2HG1      ILE  16  -2.707  -6.021   4.750
  108   2HG1  ILE  16          1HG1      ILE  16  -1.003  -5.609   4.899
  109   1HG2  ILE  16          1HG2      ILE  16  -1.613  -2.882   6.676
  110   2HG2  ILE  16          2HG2      ILE  16  -1.341  -2.032   5.154
  111   3HG2  ILE  16          3HG2      ILE  16  -0.341  -3.421   5.580
  112   1HD1  ILE  16          1HD1      ILE  16  -2.976  -5.357   7.150
  113   2HD1  ILE  16          2HD1      ILE  16  -1.219  -5.241   7.236
  114   3HD1  ILE  16          3HD1      ILE  16  -1.984  -6.786   6.863
  115    H    SER  17           H        SER  17  -3.046  -1.234   5.968
  116    HA   SER  17           HA       SER  17  -4.465  -0.018   3.702
  117   1HB   SER  17          2HB       SER  17  -4.723   1.925   5.594
  118   2HB   SER  17          1HB       SER  17  -5.974   0.739   5.222
  119    HG   SER  17           HG       SER  17  -4.020   0.569   7.274
  120    H    PHE  18           H        PHE  18  -3.647   2.082   3.082
  121    HA   PHE  18           HA       PHE  18  -0.954   2.686   4.065
  122   1HB   PHE  18          2HB       PHE  18  -1.797   2.433   1.172
  123   2HB   PHE  18          1HB       PHE  18  -0.260   3.096   1.704
  124    HD1  PHE  18           1HD      PHE  18   1.162   1.532   3.246
  125    HD2  PHE  18           2HD      PHE  18  -1.957   0.198   0.680
  126    HE1  PHE  18           1HE      PHE  18   2.114  -0.738   3.275
  127    HE2  PHE  18           2HE      PHE  18  -1.013  -2.073   0.703
  128    HZ   PHE  18           HZ       PHE  18   1.023  -2.545   2.002
  129    H    ASN  19           H        ASN  19  -0.603   4.796   4.411
  130    HA   ASN  19           HA       ASN  19  -2.765   6.651   3.990
  131   1HB   ASN  19          2HB       ASN  19  -0.173   6.674   5.443
  132   2HB   ASN  19          1HB       ASN  19  -0.818   8.232   4.937
  133   1HD2  ASN  19          1HD2      ASN  19  -2.162   5.225   6.268
  134   2HD2  ASN  19          2HD2      ASN  19  -3.067   5.990   7.526
  135    H    TYR  20           H        TYR  20  -0.417   5.545   1.972
  136    HA   TYR  20           HA       TYR  20  -0.567   7.968   0.340
  137   1HB   TYR  20          2HB       TYR  20   1.941   6.535   1.174
  138   2HB   TYR  20          1HB       TYR  20   1.881   7.465  -0.320
  139    HD1  TYR  20           1HD      TYR  20   0.509   9.862   0.232
  140    HD2  TYR  20           2HD      TYR  20   3.061   7.667   2.835
  141    HE1  TYR  20           1HE      TYR  20   0.985  11.919   1.491
  142    HE2  TYR  20           2HE      TYR  20   3.544   9.718   4.101
  143    HH   TYR  20           HH       TYR  20   2.941  12.750   2.990
  144    H    VAL  21           H        VAL  21  -1.274   7.496  -1.625
  145    HA   VAL  21           HA       VAL  21  -1.961   4.987  -2.527
  146    HB   VAL  21           HB       VAL  21  -1.136   7.251  -4.347
  147   1HG1  VAL  21          1HG1      VAL  21  -3.000   6.259  -5.747
  148   2HG1  VAL  21          2HG1      VAL  21  -2.948   4.871  -4.661
  149   3HG1  VAL  21          3HG1      VAL  21  -1.528   5.298  -5.615
  150   1HG2  VAL  21          1HG2      VAL  21  -3.489   6.929  -2.566
  151   2HG2  VAL  21          2HG2      VAL  21  -3.767   7.589  -4.178
  152   3HG2  VAL  21          3HG2      VAL  21  -2.645   8.391  -3.078
  153    H    LYS  22           H        LYS  22   1.127   6.597  -2.700
  154    HA   LYS  22           HA       LYS  22   2.327   4.969  -4.672
  155   1HB   LYS  22          2HB       LYS  22   3.581   6.507  -2.391
  156   2HB   LYS  22          1HB       LYS  22   4.472   5.792  -3.727
  157   1HG   LYS  22          2HG       LYS  22   4.273   7.805  -4.670
  158   2HG   LYS  22          1HG       LYS  22   2.627   7.294  -5.047
  159   1HD   LYS  22          2HD       LYS  22   2.289   8.214  -2.530
  160   2HD   LYS  22          1HD       LYS  22   3.602   9.258  -3.076
  161   1HE   LYS  22          2HE       LYS  22   2.310  10.303  -4.628
  162   2HE   LYS  22          1HE       LYS  22   1.325   8.873  -4.931
  163   1HZ   LYS  22          1HZ       LYS  22   1.102  10.212  -2.330
  164   2HZ   LYS  22          2HZ       LYS  22  -0.065   9.349  -3.200
  165   3HZ   LYS  22          3HZ       LYS  22   0.350  10.920  -3.670
  166    H    THR  23           H        THR  23   1.927   4.626  -1.200
  167    HA   THR  23           HA       THR  23   3.700   2.410  -0.951
  168    HB   THR  23           HB       THR  23   1.487   2.667   0.993
  169    HG1  THR  23           1HG      THR  23   3.450   4.696   0.753
  170   1HG2  THR  23          1HG2      THR  23   4.475   2.646   1.332
  171   2HG2  THR  23          2HG2      THR  23   3.406   1.250   1.474
  172   3HG2  THR  23          3HG2      THR  23   3.278   2.581   2.626
  173    H    TYR  24           H        TYR  24   0.231   2.767  -1.444
  174    HA   TYR  24           HA       TYR  24  -0.467   0.055  -1.177
  175   1HB   TYR  24          2HB       TYR  24  -2.140   1.842  -1.214
  176   2HB   TYR  24          1HB       TYR  24  -1.734   2.210  -2.884
  177    HD1  TYR  24           1HD      TYR  24  -3.180   1.407  -4.485
  178    HD2  TYR  24           2HD      TYR  24  -2.735  -0.779  -0.862
  179    HE1  TYR  24           1HE      TYR  24  -4.868  -0.205  -5.257
  180    HE2  TYR  24           2HE      TYR  24  -4.422  -2.397  -1.625
  181    HH   TYR  24           HH       TYR  24  -5.407  -2.694  -4.746
  182    H    LEU  25           H        LEU  25   0.894   1.920  -3.778
  183    HA   LEU  25           HA       LEU  25   0.549  -0.106  -5.786
  184   1HB   LEU  25          2HB       LEU  25   2.213   2.406  -5.653
  185   2HB   LEU  25          1HB       LEU  25   2.245   1.324  -7.034
  186    HG   LEU  25           HG       LEU  25  -0.213   2.755  -6.020
  187   1HD1  LEU  25          1HD1      LEU  25   0.010   4.202  -7.921
  188   2HD1  LEU  25          2HD1      LEU  25   1.426   3.314  -8.486
  189   3HD1  LEU  25          3HD1      LEU  25   1.510   4.252  -6.995
  190   1HD2  LEU  25          1HD2      LEU  25  -0.977   0.824  -7.079
  191   2HD2  LEU  25          2HD2      LEU  25   0.297   0.874  -8.298
  192   3HD2  LEU  25          3HD2      LEU  25  -1.021   2.045  -8.351
  193    H    ALA  26           H        ALA  26   3.136   0.994  -3.667
  194    HA   ALA  26           HA       ALA  26   5.154  -0.698  -4.645
  195   1HB   ALA  26          1HB       ALA  26   6.118   0.895  -3.364
  196   2HB   ALA  26          2HB       ALA  26   5.932  -0.325  -2.105
  197   3HB   ALA  26          3HB       ALA  26   4.754   0.978  -2.251
  198    H    HIS  27           H        HIS  27   2.540  -1.188  -2.366
  199    HA   HIS  27           HA       HIS  27   3.567  -3.589  -1.227
  200   1HB   HIS  27          2HB       HIS  27   1.914  -2.388   0.019
  201   2HB   HIS  27          1HB       HIS  27   0.784  -2.418  -1.330
  202    HD1  HIS  27           1HD      HIS  27   2.351  -4.790   1.196
  203    HD2  HIS  27           2HD      HIS  27  -0.881  -4.554  -1.403
  204    HE1  HIS  27           1HE      HIS  27   0.925  -6.831   1.644
  205    H    LYS  28           H        LYS  28   1.413  -2.877  -3.934
  206    HA   LYS  28           HA       LYS  28   0.800  -5.625  -4.459
  207   1HB   LYS  28          2HB       LYS  28  -0.525  -3.479  -5.114
  208   2HB   LYS  28          1HB       LYS  28   0.551  -3.444  -6.504
  209   1HG   LYS  28          2HG       LYS  28  -1.102  -4.663  -7.428
  210   2HG   LYS  28          1HG       LYS  28  -0.242  -5.991  -6.647
  211   1HD   LYS  28          2HD       LYS  28  -1.760  -6.036  -4.833
  212   2HD   LYS  28          1HD       LYS  28  -2.464  -4.482  -5.291
  213   1HE   LYS  28          2HE       LYS  28  -3.048  -5.742  -7.509
  214   2HE   LYS  28          1HE       LYS  28  -2.854  -7.180  -6.509
  215   1HZ   LYS  28          1HZ       LYS  28  -5.107  -6.631  -6.378
  216   2HZ   LYS  28          2HZ       LYS  28  -4.802  -4.979  -6.185
  217   3HZ   LYS  28          3HZ       LYS  28  -4.456  -6.055  -4.927
  218    H    GLN  29           H        GLN  29   3.175  -3.315  -5.610
  219    HA   GLN  29           HA       GLN  29   4.149  -5.104  -7.667
  220   1HB   GLN  29          2HB       GLN  29   4.156  -2.395  -7.419
  221   2HB   GLN  29          1HB       GLN  29   5.796  -2.778  -6.916
  222   1HG   GLN  29          2HG       GLN  29   6.406  -3.534  -8.977
  223   2HG   GLN  29          1HG       GLN  29   4.767  -4.026  -9.405
  224   1HE2  GLN  29          1HE2      GLN  29   6.609  -1.089  -8.643
  225   2HE2  GLN  29          2HE2      GLN  29   5.865  -0.103  -9.850
  226    H    PHE  30           H        PHE  30   4.666  -4.722  -4.341
  227    HA   PHE  30           HA       PHE  30   7.296  -6.034  -4.541
  228   1HB   PHE  30          2HB       PHE  30   7.239  -3.784  -3.417
  229   2HB   PHE  30          1HB       PHE  30   6.231  -4.503  -2.166
  230    HD1  PHE  30           1HD      PHE  30   9.473  -5.130  -3.904
  231    HD2  PHE  30           2HD      PHE  30   7.264  -5.269  -0.268
  232    HE1  PHE  30           1HE      PHE  30  11.493  -5.868  -2.709
  233    HE2  PHE  30           2HE      PHE  30   9.281  -6.006   0.933
  234    HZ   PHE  30           HZ       PHE  30  11.400  -6.307  -0.287
  235    H    TYR  31           H        TYR  31   4.359  -5.917  -2.517
  236    HA   TYR  31           HA       TYR  31   4.982  -8.383  -1.206
  237   1HB   TYR  31          2HB       TYR  31   3.508  -6.414  -0.367
  238   2HB   TYR  31          1HB       TYR  31   2.228  -7.188  -1.297
  239    HD1  TYR  31           1HD      TYR  31   3.982  -7.128   1.803
  240    HD2  TYR  31           2HD      TYR  31   1.724  -9.656  -0.768
  241    HE1  TYR  31           1HE      TYR  31   3.540  -8.642   3.689
  242    HE2  TYR  31           2HE      TYR  31   1.275 -11.176   1.111
  243    HH   TYR  31           HH       TYR  31   2.219 -11.761   3.274
  244    H    HIS  32           H        HIS  32   2.584  -7.436  -3.660
  245    HA   HIS  32           HA       HIS  32   2.013 -10.262  -4.160
  246   1HB   HIS  32          2HB       HIS  32   0.656  -7.763  -5.190
  247   2HB   HIS  32          1HB       HIS  32   0.144  -9.410  -5.543
  248    HD1  HIS  32           1HD      HIS  32  -1.316 -10.565  -3.795
  249    HD2  HIS  32           2HD      HIS  32   0.295  -6.968  -2.480
  250    HE1  HIS  32           1HE      HIS  32  -2.458 -10.033  -1.599
  251    H    LYS  33           H        LYS  33   4.555  -9.364  -4.929
  252    HA   LYS  33           HA       LYS  33   4.670 -10.270  -7.589
  253   1HB   LYS  33          2HB       LYS  33   3.751  -7.898  -7.873
  254   2HB   LYS  33          1HB       LYS  33   5.336  -7.339  -7.356
  255   1HG   LYS  33          2HG       LYS  33   5.503  -7.292  -9.656
  256   2HG   LYS  33          1HG       LYS  33   6.230  -8.848  -9.253
  257   1HD   LYS  33          2HD       LYS  33   3.665  -9.601  -9.539
  258   2HD   LYS  33          1HD       LYS  33   3.703  -8.237 -10.656
  259   1HE   LYS  33          2HE       LYS  33   5.157  -9.265 -12.080
  260   2HE   LYS  33          1HE       LYS  33   5.934 -10.186 -10.794
  261   1HZ   LYS  33          1HZ       LYS  33   4.453 -11.410 -12.477
  262   2HZ   LYS  33          2HZ       LYS  33   3.158 -10.784 -11.586
  263   3HZ   LYS  33          3HZ       LYS  33   4.292 -11.791 -10.836
  264    H    ASN  34           H        ASN  34   5.952 -10.988  -5.272
  265    HA   ASN  34           HA       ASN  34   8.662  -9.897  -5.457
  266   1HB   ASN  34          2HB       ASN  34   7.241 -10.406  -3.256
  267   2HB   ASN  34          1HB       ASN  34   7.963 -11.998  -3.466
  268   1HD2  ASN  34          1HD2      ASN  34   8.848 -11.280  -1.322
  269   2HD2  ASN  34          2HD2      ASN  34  10.360 -10.447  -1.341
  270    H    LYS  35           H        LYS  35   7.530 -11.639  -7.524
  271    HA   LYS  35           HA       LYS  35   9.738 -13.461  -7.737
  272   1HB   LYS  35          2HB       LYS  35   7.100 -14.410  -6.856
  273   2HB   LYS  35          1HB       LYS  35   7.756 -15.288  -8.232
  274   1HG   LYS  35          2HG       LYS  35   9.395 -16.244  -7.016
  275   2HG   LYS  35          1HG       LYS  35   9.612 -14.826  -5.989
  276   1HD   LYS  35          2HD       LYS  35   7.033 -16.181  -5.658
  277   2HD   LYS  35          1HD       LYS  35   8.432 -17.157  -5.208
  278   1HE   LYS  35          2HE       LYS  35   7.747 -14.409  -4.170
  279   2HE   LYS  35          1HE       LYS  35   7.609 -15.928  -3.285
  280   1HZ   LYS  35          1HZ       LYS  35   9.617 -15.158  -2.549
  281   2HZ   LYS  35          2HZ       LYS  35  10.017 -14.418  -4.016
  282   3HZ   LYS  35          3HZ       LYS  35  10.129 -16.098  -3.859
  283    HA   PRO  36           HA       PRO  36   8.212 -11.790 -11.753
  284   1HB   PRO  36          2HB       PRO  36  10.695 -11.572 -12.849
  285   2HB   PRO  36          1HB       PRO  36   9.970 -10.317 -11.837
  286   1HG   PRO  36          2HG       PRO  36  11.954 -12.435 -11.100
  287   2HG   PRO  36          1HG       PRO  36  11.926 -10.721 -10.646
  288   1HD   PRO  36          2HD       PRO  36  11.092 -12.669  -8.973
  289   2HD   PRO  36          1HD       PRO  36  10.351 -11.056  -8.991
  Start of MODEL    7
    1   1H    GLY   1          1HT       GLY   1 -24.425  -3.235  -7.344
    2   2H    GLY   1          2HT       GLY   1 -24.007  -3.483  -5.725
    3   3H    GLY   1          3HT       GLY   1 -22.818  -3.561  -6.925
    4   1HA   GLY   1          1HA       GLY   1 -24.365  -1.085  -6.593
    5   2HA   GLY   1          2HA       GLY   1 -23.057  -1.434  -5.474
    6    H    SER   2           H        SER   2 -20.967  -2.157  -6.631
    7    HA   SER   2           HA       SER   2 -19.210  -1.581  -7.954
    8   1HB   SER   2          2HB       SER   2 -21.326  -0.969 -10.033
    9   2HB   SER   2          1HB       SER   2 -19.616  -1.285 -10.333
   10    HG   SER   2           HG       SER   2 -21.643  -3.035 -10.030
   11    H    ALA   3           H        ALA   3 -18.063   0.235  -8.877
   12    HA   ALA   3           HA       ALA   3 -17.412   2.415  -8.893
   13   1HB   ALA   3          1HB       ALA   3 -18.879   3.984  -9.781
   14   2HB   ALA   3          2HB       ALA   3 -20.287   3.246  -9.018
   15   3HB   ALA   3          3HB       ALA   3 -19.511   2.454 -10.389
   16    H    ALA   4           H        ALA   4 -17.987   1.110  -6.356
   17    HA   ALA   4           HA       ALA   4 -17.791   3.379  -4.656
   18   1HB   ALA   4          1HB       ALA   4 -20.392   1.877  -4.698
   19   2HB   ALA   4          2HB       ALA   4 -20.121   3.617  -4.797
   20   3HB   ALA   4          3HB       ALA   4 -19.847   2.767  -3.277
   21    H    GLU   5           H        GLU   5 -15.927   1.659  -4.740
   22    HA   GLU   5           HA       GLU   5 -15.460   0.652  -2.264
   23   1HB   GLU   5          2HB       GLU   5 -17.259  -1.110  -3.759
   24   2HB   GLU   5          1HB       GLU   5 -15.823  -1.934  -3.169
   25   1HG   GLU   5          2HG       GLU   5 -16.504  -1.864  -1.044
   26   2HG   GLU   5          1HG       GLU   5 -17.100  -0.210  -1.186
   27    H    VAL   6           H        VAL   6 -13.692   1.752  -3.629
   28    HA   VAL   6           HA       VAL   6 -12.193  -0.151  -5.265
   29    HB   VAL   6           HB       VAL   6 -11.519   2.738  -4.711
   30   1HG1  VAL   6          1HG1      VAL   6 -10.203   2.512  -6.796
   31   2HG1  VAL   6          2HG1      VAL   6 -10.591   0.793  -6.819
   32   3HG1  VAL   6          3HG1      VAL   6  -9.633   1.462  -5.500
   33   1HG2  VAL   6          1HG2      VAL   6 -13.069   1.562  -7.017
   34   2HG2  VAL   6          2HG2      VAL   6 -12.533   3.238  -6.886
   35   3HG2  VAL   6          3HG2      VAL   6 -13.719   2.599  -5.747
   36    H    MET   7           H        MET   7 -12.139   1.364  -2.145
   37    HA   MET   7           HA       MET   7 -10.832   1.043  -0.315
   38   1HB   MET   7          2HB       MET   7 -10.727  -1.391  -1.692
   39   2HB   MET   7          1HB       MET   7  -9.054  -1.025  -1.301
   40   1HG   MET   7          2HG       MET   7  -9.618  -2.131   0.586
   41   2HG   MET   7          1HG       MET   7 -10.114  -0.511   1.070
   42   1HE   MET   7          1HE       MET   7 -13.233  -1.001   2.461
   43   2HE   MET   7          2HE       MET   7 -13.316   0.018   1.023
   44   3HE   MET   7          3HE       MET   7 -11.864   0.022   2.024
   45    H    LYS   8           H        LYS   8 -10.044   3.172  -1.302
   46    HA   LYS   8           HA       LYS   8  -7.611   3.387  -2.650
   47   1HB   LYS   8          2HB       LYS   8  -9.135   5.268  -2.432
   48   2HB   LYS   8          1HB       LYS   8  -8.908   5.288  -0.690
   49   1HG   LYS   8          2HG       LYS   8  -6.458   5.737  -1.162
   50   2HG   LYS   8          1HG       LYS   8  -6.946   6.045  -2.829
   51   1HD   LYS   8          2HD       LYS   8  -8.330   7.432  -0.567
   52   2HD   LYS   8          1HD       LYS   8  -6.777   8.027  -1.158
   53   1HE   LYS   8          2HE       LYS   8  -9.360   7.751  -2.677
   54   2HE   LYS   8          1HE       LYS   8  -8.467   9.228  -2.318
   55   1HZ   LYS   8          1HZ       LYS   8  -6.614   7.963  -3.662
   56   2HZ   LYS   8          2HZ       LYS   8  -7.805   8.871  -4.448
   57   3HZ   LYS   8          3HZ       LYS   8  -7.952   7.189  -4.352
   58    H    LYS   9           H        LYS   9  -5.628   2.851  -2.057
   59    HA   LYS   9           HA       LYS   9  -3.820   2.289  -0.806
   60   1HB   LYS   9          2HB       LYS   9  -4.857   4.178   1.296
   61   2HB   LYS   9          1HB       LYS   9  -3.190   3.778   0.915
   62   1HG   LYS   9          2HG       LYS   9  -3.051   5.321  -0.691
   63   2HG   LYS   9          1HG       LYS   9  -4.663   4.969  -1.312
   64   1HD   LYS   9          2HD       LYS   9  -5.022   7.073  -0.493
   65   2HD   LYS   9          1HD       LYS   9  -5.391   6.131   0.953
   66   1HE   LYS   9          2HE       LYS   9  -3.352   6.646   1.956
   67   2HE   LYS   9          1HE       LYS   9  -2.612   7.114   0.426
   68   1HZ   LYS   9          1HZ       LYS   9  -3.455   8.883   2.171
   69   2HZ   LYS   9          2HZ       LYS   9  -4.911   8.669   1.336
   70   3HZ   LYS   9          3HZ       LYS   9  -3.525   9.172   0.506
   71    H    TYR  10           H        TYR  10  -5.750   0.431  -0.590
   72    HA   TYR  10           HA       TYR  10  -5.243  -0.652   2.040
   73   1HB   TYR  10          2HB       TYR  10  -7.356   0.757   2.231
   74   2HB   TYR  10          1HB       TYR  10  -8.117  -0.406   1.152
   75    HD1  TYR  10           1HD      TYR  10  -7.596   0.438   4.502
   76    HD2  TYR  10           2HD      TYR  10  -7.818  -2.941   1.925
   77    HE1  TYR  10           1HE      TYR  10  -8.126  -0.992   6.432
   78    HE2  TYR  10           2HE      TYR  10  -8.348  -4.378   3.848
   79    HH   TYR  10           HH       TYR  10  -9.308  -3.203   6.816
   80    H    CYS  11           H        CYS  11  -4.884  -2.780   1.865
   81    HA   CYS  11           HA       CYS  11  -5.400  -4.060  -0.683
   82   1HB   CYS  11          2HB       CYS  11  -3.242  -4.319   0.629
   83   2HB   CYS  11          1HB       CYS  11  -4.143  -5.337   1.745
   84    H    SER  12           H        SER  12  -7.017  -5.371  -1.133
   85    HA   SER  12           HA       SER  12  -8.977  -5.986   0.911
   86   1HB   SER  12          2HB       SER  12  -8.911  -6.027  -2.066
   87   2HB   SER  12          1HB       SER  12 -10.050  -7.106  -1.261
   88    HG   SER  12           HG       SER  12  -9.845  -4.313  -0.795
   89    H    THR  13           H        THR  13  -6.253  -7.379   0.634
   90    HA   THR  13           HA       THR  13  -7.321 -10.093   0.856
   91    HB   THR  13           HB       THR  13  -4.764  -9.343  -0.569
   92    HG1  THR  13           1HG      THR  13  -6.502  -8.917  -1.886
   93   1HG2  THR  13          1HG2      THR  13  -5.342 -11.899  -1.295
   94   2HG2  THR  13          2HG2      THR  13  -5.773 -11.896   0.415
   95   3HG2  THR  13          3HG2      THR  13  -4.148 -11.428  -0.085
   96    H    CYS  14           H        CYS  14  -4.818  -7.772   1.690
   97    HA   CYS  14           HA       CYS  14  -3.832  -9.568   3.789
   98   1HB   CYS  14          2HB       CYS  14  -2.716  -6.925   2.832
   99   2HB   CYS  14          1HB       CYS  14  -1.966  -7.995   4.011
  100    H    ASP  15           H        ASP  15  -6.142  -7.220   3.456
  101    HA   ASP  15           HA       ASP  15  -7.302  -5.899   4.894
  102   1HB   ASP  15          2HB       ASP  15  -6.714  -8.286   6.247
  103   2HB   ASP  15          1HB       ASP  15  -6.375  -7.004   7.404
  104    H    ILE  16           H        ILE  16  -4.761  -5.005   4.081
  105    HA   ILE  16           HA       ILE  16  -3.827  -3.524   6.451
  106    HB   ILE  16           HB       ILE  16  -2.270  -3.799   3.891
  107   1HG1  ILE  16          2HG1      ILE  16  -2.767  -6.064   4.752
  108   2HG1  ILE  16          1HG1      ILE  16  -1.056  -5.669   4.881
  109   1HG2  ILE  16          1HG2      ILE  16  -0.375  -3.464   5.572
  110   2HG2  ILE  16          2HG2      ILE  16  -1.636  -2.983   6.708
  111   3HG2  ILE  16          3HG2      ILE  16  -1.401  -2.076   5.213
  112   1HD1  ILE  16          1HD1      ILE  16  -1.740  -6.790   6.871
  113   2HD1  ILE  16          2HD1      ILE  16  -3.090  -5.678   7.094
  114   3HD1  ILE  16          3HD1      ILE  16  -1.433  -5.100   7.266
  115    H    SER  17           H        SER  17  -3.068  -1.302   6.026
  116    HA   SER  17           HA       SER  17  -4.490  -0.020   3.796
  117   1HB   SER  17          2HB       SER  17  -5.772   0.245   5.924
  118   2HB   SER  17          1HB       SER  17  -4.378   1.072   6.619
  119    HG   SER  17           HG       SER  17  -5.355   2.763   5.811
  120    H    PHE  18           H        PHE  18  -3.667   2.163   3.298
  121    HA   PHE  18           HA       PHE  18  -0.919   2.636   4.165
  122   1HB   PHE  18          2HB       PHE  18  -1.870   2.442   1.303
  123   2HB   PHE  18          1HB       PHE  18  -0.319   3.119   1.775
  124    HD1  PHE  18           1HD      PHE  18   1.339   1.628   2.955
  125    HD2  PHE  18           2HD      PHE  18  -2.174   0.138   1.071
  126    HE1  PHE  18           1HE      PHE  18   2.323  -0.628   2.913
  127    HE2  PHE  18           2HE      PHE  18  -1.198  -2.119   1.027
  128    HZ   PHE  18           HZ       PHE  18   1.052  -2.505   1.948
  129    H    ASN  19           H        ASN  19  -0.373   4.758   4.320
  130    HA   ASN  19           HA       ASN  19  -2.536   6.675   4.144
  131   1HB   ASN  19          2HB       ASN  19   0.254   6.748   5.263
  132   2HB   ASN  19          1HB       ASN  19  -0.665   8.234   5.046
  133   1HD2  ASN  19          1HD2      ASN  19  -3.134   7.676   5.775
  134   2HD2  ASN  19          2HD2      ASN  19  -3.213   7.126   7.410
  135    H    TYR  20           H        TYR  20  -0.502   5.488   1.910
  136    HA   TYR  20           HA       TYR  20  -0.695   7.894   0.283
  137   1HB   TYR  20          2HB       TYR  20   1.891   6.486   0.935
  138   2HB   TYR  20          1HB       TYR  20   1.705   7.476  -0.508
  139    HD1  TYR  20           1HD      TYR  20   0.106   9.727   0.486
  140    HD2  TYR  20           2HD      TYR  20   3.346   7.664   2.316
  141    HE1  TYR  20           1HE      TYR  20   0.641  11.739   1.795
  142    HE2  TYR  20           2HE      TYR  20   3.889   9.670   3.629
  143    HH   TYR  20           HH       TYR  20   3.299  12.441   3.086
  144    H    VAL  21           H        VAL  21  -1.566   7.332  -1.599
  145    HA   VAL  21           HA       VAL  21  -2.204   4.767  -2.377
  146    HB   VAL  21           HB       VAL  21  -1.635   6.938  -4.387
  147   1HG1  VAL  21          1HG1      VAL  21  -3.925   5.011  -4.425
  148   2HG1  VAL  21          2HG1      VAL  21  -2.326   4.507  -4.976
  149   3HG1  VAL  21          3HG1      VAL  21  -3.148   5.852  -5.767
  150   1HG2  VAL  21          1HG2      VAL  21  -4.199   7.376  -3.924
  151   2HG2  VAL  21          2HG2      VAL  21  -2.945   8.187  -2.986
  152   3HG2  VAL  21          3HG2      VAL  21  -3.771   6.778  -2.321
  153    H    LYS  22           H        LYS  22   0.785   6.495  -2.808
  154    HA   LYS  22           HA       LYS  22   1.914   4.871  -4.831
  155   1HB   LYS  22          2HB       LYS  22   2.938   6.839  -2.849
  156   2HB   LYS  22          1HB       LYS  22   4.105   5.730  -3.555
  157   1HG   LYS  22          2HG       LYS  22   4.044   7.796  -4.804
  158   2HG   LYS  22          1HG       LYS  22   3.440   6.466  -5.795
  159   1HD   LYS  22          2HD       LYS  22   1.193   7.167  -5.530
  160   2HD   LYS  22          1HD       LYS  22   1.621   8.288  -4.235
  161   1HE   LYS  22          2HE       LYS  22   2.331   9.886  -5.670
  162   2HE   LYS  22          1HE       LYS  22   2.975   8.717  -6.821
  163   1HZ   LYS  22          1HZ       LYS  22   0.374   8.257  -7.072
  164   2HZ   LYS  22          2HZ       LYS  22   1.206   9.388  -8.016
  165   3HZ   LYS  22          3HZ       LYS  22   0.325   9.899  -6.665
  166    H    THR  23           H        THR  23   1.957   4.711  -1.300
  167    HA   THR  23           HA       THR  23   3.735   2.526  -1.107
  168    HB   THR  23           HB       THR  23   1.541   3.069   0.879
  169    HG1  THR  23           1HG      THR  23   2.697   4.754   1.682
  170   1HG2  THR  23          1HG2      THR  23   4.415   2.268   1.260
  171   2HG2  THR  23          2HG2      THR  23   3.024   1.188   1.357
  172   3HG2  THR  23          3HG2      THR  23   3.212   2.493   2.529
  173    H    TYR  24           H        TYR  24   0.234   2.765  -1.385
  174    HA   TYR  24           HA       TYR  24  -0.368   0.046  -1.005
  175   1HB   TYR  24          2HB       TYR  24  -2.044   1.881  -1.009
  176   2HB   TYR  24          1HB       TYR  24  -1.829   2.042  -2.747
  177    HD1  TYR  24           1HD      TYR  24  -3.868   1.400  -3.671
  178    HD2  TYR  24           2HD      TYR  24  -2.094  -1.041  -0.673
  179    HE1  TYR  24           1HE      TYR  24  -5.595  -0.309  -4.050
  180    HE2  TYR  24           2HE      TYR  24  -3.815  -2.758  -1.043
  181    HH   TYR  24           HH       TYR  24  -6.627  -2.171  -2.902
  182    H    LEU  25           H        LEU  25   0.800   1.860  -3.735
  183    HA   LEU  25           HA       LEU  25   0.363  -0.224  -5.665
  184   1HB   LEU  25          2HB       LEU  25   2.044   2.285  -5.712
  185   2HB   LEU  25          1HB       LEU  25   1.925   1.182  -7.071
  186    HG   LEU  25           HG       LEU  25  -0.607   2.269  -5.943
  187   1HD1  LEU  25          1HD1      LEU  25  -0.120   4.135  -7.792
  188   2HD1  LEU  25          2HD1      LEU  25   1.524   3.880  -7.207
  189   3HD1  LEU  25          3HD1      LEU  25   0.252   4.358  -6.082
  190   1HD2  LEU  25          1HD2      LEU  25  -0.485   0.590  -7.799
  191   2HD2  LEU  25          2HD2      LEU  25   0.287   1.831  -8.786
  192   3HD2  LEU  25          3HD2      LEU  25  -1.357   2.071  -8.196
  193    H    ALA  26           H        ALA  26   3.070   0.991  -3.763
  194    HA   ALA  26           HA       ALA  26   5.052  -0.701  -4.788
  195   1HB   ALA  26          1HB       ALA  26   5.147   1.374  -3.150
  196   2HB   ALA  26          2HB       ALA  26   6.418   0.152  -3.171
  197   3HB   ALA  26          3HB       ALA  26   5.167   0.099  -1.931
  198    H    HIS  27           H        HIS  27   2.570  -1.181  -2.357
  199    HA   HIS  27           HA       HIS  27   3.660  -3.560  -1.244
  200   1HB   HIS  27          2HB       HIS  27   2.054  -2.409   0.077
  201   2HB   HIS  27          1HB       HIS  27   0.885  -2.373  -1.239
  202    HD1  HIS  27           1HD      HIS  27   2.418  -4.807   1.236
  203    HD2  HIS  27           2HD      HIS  27  -0.793  -4.509  -1.381
  204    HE1  HIS  27           1HE      HIS  27   0.971  -6.842   1.649
  205    H    LYS  28           H        LYS  28   1.393  -2.902  -3.870
  206    HA   LYS  28           HA       LYS  28   0.775  -5.653  -4.345
  207   1HB   LYS  28          2HB       LYS  28  -0.572  -3.526  -4.995
  208   2HB   LYS  28          1HB       LYS  28   0.477  -3.490  -6.406
  209   1HG   LYS  28          2HG       LYS  28  -1.397  -4.638  -7.144
  210   2HG   LYS  28          1HG       LYS  28  -0.253  -5.926  -6.760
  211   1HD   LYS  28          2HD       LYS  28  -2.445  -6.494  -5.904
  212   2HD   LYS  28          1HD       LYS  28  -1.339  -6.196  -4.561
  213   1HE   LYS  28          2HE       LYS  28  -2.844  -3.852  -5.522
  214   2HE   LYS  28          1HE       LYS  28  -3.808  -5.117  -4.762
  215   1HZ   LYS  28          1HZ       LYS  28  -2.915  -4.712  -2.751
  216   2HZ   LYS  28          2HZ       LYS  28  -2.598  -3.185  -3.404
  217   3HZ   LYS  28          3HZ       LYS  28  -1.379  -4.356  -3.364
  218    H    GLN  29           H        GLN  29   3.108  -3.357  -5.616
  219    HA   GLN  29           HA       GLN  29   4.029  -5.194  -7.655
  220   1HB   GLN  29          2HB       GLN  29   4.011  -2.497  -7.526
  221   2HB   GLN  29          1HB       GLN  29   5.654  -2.815  -6.985
  222   1HG   GLN  29          2HG       GLN  29   5.987  -4.188  -9.037
  223   2HG   GLN  29          1HG       GLN  29   4.400  -3.652  -9.588
  224   1HE2  GLN  29          1HE2      GLN  29   4.795  -2.322 -11.220
  225   2HE2  GLN  29          2HE2      GLN  29   5.859  -0.961 -11.174
  226    H    PHE  30           H        PHE  30   4.693  -4.648  -4.358
  227    HA   PHE  30           HA       PHE  30   7.318  -5.958  -4.612
  228   1HB   PHE  30          2HB       PHE  30   7.131  -3.666  -3.482
  229   2HB   PHE  30          1HB       PHE  30   6.336  -4.511  -2.159
  230    HD1  PHE  30           1HD      PHE  30   9.317  -5.236  -4.287
  231    HD2  PHE  30           2HD      PHE  30   7.735  -4.757  -0.366
  232    HE1  PHE  30           1HE      PHE  30  11.515  -5.803  -3.336
  233    HE2  PHE  30           2HE      PHE  30   9.930  -5.321   0.593
  234    HZ   PHE  30           HZ       PHE  30  11.823  -5.845  -0.892
  235    H    TYR  31           H        TYR  31   4.429  -5.880  -2.521
  236    HA   TYR  31           HA       TYR  31   5.131  -8.316  -1.195
  237   1HB   TYR  31          2HB       TYR  31   3.601  -6.335  -0.404
  238   2HB   TYR  31          1HB       TYR  31   2.335  -7.242  -1.224
  239    HD1  TYR  31           1HD      TYR  31   4.189  -6.868   1.786
  240    HD2  TYR  31           2HD      TYR  31   2.042  -9.714  -0.535
  241    HE1  TYR  31           1HE      TYR  31   3.928  -8.286   3.778
  242    HE2  TYR  31           2HE      TYR  31   1.774 -11.140   1.450
  243    HH   TYR  31           HH       TYR  31   2.920 -11.500   3.627
  244    H    HIS  32           H        HIS  32   2.710  -7.442  -3.650
  245    HA   HIS  32           HA       HIS  32   2.124 -10.275  -4.069
  246   1HB   HIS  32          2HB       HIS  32   0.810  -7.787  -5.179
  247   2HB   HIS  32          1HB       HIS  32   0.292  -9.433  -5.526
  248    HD1  HIS  32           1HD      HIS  32  -1.232 -10.547  -3.814
  249    HD2  HIS  32           2HD      HIS  32   0.410  -6.973  -2.474
  250    HE1  HIS  32           1HE      HIS  32  -2.415  -9.988  -1.647
  251    H    LYS  33           H        LYS  33   4.680  -9.543  -4.832
  252    HA   LYS  33           HA       LYS  33   4.773 -10.468  -7.490
  253   1HB   LYS  33          2HB       LYS  33   4.127  -7.851  -7.509
  254   2HB   LYS  33          1HB       LYS  33   5.880  -7.719  -7.468
  255   1HG   LYS  33          2HG       LYS  33   5.308  -7.676  -9.737
  256   2HG   LYS  33          1HG       LYS  33   5.898  -9.313  -9.443
  257   1HD   LYS  33          2HD       LYS  33   3.972  -9.667 -10.695
  258   2HD   LYS  33          1HD       LYS  33   3.413  -9.888  -9.036
  259   1HE   LYS  33          2HE       LYS  33   1.780  -8.482  -9.739
  260   2HE   LYS  33          1HE       LYS  33   2.971  -7.268  -9.274
  261   1HZ   LYS  33          1HZ       LYS  33   3.064  -8.305 -12.009
  262   2HZ   LYS  33          2HZ       LYS  33   3.434  -6.761 -11.428
  263   3HZ   LYS  33          3HZ       LYS  33   1.820  -7.227 -11.616
  264    H    ASN  34           H        ASN  34   5.973 -11.268  -5.154
  265    HA   ASN  34           HA       ASN  34   8.766 -10.398  -5.376
  266   1HB   ASN  34          2HB       ASN  34   7.320 -10.612  -3.141
  267   2HB   ASN  34          1HB       ASN  34   7.900 -12.273  -3.231
  268   1HD2  ASN  34          1HD2      ASN  34   8.699 -11.045  -1.101
  269   2HD2  ASN  34          2HD2      ASN  34  10.339 -10.513  -1.204
  270    H    LYS  35           H        LYS  35   7.833 -11.979  -7.449
  271    HA   LYS  35           HA       LYS  35   8.371 -13.821  -8.668
  272   1HB   LYS  35          2HB       LYS  35  10.508 -14.133  -6.551
  273   2HB   LYS  35          1HB       LYS  35  10.453 -15.023  -8.066
  274   1HG   LYS  35          2HG       LYS  35  11.800 -13.400  -8.806
  275   2HG   LYS  35          1HG       LYS  35  10.309 -12.470  -8.963
  276   1HD   LYS  35          2HD       LYS  35  11.903 -11.118  -7.799
  277   2HD   LYS  35          1HD       LYS  35  10.677 -11.632  -6.638
  278   1HE   LYS  35          2HE       LYS  35  12.496 -12.143  -5.395
  279   2HE   LYS  35          1HE       LYS  35  12.434 -13.631  -6.337
  280   1HZ   LYS  35          1HZ       LYS  35  14.566 -13.097  -6.746
  281   2HZ   LYS  35          2HZ       LYS  35  14.343 -11.446  -6.448
  282   3HZ   LYS  35          3HZ       LYS  35  13.896 -12.104  -7.941
  283    HA   PRO  36           HA       PRO  36   6.206 -16.456  -5.381
  284   1HB   PRO  36          2HB       PRO  36   3.727 -16.413  -6.487
  285   2HB   PRO  36          1HB       PRO  36   4.275 -15.212  -5.312
  286   1HG   PRO  36          2HG       PRO  36   4.141 -15.017  -8.296
  287   2HG   PRO  36          1HG       PRO  36   3.682 -13.816  -7.076
  288   1HD   PRO  36          2HD       PRO  36   6.031 -13.703  -8.413
  289   2HD   PRO  36          1HD       PRO  36   5.861 -13.141  -6.737
  Start of MODEL    8
    1   1H    GLY   1          1HT       GLY   1 -24.589  -3.797  -3.191
    2   2H    GLY   1          2HT       GLY   1 -25.540  -2.604  -2.459
    3   3H    GLY   1          3HT       GLY   1 -23.876  -2.660  -2.158
    4   1HA   GLY   1          1HA       GLY   1 -25.284  -1.813  -4.610
    5   2HA   GLY   1          2HA       GLY   1 -24.093  -0.925  -3.671
    6    H    SER   2           H        SER   2 -22.164  -2.947  -3.378
    7    HA   SER   2           HA       SER   2 -20.331  -3.794  -4.424
    8   1HB   SER   2          2HB       SER   2 -22.422  -5.045  -5.585
    9   2HB   SER   2          1HB       SER   2 -21.729  -4.251  -6.998
   10    HG   SER   2           HG       SER   2 -20.939  -6.478  -6.083
   11    H    ALA   3           H        ALA   3 -20.791  -0.987  -4.567
   12    HA   ALA   3           HA       ALA   3 -18.843  -0.252  -6.464
   13   1HB   ALA   3          1HB       ALA   3 -20.359   1.211  -7.881
   14   2HB   ALA   3          2HB       ALA   3 -21.700   0.258  -7.246
   15   3HB   ALA   3          3HB       ALA   3 -20.429  -0.525  -8.183
   16    H    ALA   4           H        ALA   4 -17.837   1.229  -5.282
   17    HA   ALA   4           HA       ALA   4 -19.276   3.582  -4.394
   18   1HB   ALA   4          1HB       ALA   4 -18.046   3.240  -2.079
   19   2HB   ALA   4          2HB       ALA   4 -18.216   1.540  -2.514
   20   3HB   ALA   4          3HB       ALA   4 -19.645   2.564  -2.385
   21    H    GLU   5           H        GLU   5 -16.196   1.818  -4.312
   22    HA   GLU   5           HA       GLU   5 -14.645   3.518  -5.749
   23   1HB   GLU   5          2HB       GLU   5 -15.214   4.643  -3.105
   24   2HB   GLU   5          1HB       GLU   5 -13.494   4.527  -3.447
   25   1HG   GLU   5          2HG       GLU   5 -15.252   5.681  -5.538
   26   2HG   GLU   5          1HG       GLU   5 -14.914   6.649  -4.105
   27    H    VAL   6           H        VAL   6 -14.340   1.048  -5.797
   28    HA   VAL   6           HA       VAL   6 -12.656  -0.088  -3.769
   29    HB   VAL   6           HB       VAL   6 -14.202  -1.492  -5.063
   30   1HG1  VAL   6          1HG1      VAL   6 -12.404  -0.841  -7.394
   31   2HG1  VAL   6          2HG1      VAL   6 -14.094  -0.371  -7.203
   32   3HG1  VAL   6          3HG1      VAL   6 -13.667  -2.071  -7.397
   33   1HG2  VAL   6          1HG2      VAL   6 -12.773  -3.352  -5.315
   34   2HG2  VAL   6          2HG2      VAL   6 -12.040  -2.357  -4.057
   35   3HG2  VAL   6          3HG2      VAL   6 -11.385  -2.333  -5.694
   36    H    MET   7           H        MET   7 -10.501  -0.937  -4.178
   37    HA   MET   7           HA       MET   7  -8.319  -0.711  -4.778
   38   1HB   MET   7          2HB       MET   7  -9.635  -0.994  -7.116
   39   2HB   MET   7          1HB       MET   7  -8.929   0.597  -7.366
   40   1HG   MET   7          2HG       MET   7  -7.162  -0.529  -8.120
   41   2HG   MET   7          1HG       MET   7  -6.797  -0.792  -6.416
   42   1HE   MET   7          1HE       MET   7  -8.201  -4.083  -5.548
   43   2HE   MET   7          2HE       MET   7  -7.524  -2.521  -5.085
   44   3HE   MET   7          3HE       MET   7  -6.465  -3.801  -5.673
   45    H    LYS   8           H        LYS   8  -7.233   0.759  -3.656
   46    HA   LYS   8           HA       LYS   8  -6.888   3.410  -4.647
   47   1HB   LYS   8          2HB       LYS   8  -8.991   3.854  -3.586
   48   2HB   LYS   8          1HB       LYS   8  -8.502   3.009  -2.126
   49   1HG   LYS   8          2HG       LYS   8  -7.021   4.730  -1.503
   50   2HG   LYS   8          1HG       LYS   8  -7.096   5.477  -3.100
   51   1HD   LYS   8          2HD       LYS   8  -9.576   5.193  -1.447
   52   2HD   LYS   8          1HD       LYS   8  -8.444   6.510  -1.131
   53   1HE   LYS   8          2HE       LYS   8  -9.171   6.116  -3.955
   54   2HE   LYS   8          1HE       LYS   8 -10.485   6.642  -2.905
   55   1HZ   LYS   8          1HZ       LYS   8  -7.853   8.003  -3.003
   56   2HZ   LYS   8          2HZ       LYS   8  -9.281   8.561  -2.286
   57   3HZ   LYS   8          3HZ       LYS   8  -9.164   8.460  -3.971
   58    H    LYS   9           H        LYS   9  -6.828   2.454  -1.241
   59    HA   LYS   9           HA       LYS   9  -3.966   1.976  -1.332
   60   1HB   LYS   9          2HB       LYS   9  -5.082   4.118   0.482
   61   2HB   LYS   9          1HB       LYS   9  -3.397   3.666   0.277
   62   1HG   LYS   9          2HG       LYS   9  -3.366   4.556  -1.949
   63   2HG   LYS   9          1HG       LYS   9  -5.102   4.865  -1.892
   64   1HD   LYS   9          2HD       LYS   9  -4.244   6.200   0.318
   65   2HD   LYS   9          1HD       LYS   9  -2.870   6.407  -0.770
   66   1HE   LYS   9          2HE       LYS   9  -3.975   7.893  -2.005
   67   2HE   LYS   9          1HE       LYS   9  -5.369   6.825  -2.154
   68   1HZ   LYS   9          1HZ       LYS   9  -5.761   9.027  -1.028
   69   2HZ   LYS   9          2HZ       LYS   9  -4.859   8.437   0.277
   70   3HZ   LYS   9          3HZ       LYS   9  -6.292   7.663  -0.179
   71    H    TYR  10           H        TYR  10  -5.926   0.150  -0.825
   72    HA   TYR  10           HA       TYR  10  -5.281  -0.654   1.878
   73   1HB   TYR  10          2HB       TYR  10  -7.332   0.769   2.112
   74   2HB   TYR  10          1HB       TYR  10  -8.183  -0.366   1.070
   75    HD1  TYR  10           1HD      TYR  10  -7.512   0.494   4.393
   76    HD2  TYR  10           2HD      TYR  10  -8.041  -2.896   1.879
   77    HE1  TYR  10           1HE      TYR  10  -8.079  -0.868   6.360
   78    HE2  TYR  10           2HE      TYR  10  -8.610  -4.267   3.838
   79    HH   TYR  10           HH       TYR  10  -9.489  -3.926   6.133
   80    H    CYS  11           H        CYS  11  -5.007  -2.805   1.957
   81    HA   CYS  11           HA       CYS  11  -5.851  -4.344  -0.392
   82   1HB   CYS  11          2HB       CYS  11  -3.426  -4.323   0.523
   83   2HB   CYS  11          1HB       CYS  11  -4.040  -5.415   1.751
   84    H    SER  12           H        SER  12  -7.550  -5.602  -0.299
   85    HA   SER  12           HA       SER  12  -8.863  -6.152   2.208
   86   1HB   SER  12          2HB       SER  12  -9.750  -7.513  -0.284
   87   2HB   SER  12          1HB       SER  12 -10.703  -6.698   0.956
   88    HG   SER  12           HG       SER  12  -9.744  -4.704   0.068
   89    H    THR  13           H        THR  13  -6.669  -7.759   0.084
   90    HA   THR  13           HA       THR  13  -7.225 -10.416   1.016
   91    HB   THR  13           HB       THR  13  -4.684  -9.575  -0.353
   92    HG1  THR  13           1HG      THR  13  -6.191  -8.660  -1.648
   93   1HG2  THR  13          1HG2      THR  13  -6.143 -11.950  -1.238
   94   2HG2  THR  13          2HG2      THR  13  -5.524 -12.032   0.411
   95   3HG2  THR  13          3HG2      THR  13  -4.422 -11.715  -0.929
   96    H    CYS  14           H        CYS  14  -4.766  -7.939   1.670
   97    HA   CYS  14           HA       CYS  14  -3.654  -9.652   3.778
   98   1HB   CYS  14          2HB       CYS  14  -2.566  -7.039   2.726
   99   2HB   CYS  14          1HB       CYS  14  -1.743  -8.183   3.778
  100    H    ASP  15           H        ASP  15  -6.039  -7.448   3.539
  101    HA   ASP  15           HA       ASP  15  -7.091  -6.010   4.947
  102   1HB   ASP  15          2HB       ASP  15  -5.730  -7.775   6.990
  103   2HB   ASP  15          1HB       ASP  15  -7.048  -6.661   7.336
  104    H    ILE  16           H        ILE  16  -4.707  -5.003   3.939
  105    HA   ILE  16           HA       ILE  16  -3.540  -3.564   6.228
  106    HB   ILE  16           HB       ILE  16  -2.369  -3.600   3.459
  107   1HG1  ILE  16          2HG1      ILE  16  -1.569  -5.483   5.678
  108   2HG1  ILE  16          1HG1      ILE  16  -2.681  -5.945   4.393
  109   1HG2  ILE  16          1HG2      ILE  16  -1.399  -1.912   4.748
  110   2HG2  ILE  16          2HG2      ILE  16  -0.266  -3.258   4.872
  111   3HG2  ILE  16          3HG2      ILE  16  -1.372  -2.912   6.200
  112   1HD1  ILE  16          1HD1      ILE  16   0.102  -4.937   3.888
  113   2HD1  ILE  16          2HD1      ILE  16  -0.999  -5.699   2.741
  114   3HD1  ILE  16          3HD1      ILE  16  -0.307  -6.644   4.061
  115    H    SER  17           H        SER  17  -2.980  -1.282   5.840
  116    HA   SER  17           HA       SER  17  -4.746   0.022   3.890
  117   1HB   SER  17          2HB       SER  17  -4.834   1.824   5.902
  118   2HB   SER  17          1HB       SER  17  -6.039   0.553   5.698
  119    HG   SER  17           HG       SER  17  -3.716   0.365   7.319
  120    H    PHE  18           H        PHE  18  -4.015   2.033   3.111
  121    HA   PHE  18           HA       PHE  18  -1.336   2.868   3.929
  122   1HB   PHE  18          2HB       PHE  18  -2.216   2.316   1.090
  123   2HB   PHE  18          1HB       PHE  18  -0.701   3.088   1.537
  124    HD1  PHE  18           1HD      PHE  18   0.228   1.511   3.780
  125    HD2  PHE  18           2HD      PHE  18  -1.700   0.255   0.201
  126    HE1  PHE  18           1HE      PHE  18   1.274  -0.707   3.998
  127    HE2  PHE  18           2HE      PHE  18  -0.661  -1.964   0.414
  128    HZ   PHE  18           HZ       PHE  18   0.828  -2.449   2.316
  129    H    ASN  19           H        ASN  19  -1.147   5.008   4.123
  130    HA   ASN  19           HA       ASN  19  -3.408   6.672   3.337
  131   1HB   ASN  19          2HB       ASN  19  -1.166   6.919   5.279
  132   2HB   ASN  19          1HB       ASN  19  -1.826   8.409   4.612
  133   1HD2  ASN  19          1HD2      ASN  19  -3.800   9.108   5.256
  134   2HD2  ASN  19          2HD2      ASN  19  -4.743   8.334   6.480
  135    H    TYR  20           H        TYR  20  -1.018   5.594   1.610
  136    HA   TYR  20           HA       TYR  20  -0.801   8.013   0.027
  137   1HB   TYR  20          2HB       TYR  20   1.579   6.599   1.223
  138   2HB   TYR  20          1HB       TYR  20   1.708   7.636  -0.191
  139    HD1  TYR  20           1HD      TYR  20   0.544  10.030   0.150
  140    HD2  TYR  20           2HD      TYR  20   2.027   7.550   3.273
  141    HE1  TYR  20           1HE      TYR  20   0.749  11.999   1.609
  142    HE2  TYR  20           2HE      TYR  20   2.236   9.511   4.740
  143    HH   TYR  20           HH       TYR  20   0.751  12.354   4.233
  144    H    VAL  21           H        VAL  21  -1.228   7.468  -1.999
  145    HA   VAL  21           HA       VAL  21  -1.677   4.937  -2.957
  146    HB   VAL  21           HB       VAL  21  -0.624   7.199  -4.657
  147   1HG1  VAL  21          1HG1      VAL  21  -2.469   5.989  -6.165
  148   2HG1  VAL  21          2HG1      VAL  21  -1.954   4.611  -5.193
  149   3HG1  VAL  21          3HG1      VAL  21  -0.773   5.503  -6.153
  150   1HG2  VAL  21          1HG2      VAL  21  -3.348   6.715  -3.490
  151   2HG2  VAL  21          2HG2      VAL  21  -3.126   7.654  -4.968
  152   3HG2  VAL  21          3HG2      VAL  21  -2.379   8.190  -3.463
  153    H    LYS  22           H        LYS  22   1.363   6.596  -2.615
  154    HA   LYS  22           HA       LYS  22   2.906   4.993  -4.353
  155   1HB   LYS  22          2HB       LYS  22   4.839   5.916  -3.226
  156   2HB   LYS  22          1HB       LYS  22   3.650   7.186  -3.474
  157   1HG   LYS  22          2HG       LYS  22   2.953   6.346  -1.008
  158   2HG   LYS  22          1HG       LYS  22   4.687   6.019  -0.983
  159   1HD   LYS  22          2HD       LYS  22   4.232   8.256  -0.145
  160   2HD   LYS  22          1HD       LYS  22   5.123   8.337  -1.666
  161   1HE   LYS  22          2HE       LYS  22   2.430   8.338  -2.398
  162   2HE   LYS  22          1HE       LYS  22   2.522   9.399  -0.992
  163   1HZ   LYS  22          1HZ       LYS  22   4.619  10.255  -2.366
  164   2HZ   LYS  22          2HZ       LYS  22   3.067  10.898  -2.565
  165   3HZ   LYS  22          3HZ       LYS  22   3.647   9.740  -3.651
  166    H    THR  23           H        THR  23   1.925   4.641  -1.002
  167    HA   THR  23           HA       THR  23   3.659   2.439  -0.459
  168    HB   THR  23           HB       THR  23   1.162   2.699   1.107
  169    HG1  THR  23           1HG      THR  23   1.889   4.612   2.090
  170   1HG2  THR  23          1HG2      THR  23   3.408   1.419   1.633
  171   2HG2  THR  23          2HG2      THR  23   2.437   2.166   2.902
  172   3HG2  THR  23          3HG2      THR  23   3.864   2.995   2.279
  173    H    TYR  24           H        TYR  24   0.318   2.782  -1.508
  174    HA   TYR  24           HA       TYR  24  -0.361   0.039  -1.356
  175   1HB   TYR  24          2HB       TYR  24  -2.019   1.883  -1.541
  176   2HB   TYR  24          1HB       TYR  24  -1.497   2.152  -3.199
  177    HD1  TYR  24           1HD      TYR  24  -2.200   0.699  -4.974
  178    HD2  TYR  24           2HD      TYR  24  -3.255  -0.170  -0.945
  179    HE1  TYR  24           1HE      TYR  24  -3.822  -0.971  -5.765
  180    HE2  TYR  24           2HE      TYR  24  -4.878  -1.844  -1.725
  181    HH   TYR  24           HH       TYR  24  -5.322  -3.217  -3.662
  182    H    LEU  25           H        LEU  25   1.324   1.984  -3.679
  183    HA   LEU  25           HA       LEU  25   1.190   0.076  -5.819
  184   1HB   LEU  25          2HB       LEU  25   2.866   2.532  -5.331
  185   2HB   LEU  25          1HB       LEU  25   3.093   1.514  -6.741
  186    HG   LEU  25           HG       LEU  25   0.514   2.921  -6.043
  187   1HD1  LEU  25          1HD1      LEU  25   2.633   3.626  -8.068
  188   2HD1  LEU  25          2HD1      LEU  25   2.246   4.528  -6.603
  189   3HD1  LEU  25          3HD1      LEU  25   1.064   4.414  -7.906
  190   1HD2  LEU  25          1HD2      LEU  25  -0.051   1.056  -7.335
  191   2HD2  LEU  25          2HD2      LEU  25   1.391   1.200  -8.340
  192   3HD2  LEU  25          3HD2      LEU  25   0.081   2.370  -8.505
  193    H    ALA  26           H        ALA  26   3.561   0.999  -3.373
  194    HA   ALA  26           HA       ALA  26   5.600  -0.749  -4.199
  195   1HB   ALA  26          1HB       ALA  26   5.014   0.776  -1.711
  196   2HB   ALA  26          2HB       ALA  26   6.399   0.879  -2.798
  197   3HB   ALA  26          3HB       ALA  26   6.260  -0.471  -1.672
  198    H    HIS  27           H        HIS  27   2.742  -1.194  -2.237
  199    HA   HIS  27           HA       HIS  27   3.572  -3.671  -1.077
  200   1HB   HIS  27          2HB       HIS  27   1.872  -2.397   0.059
  201   2HB   HIS  27          1HB       HIS  27   0.841  -2.403  -1.370
  202    HD1  HIS  27           1HD      HIS  27   2.204  -4.826   1.227
  203    HD2  HIS  27           2HD      HIS  27  -0.859  -4.502  -1.556
  204    HE1  HIS  27           1HE      HIS  27   0.727  -6.851   1.554
  205    H    LYS  28           H        LYS  28   1.410  -2.821  -3.773
  206    HA   LYS  28           HA       LYS  28   0.887  -5.531  -4.479
  207   1HB   LYS  28          2HB       LYS  28  -0.308  -3.192  -5.088
  208   2HB   LYS  28          1HB       LYS  28   0.632  -3.432  -6.555
  209   1HG   LYS  28          2HG       LYS  28  -0.416  -5.843  -6.435
  210   2HG   LYS  28          1HG       LYS  28  -1.642  -5.012  -5.475
  211   1HD   LYS  28          2HD       LYS  28  -0.757  -4.229  -8.253
  212   2HD   LYS  28          1HD       LYS  28  -2.242  -5.095  -7.854
  213   1HE   LYS  28          2HE       LYS  28  -3.133  -3.024  -7.864
  214   2HE   LYS  28          1HE       LYS  28  -2.488  -2.968  -6.223
  215   1HZ   LYS  28          1HZ       LYS  28  -1.972  -1.056  -7.854
  216   2HZ   LYS  28          2HZ       LYS  28  -0.814  -2.113  -8.489
  217   3HZ   LYS  28          3HZ       LYS  28  -0.732  -1.647  -6.866
  218    H    GLN  29           H        GLN  29   3.458  -3.339  -5.140
  219    HA   GLN  29           HA       GLN  29   4.377  -4.738  -7.498
  220   1HB   GLN  29          2HB       GLN  29   4.617  -2.227  -7.003
  221   2HB   GLN  29          1HB       GLN  29   5.940  -2.692  -5.945
  222   1HG   GLN  29          2HG       GLN  29   6.591  -4.017  -8.221
  223   2HG   GLN  29          1HG       GLN  29   5.810  -2.575  -8.866
  224   1HE2  GLN  29          1HE2      GLN  29   7.223  -1.074  -9.362
  225   2HE2  GLN  29          2HE2      GLN  29   8.664  -0.694  -8.489
  226    H    PHE  30           H        PHE  30   4.990  -4.793  -4.072
  227    HA   PHE  30           HA       PHE  30   7.233  -6.649  -4.534
  228   1HB   PHE  30          2HB       PHE  30   7.461  -4.377  -3.192
  229   2HB   PHE  30          1HB       PHE  30   6.829  -5.361  -1.876
  230    HD1  PHE  30           1HD      PHE  30   9.729  -4.344  -3.594
  231    HD2  PHE  30           2HD      PHE  30   8.044  -7.630  -1.478
  232    HE1  PHE  30           1HE      PHE  30  11.987  -5.231  -3.181
  233    HE2  PHE  30           2HE      PHE  30  10.299  -8.522  -1.059
  234    HZ   PHE  30           HZ       PHE  30  12.273  -7.322  -1.911
  235    H    TYR  31           H        TYR  31   4.367  -6.084  -2.508
  236    HA   TYR  31           HA       TYR  31   4.613  -8.585  -1.146
  237   1HB   TYR  31          2HB       TYR  31   3.218  -6.278  -0.676
  238   2HB   TYR  31          1HB       TYR  31   1.940  -7.366  -1.208
  239    HD1  TYR  31           1HD      TYR  31   4.459  -6.720   1.378
  240    HD2  TYR  31           2HD      TYR  31   1.305  -9.285   0.124
  241    HE1  TYR  31           1HE      TYR  31   4.390  -7.721   3.623
  242    HE2  TYR  31           2HE      TYR  31   1.226 -10.293   2.366
  243    HH   TYR  31           HH       TYR  31   2.619 -10.577   4.309
  244    H    HIS  32           H        HIS  32   2.903  -7.487  -4.011
  245    HA   HIS  32           HA       HIS  32   1.878 -10.227  -4.354
  246   1HB   HIS  32          2HB       HIS  32   0.719  -7.619  -5.347
  247   2HB   HIS  32          1HB       HIS  32   0.112  -9.208  -5.798
  248    HD1  HIS  32           1HD      HIS  32  -1.449 -10.368  -4.137
  249    HD2  HIS  32           2HD      HIS  32   0.310  -6.922  -2.617
  250    HE1  HIS  32           1HE      HIS  32  -2.624  -9.871  -1.951
  251    H    LYS  33           H        LYS  33   4.437  -8.731  -5.236
  252    HA   LYS  33           HA       LYS  33   5.761  -8.519  -7.092
  253   1HB   LYS  33          2HB       LYS  33   4.482 -11.220  -7.291
  254   2HB   LYS  33          1HB       LYS  33   5.588 -10.682  -8.549
  255   1HG   LYS  33          2HG       LYS  33   6.868 -11.943  -7.025
  256   2HG   LYS  33          1HG       LYS  33   7.272 -10.251  -6.729
  257   1HD   LYS  33          2HD       LYS  33   6.971 -11.444  -4.627
  258   2HD   LYS  33          1HD       LYS  33   5.717 -10.219  -4.832
  259   1HE   LYS  33          2HE       LYS  33   4.906 -12.429  -3.974
  260   2HE   LYS  33          1HE       LYS  33   4.102 -11.859  -5.434
  261   1HZ   LYS  33          1HZ       LYS  33   5.129 -13.442  -6.725
  262   2HZ   LYS  33          2HZ       LYS  33   4.898 -14.297  -5.284
  263   3HZ   LYS  33          3HZ       LYS  33   6.420 -13.658  -5.652
  264    H    ASN  34           H        ASN  34   3.479  -7.019  -7.466
  265    HA   ASN  34           HA       ASN  34   2.236  -5.968  -9.059
  266   1HB   ASN  34          2HB       ASN  34   4.147  -7.212 -11.041
  267   2HB   ASN  34          1HB       ASN  34   3.216  -5.730 -11.236
  268   1HD2  ASN  34          1HD2      ASN  34   5.930  -7.223  -9.642
  269   2HD2  ASN  34          2HD2      ASN  34   6.715  -5.757  -9.175
  270    H    LYS  35           H        LYS  35   1.462  -8.664  -8.287
  271    HA   LYS  35           HA       LYS  35  -0.597  -9.104 -10.144
  272   1HB   LYS  35          2HB       LYS  35   0.105 -11.276 -11.077
  273   2HB   LYS  35          1HB       LYS  35   1.146  -9.960 -11.601
  274   1HG   LYS  35          2HG       LYS  35   2.907 -11.090 -10.889
  275   2HG   LYS  35          1HG       LYS  35   2.278 -11.018  -9.242
  276   1HD   LYS  35          2HD       LYS  35   2.692 -13.321  -9.853
  277   2HD   LYS  35          1HD       LYS  35   0.954 -13.055  -9.694
  278   1HE   LYS  35          2HE       LYS  35   1.624 -14.414 -11.684
  279   2HE   LYS  35          1HE       LYS  35   0.672 -12.979 -12.059
  280   1HZ   LYS  35          1HZ       LYS  35   2.566 -11.857 -12.837
  281   2HZ   LYS  35          2HZ       LYS  35   2.670 -13.408 -13.506
  282   3HZ   LYS  35          3HZ       LYS  35   3.630 -12.995 -12.176
  283    HA   PRO  36           HA       PRO  36  -1.283 -10.975  -6.012
  284   1HB   PRO  36          2HB       PRO  36  -3.892 -10.271  -5.845
  285   2HB   PRO  36          1HB       PRO  36  -2.579  -9.160  -5.437
  286   1HG   PRO  36          2HG       PRO  36  -4.181  -9.352  -7.958
  287   2HG   PRO  36          1HG       PRO  36  -3.685  -7.909  -7.055
  288   1HD   PRO  36          2HD       PRO  36  -2.393  -8.764  -9.282
  289   2HD   PRO  36          1HD       PRO  36  -1.566  -7.921  -7.958
  Start of MODEL    9
    1   1H    GLY   1          1HT       GLY   1 -18.038  -4.508   6.564
    2   2H    GLY   1          2HT       GLY   1 -19.632  -4.550   7.130
    3   3H    GLY   1          3HT       GLY   1 -18.892  -3.066   6.795
    4   1HA   GLY   1          1HA       GLY   1 -19.639  -5.161   4.831
    5   2HA   GLY   1          2HA       GLY   1 -20.403  -3.591   5.024
    6    H    SER   2           H        SER   2 -19.970  -2.552   3.173
    7    HA   SER   2           HA       SER   2 -17.414  -1.505   2.679
    8   1HB   SER   2          2HB       SER   2 -16.669  -3.588   1.860
    9   2HB   SER   2          1HB       SER   2 -18.194  -3.905   1.033
   10    HG   SER   2           HG       SER   2 -16.225  -1.986   0.337
   11    H    ALA   3           H        ALA   3 -17.638   0.305   1.511
   12    HA   ALA   3           HA       ALA   3 -20.213   0.746   0.176
   13   1HB   ALA   3          1HB       ALA   3 -19.803   3.096   0.420
   14   2HB   ALA   3          2HB       ALA   3 -18.147   2.800   0.949
   15   3HB   ALA   3          3HB       ALA   3 -19.500   2.314   1.971
   16    H    ALA   4           H        ALA   4 -19.445  -0.568  -1.654
   17    HA   ALA   4           HA       ALA   4 -18.745  -0.747  -3.809
   18   1HB   ALA   4          1HB       ALA   4 -18.892   2.181  -3.399
   19   2HB   ALA   4          2HB       ALA   4 -19.696   1.159  -4.590
   20   3HB   ALA   4          3HB       ALA   4 -18.006   1.612  -4.814
   21    H    GLU   5           H        GLU   5 -16.619   1.960  -2.981
   22    HA   GLU   5           HA       GLU   5 -14.343   0.748  -2.132
   23   1HB   GLU   5          2HB       GLU   5 -13.047   0.592  -4.370
   24   2HB   GLU   5          1HB       GLU   5 -14.103  -0.737  -3.916
   25   1HG   GLU   5          2HG       GLU   5 -15.448  -0.424  -5.669
   26   2HG   GLU   5          1HG       GLU   5 -15.431   1.330  -5.491
   27    H    VAL   6           H        VAL   6 -14.984   3.060  -1.445
   28    HA   VAL   6           HA       VAL   6 -13.913   5.114  -3.213
   29    HB   VAL   6           HB       VAL   6 -16.029   5.545  -2.022
   30   1HG1  VAL   6          1HG1      VAL   6 -16.028   5.952   0.385
   31   2HG1  VAL   6          2HG1      VAL   6 -14.332   5.475   0.471
   32   3HG1  VAL   6          3HG1      VAL   6 -15.560   4.291   0.021
   33   1HG2  VAL   6          1HG2      VAL   6 -14.981   7.699  -0.767
   34   2HG2  VAL   6          2HG2      VAL   6 -15.222   7.590  -2.510
   35   3HG2  VAL   6          3HG2      VAL   6 -13.638   7.246  -1.817
   36    H    MET   7           H        MET   7 -13.248   3.623  -0.083
   37    HA   MET   7           HA       MET   7 -11.020   5.327   0.502
   38   1HB   MET   7          2HB       MET   7 -12.585   3.780   2.046
   39   2HB   MET   7          1HB       MET   7 -11.237   2.675   1.815
   40   1HG   MET   7          2HG       MET   7  -9.838   4.814   2.480
   41   2HG   MET   7          1HG       MET   7 -11.353   5.260   3.263
   42   1HE   MET   7          1HE       MET   7  -8.205   3.494   5.309
   43   2HE   MET   7          2HE       MET   7  -8.255   4.360   3.773
   44   3HE   MET   7          3HE       MET   7  -8.154   2.599   3.790
   45    H    LYS   8           H        LYS   8  -9.320   5.253  -0.836
   46    HA   LYS   8           HA       LYS   8  -8.439   2.750  -2.004
   47   1HB   LYS   8          2HB       LYS   8  -6.779   4.146  -3.170
   48   2HB   LYS   8          1HB       LYS   8  -8.413   4.759  -3.382
   49   1HG   LYS   8          2HG       LYS   8  -7.993   6.665  -2.248
   50   2HG   LYS   8          1HG       LYS   8  -6.880   5.882  -1.124
   51   1HD   LYS   8          2HD       LYS   8  -5.670   7.443  -2.527
   52   2HD   LYS   8          1HD       LYS   8  -5.185   5.791  -2.915
   53   1HE   LYS   8          2HE       LYS   8  -7.400   7.053  -4.461
   54   2HE   LYS   8          1HE       LYS   8  -5.737   7.522  -4.814
   55   1HZ   LYS   8          1HZ       LYS   8  -7.092   4.986  -5.286
   56   2HZ   LYS   8          2HZ       LYS   8  -5.470   4.897  -4.816
   57   3HZ   LYS   8          3HZ       LYS   8  -5.902   5.765  -6.202
   58    H    LYS   9           H        LYS   9  -5.792   2.792  -2.088
   59    HA   LYS   9           HA       LYS   9  -3.920   2.204  -0.941
   60   1HB   LYS   9          2HB       LYS   9  -4.785   4.120   1.213
   61   2HB   LYS   9          1HB       LYS   9  -3.155   3.696   0.720
   62   1HG   LYS   9          2HG       LYS   9  -3.379   4.920  -1.320
   63   2HG   LYS   9          1HG       LYS   9  -5.090   5.209  -1.009
   64   1HD   LYS   9          2HD       LYS   9  -3.988   6.211   1.253
   65   2HD   LYS   9          1HD       LYS   9  -2.710   6.554   0.084
   66   1HE   LYS   9          2HE       LYS   9  -4.083   7.923  -1.200
   67   2HE   LYS   9          1HE       LYS   9  -5.561   7.233  -0.530
   68   1HZ   LYS   9          1HZ       LYS   9  -5.495   8.590   1.248
   69   2HZ   LYS   9          2HZ       LYS   9  -4.570   9.572   0.228
   70   3HZ   LYS   9          3HZ       LYS   9  -3.807   8.573   1.360
   71    H    TYR  10           H        TYR  10  -5.810   0.364  -0.626
   72    HA   TYR  10           HA       TYR  10  -5.254  -0.680   2.012
   73   1HB   TYR  10          2HB       TYR  10  -7.369   0.732   2.208
   74   2HB   TYR  10          1HB       TYR  10  -8.144  -0.459   1.169
   75    HD1  TYR  10           1HD      TYR  10  -7.621   0.473   4.481
   76    HD2  TYR  10           2HD      TYR  10  -7.771  -2.982   2.004
   77    HE1  TYR  10           1HE      TYR  10  -8.111  -0.913   6.452
   78    HE2  TYR  10           2HE      TYR  10  -8.262  -4.377   3.968
   79    HH   TYR  10           HH       TYR  10  -9.331  -3.239   6.810
   80    H    CYS  11           H        CYS  11  -4.884  -2.806   1.855
   81    HA   CYS  11           HA       CYS  11  -5.456  -4.123  -0.663
   82   1HB   CYS  11          2HB       CYS  11  -3.264  -4.361   0.597
   83   2HB   CYS  11          1HB       CYS  11  -4.134  -5.366   1.748
   84    H    SER  12           H        SER  12  -7.099  -5.411  -1.056
   85    HA   SER  12           HA       SER  12  -8.984  -6.039   1.053
   86   1HB   SER  12          2HB       SER  12 -10.336  -6.972  -0.883
   87   2HB   SER  12          1HB       SER  12  -9.979  -5.246  -0.959
   88    HG   SER  12           HG       SER  12  -9.359  -5.852  -2.908
   89    H    THR  13           H        THR  13  -6.279  -7.419   0.700
   90    HA   THR  13           HA       THR  13  -7.325 -10.142   0.909
   91    HB   THR  13           HB       THR  13  -4.795  -9.362  -0.548
   92    HG1  THR  13           1HG      THR  13  -6.358  -8.952  -1.964
   93   1HG2  THR  13          1HG2      THR  13  -5.157 -11.835  -1.354
   94   2HG2  THR  13          2HG2      THR  13  -5.941 -11.989   0.218
   95   3HG2  THR  13          3HG2      THR  13  -4.259 -11.469   0.118
   96    H    CYS  14           H        CYS  14  -4.824  -7.811   1.726
   97    HA   CYS  14           HA       CYS  14  -3.815  -9.626   3.803
   98   1HB   CYS  14          2HB       CYS  14  -2.659  -7.004   2.838
   99   2HB   CYS  14          1HB       CYS  14  -1.907  -8.115   3.977
  100    H    ASP  15           H        ASP  15  -6.149  -7.347   3.543
  101    HA   ASP  15           HA       ASP  15  -7.243  -5.966   4.972
  102   1HB   ASP  15          2HB       ASP  15  -5.977  -7.829   6.988
  103   2HB   ASP  15          1HB       ASP  15  -7.277  -6.698   7.343
  104    H    ILE  16           H        ILE  16  -4.774  -5.016   4.087
  105    HA   ILE  16           HA       ILE  16  -3.761  -3.563   6.444
  106    HB   ILE  16           HB       ILE  16  -2.272  -3.799   3.843
  107   1HG1  ILE  16          2HG1      ILE  16  -2.742  -6.082   4.656
  108   2HG1  ILE  16          1HG1      ILE  16  -1.032  -5.687   4.769
  109   1HG2  ILE  16          1HG2      ILE  16  -1.627  -2.963   6.638
  110   2HG2  ILE  16          2HG2      ILE  16  -1.298  -2.135   5.115
  111   3HG2  ILE  16          3HG2      ILE  16  -0.352  -3.553   5.572
  112   1HD1  ILE  16          1HD1      ILE  16  -1.181  -5.384   7.122
  113   2HD1  ILE  16          2HD1      ILE  16  -1.960  -6.915   6.725
  114   3HD1  ILE  16          3HD1      ILE  16  -2.940  -5.493   7.080
  115    H    SER  17           H        SER  17  -3.027  -1.330   6.006
  116    HA   SER  17           HA       SER  17  -4.534  -0.055   3.827
  117   1HB   SER  17          2HB       SER  17  -4.659   1.878   5.705
  118   2HB   SER  17          1HB       SER  17  -5.918   0.662   5.493
  119    HG   SER  17           HG       SER  17  -5.275  -0.344   7.274
  120    H    PHE  18           H        PHE  18  -3.752   2.143   3.314
  121    HA   PHE  18           HA       PHE  18  -0.989   2.668   4.079
  122   1HB   PHE  18          2HB       PHE  18  -1.996   2.355   1.248
  123   2HB   PHE  18          1HB       PHE  18  -0.451   3.087   1.656
  124    HD1  PHE  18           1HD      PHE  18   1.269   1.675   2.851
  125    HD2  PHE  18           2HD      PHE  18  -2.252   0.044   1.106
  126    HE1  PHE  18           1HE      PHE  18   2.299  -0.560   2.870
  127    HE2  PHE  18           2HE      PHE  18  -1.231  -2.194   1.123
  128    HZ   PHE  18           HZ       PHE  18   1.047  -2.498   2.005
  129    H    ASN  19           H        ASN  19  -0.506   4.810   4.198
  130    HA   ASN  19           HA       ASN  19  -2.727   6.663   3.875
  131   1HB   ASN  19          2HB       ASN  19  -0.895   6.446   5.842
  132   2HB   ASN  19          1HB       ASN  19  -0.100   7.649   4.831
  133   1HD2  ASN  19          1HD2      ASN  19  -3.442   6.986   5.834
  134   2HD2  ASN  19          2HD2      ASN  19  -3.779   8.595   6.366
  135    H    TYR  20           H        TYR  20  -0.822   5.491   1.688
  136    HA   TYR  20           HA       TYR  20  -0.780   7.907   0.115
  137   1HB   TYR  20          2HB       TYR  20   1.734   6.560   1.049
  138   2HB   TYR  20          1HB       TYR  20   1.695   7.375  -0.511
  139    HD1  TYR  20           1HD      TYR  20   0.218   9.775  -0.115
  140    HD2  TYR  20           2HD      TYR  20   2.874   7.840   2.588
  141    HE1  TYR  20           1HE      TYR  20   0.645  11.927   0.997
  142    HE2  TYR  20           2HE      TYR  20   3.308   9.987   3.707
  143    HH   TYR  20           HH       TYR  20   2.384  12.972   2.383
  144    H    VAL  21           H        VAL  21  -1.384   7.400  -1.890
  145    HA   VAL  21           HA       VAL  21  -2.025   4.838  -2.724
  146    HB   VAL  21           HB       VAL  21  -1.205   6.990  -4.665
  147   1HG1  VAL  21          1HG1      VAL  21  -3.481   5.039  -4.868
  148   2HG1  VAL  21          2HG1      VAL  21  -1.848   4.640  -5.401
  149   3HG1  VAL  21          3HG1      VAL  21  -2.718   5.978  -6.152
  150   1HG2  VAL  21          1HG2      VAL  21  -3.534   6.903  -2.817
  151   2HG2  VAL  21          2HG2      VAL  21  -3.786   7.508  -4.455
  152   3HG2  VAL  21          3HG2      VAL  21  -2.605   8.284  -3.399
  153    H    LYS  22           H        LYS  22   1.017   6.510  -2.825
  154    HA   LYS  22           HA       LYS  22   2.327   4.886  -4.734
  155   1HB   LYS  22          2HB       LYS  22   3.190   7.082  -4.039
  156   2HB   LYS  22          1HB       LYS  22   3.490   6.455  -2.424
  157   1HG   LYS  22          2HG       LYS  22   4.745   5.035  -4.703
  158   2HG   LYS  22          1HG       LYS  22   5.391   6.615  -4.255
  159   1HD   LYS  22          2HD       LYS  22   5.201   5.481  -1.821
  160   2HD   LYS  22          1HD       LYS  22   5.481   4.044  -2.806
  161   1HE   LYS  22          2HE       LYS  22   7.648   4.588  -2.486
  162   2HE   LYS  22          1HE       LYS  22   7.347   5.681  -3.836
  163   1HZ   LYS  22          1HZ       LYS  22   7.358   6.343  -0.947
  164   2HZ   LYS  22          2HZ       LYS  22   6.777   7.399  -2.133
  165   3HZ   LYS  22          3HZ       LYS  22   8.401   6.927  -2.145
  166    H    THR  23           H        THR  23   1.969   4.689  -1.228
  167    HA   THR  23           HA       THR  23   3.703   2.475  -0.886
  168    HB   THR  23           HB       THR  23   1.420   2.866   0.984
  169    HG1  THR  23           1HG      THR  23   3.470   4.772   0.558
  170   1HG2  THR  23          1HG2      THR  23   4.381   2.660   1.471
  171   2HG2  THR  23          2HG2      THR  23   3.242   1.316   1.533
  172   3HG2  THR  23          3HG2      THR  23   3.105   2.642   2.688
  173    H    TYR  24           H        TYR  24   0.238   2.787  -1.439
  174    HA   TYR  24           HA       TYR  24  -0.408   0.063  -1.100
  175   1HB   TYR  24          2HB       TYR  24  -2.044   1.972  -1.188
  176   2HB   TYR  24          1HB       TYR  24  -1.793   2.032  -2.929
  177    HD1  TYR  24           1HD      TYR  24  -3.829   1.366  -3.849
  178    HD2  TYR  24           2HD      TYR  24  -2.134  -0.928  -0.692
  179    HE1  TYR  24           1HE      TYR  24  -5.571  -0.341  -4.162
  180    HE2  TYR  24           2HE      TYR  24  -3.870  -2.642  -0.997
  181    HH   TYR  24           HH       TYR  24  -6.648  -2.124  -2.907
  182    H    LEU  25           H        LEU  25   0.945   1.891  -3.728
  183    HA   LEU  25           HA       LEU  25   0.566  -0.148  -5.717
  184   1HB   LEU  25          2HB       LEU  25   2.093   2.426  -5.573
  185   2HB   LEU  25          1HB       LEU  25   2.419   1.295  -6.874
  186    HG   LEU  25           HG       LEU  25  -0.315   2.428  -6.290
  187   1HD1  LEU  25          1HD1      LEU  25   1.315   3.274  -8.629
  188   2HD1  LEU  25          2HD1      LEU  25   1.637   4.011  -7.060
  189   3HD1  LEU  25          3HD1      LEU  25   0.031   4.130  -7.776
  190   1HD2  LEU  25          1HD2      LEU  25  -0.786   0.591  -7.542
  191   2HD2  LEU  25          2HD2      LEU  25   0.813   0.548  -8.284
  192   3HD2  LEU  25          3HD2      LEU  25  -0.391   1.706  -8.850
  193    H    ALA  26           H        ALA  26   3.192   0.959  -3.645
  194    HA   ALA  26           HA       ALA  26   5.180  -0.767  -4.614
  195   1HB   ALA  26          1HB       ALA  26   5.323   1.302  -3.025
  196   2HB   ALA  26          2HB       ALA  26   6.498  -0.007  -2.887
  197   3HB   ALA  26          3HB       ALA  26   5.147   0.089  -1.758
  198    H    HIS  27           H        HIS  27   2.598  -1.207  -2.277
  199    HA   HIS  27           HA       HIS  27   3.610  -3.594  -1.120
  200   1HB   HIS  27          2HB       HIS  27   1.948  -2.411   0.109
  201   2HB   HIS  27          1HB       HIS  27   0.833  -2.416  -1.255
  202    HD1  HIS  27           1HD      HIS  27   2.309  -4.792   1.313
  203    HD2  HIS  27           2HD      HIS  27  -0.815  -4.570  -1.413
  204    HE1  HIS  27           1HE      HIS  27   0.876  -6.838   1.705
  205    H    LYS  28           H        LYS  28   1.399  -2.955  -3.809
  206    HA   LYS  28           HA       LYS  28   0.854  -5.716  -4.304
  207   1HB   LYS  28          2HB       LYS  28  -0.454  -3.521  -5.002
  208   2HB   LYS  28          1HB       LYS  28   0.544  -3.656  -6.442
  209   1HG   LYS  28          2HG       LYS  28  -0.359  -6.179  -6.277
  210   2HG   LYS  28          1HG       LYS  28  -1.709  -5.320  -5.531
  211   1HD   LYS  28          2HD       LYS  28  -2.358  -5.193  -7.713
  212   2HD   LYS  28          1HD       LYS  28  -1.368  -3.734  -7.631
  213   1HE   LYS  28          2HE       LYS  28   0.336  -4.657  -8.854
  214   2HE   LYS  28          1HE       LYS  28  -0.047  -6.302  -8.347
  215   1HZ   LYS  28          1HZ       LYS  28  -0.695  -6.237 -10.556
  216   2HZ   LYS  28          2HZ       LYS  28  -1.332  -4.674 -10.445
  217   3HZ   LYS  28          3HZ       LYS  28  -2.153  -5.973  -9.738
  218    H    GLN  29           H        GLN  29   3.180  -3.379  -5.492
  219    HA   GLN  29           HA       GLN  29   4.168  -5.166  -7.543
  220   1HB   GLN  29          2HB       GLN  29   4.137  -2.456  -7.310
  221   2HB   GLN  29          1HB       GLN  29   5.787  -2.813  -6.822
  222   1HG   GLN  29          2HG       GLN  29   4.698  -4.036  -9.311
  223   2HG   GLN  29          1HG       GLN  29   5.213  -2.350  -9.319
  224   1HE2  GLN  29          1HE2      GLN  29   7.414  -1.895  -8.680
  225   2HE2  GLN  29          2HE2      GLN  29   8.647  -3.067  -8.981
  226    H    PHE  30           H        PHE  30   4.715  -4.751  -4.222
  227    HA   PHE  30           HA       PHE  30   7.358  -6.034  -4.446
  228   1HB   PHE  30          2HB       PHE  30   7.262  -3.764  -3.338
  229   2HB   PHE  30          1HB       PHE  30   6.320  -4.513  -2.054
  230    HD1  PHE  30           1HD      PHE  30   9.363  -5.577  -3.932
  231    HD2  PHE  30           2HD      PHE  30   7.595  -4.707  -0.160
  232    HE1  PHE  30           1HE      PHE  30  11.444  -6.252  -2.806
  233    HE2  PHE  30           2HE      PHE  30   9.674  -5.378   0.973
  234    HZ   PHE  30           HZ       PHE  30  11.602  -6.151  -0.351
  235    H    TYR  31           H        TYR  31   4.435  -5.938  -2.407
  236    HA   TYR  31           HA       TYR  31   5.103  -8.367  -1.053
  237   1HB   TYR  31          2HB       TYR  31   3.466  -6.319  -0.441
  238   2HB   TYR  31          1HB       TYR  31   2.283  -7.450  -1.088
  239    HD1  TYR  31           1HD      TYR  31   4.426  -6.638   1.704
  240    HD2  TYR  31           2HD      TYR  31   2.043  -9.708  -0.029
  241    HE1  TYR  31           1HE      TYR  31   4.388  -7.819   3.860
  242    HE2  TYR  31           2HE      TYR  31   1.999 -10.897   2.122
  243    HH   TYR  31           HH       TYR  31   3.967 -10.618   4.419
  244    H    HIS  32           H        HIS  32   2.755  -7.509  -3.584
  245    HA   HIS  32           HA       HIS  32   2.145 -10.341  -3.964
  246   1HB   HIS  32          2HB       HIS  32   0.899  -7.854  -5.151
  247   2HB   HIS  32          1HB       HIS  32   0.375  -9.497  -5.504
  248    HD1  HIS  32           1HD      HIS  32  -1.259 -10.549  -3.865
  249    HD2  HIS  32           2HD      HIS  32   0.468  -7.052  -2.431
  250    HE1  HIS  32           1HE      HIS  32  -2.484  -9.974  -1.724
  251    H    LYS  33           H        LYS  33   4.689  -8.867  -4.814
  252    HA   LYS  33           HA       LYS  33   6.100  -8.728  -6.605
  253   1HB   LYS  33          2HB       LYS  33   5.500 -11.300  -6.126
  254   2HB   LYS  33          1HB       LYS  33   4.931 -11.186  -7.785
  255   1HG   LYS  33          2HG       LYS  33   7.287 -10.085  -8.170
  256   2HG   LYS  33          1HG       LYS  33   7.692 -10.984  -6.705
  257   1HD   LYS  33          2HD       LYS  33   6.441 -12.923  -8.047
  258   2HD   LYS  33          1HD       LYS  33   7.009 -11.967  -9.419
  259   1HE   LYS  33          2HE       LYS  33   8.877 -13.204  -9.175
  260   2HE   LYS  33          1HE       LYS  33   9.246 -12.030  -7.913
  261   1HZ   LYS  33          1HZ       LYS  33   7.750 -14.514  -7.334
  262   2HZ   LYS  33          2HZ       LYS  33   8.567 -13.503  -6.253
  263   3HZ   LYS  33          3HZ       LYS  33   9.441 -14.475  -7.324
  264    H    ASN  34           H        ASN  34   3.882  -7.153  -7.044
  265    HA   ASN  34           HA       ASN  34   2.718  -6.059  -8.666
  266   1HB   ASN  34          2HB       ASN  34   5.093  -5.976  -9.572
  267   2HB   ASN  34          1HB       ASN  34   4.642  -7.315 -10.623
  268   1HD2  ASN  34          1HD2      ASN  34   4.846  -6.212 -12.519
  269   2HD2  ASN  34          2HD2      ASN  34   3.797  -4.920 -12.986
  270    H    LYS  35           H        LYS  35   1.897  -8.774  -7.963
  271    HA   LYS  35           HA       LYS  35  -0.113  -9.144  -9.900
  272   1HB   LYS  35          2HB       LYS  35   1.777 -10.036 -11.221
  273   2HB   LYS  35          1HB       LYS  35   2.084 -11.219  -9.958
  274   1HG   LYS  35          2HG       LYS  35  -0.660 -11.182 -11.020
  275   2HG   LYS  35          1HG       LYS  35   0.596 -11.699 -12.147
  276   1HD   LYS  35          2HD       LYS  35   1.334 -13.113  -9.995
  277   2HD   LYS  35          1HD       LYS  35  -0.398 -12.994  -9.678
  278   1HE   LYS  35          2HE       LYS  35   0.271 -15.021 -10.967
  279   2HE   LYS  35          1HE       LYS  35  -0.923 -14.008 -11.778
  280   1HZ   LYS  35          1HZ       LYS  35   0.593 -13.310 -13.334
  281   2HZ   LYS  35          2HZ       LYS  35   1.118 -14.897 -13.078
  282   3HZ   LYS  35          3HZ       LYS  35   1.934 -13.610 -12.347
  283    HA   PRO  36           HA       PRO  36  -0.990 -10.983  -5.782
  284   1HB   PRO  36          2HB       PRO  36  -3.580 -10.190  -5.703
  285   2HB   PRO  36          1HB       PRO  36  -2.244  -9.131  -5.240
  286   1HG   PRO  36          2HG       PRO  36  -3.759  -9.250  -7.820
  287   2HG   PRO  36          1HG       PRO  36  -3.246  -7.831  -6.889
  288   1HD   PRO  36          2HD       PRO  36  -1.901  -8.710  -9.071
  289   2HD   PRO  36          1HD       PRO  36  -1.093  -7.918  -7.704
  Start of MODEL   10
    1   1H    GLY   1          1HT       GLY   1 -18.808  -7.737   5.108
    2   2H    GLY   1          2HT       GLY   1 -18.916  -7.657   6.794
    3   3H    GLY   1          3HT       GLY   1 -19.430  -9.047   5.980
    4   1HA   GLY   1          1HA       GLY   1 -17.135  -9.032   7.145
    5   2HA   GLY   1          2HA       GLY   1 -17.326  -9.802   5.577
    6    H    SER   2           H        SER   2 -17.359  -6.330   6.022
    7    HA   SER   2           HA       SER   2 -16.000  -4.676   5.255
    8   1HB   SER   2          2HB       SER   2 -13.651  -6.543   5.359
    9   2HB   SER   2          1HB       SER   2 -13.725  -4.825   5.750
   10    HG   SER   2           HG       SER   2 -14.056  -5.400   7.731
   11    H    ALA   3           H        ALA   3 -17.296  -6.346   3.346
   12    HA   ALA   3           HA       ALA   3 -15.423  -6.051   1.094
   13   1HB   ALA   3          1HB       ALA   3 -16.293  -8.066   0.067
   14   2HB   ALA   3          2HB       ALA   3 -17.399  -8.306   1.419
   15   3HB   ALA   3          3HB       ALA   3 -15.659  -8.432   1.671
   16    H    ALA   4           H        ALA   4 -16.521  -3.952   0.936
   17    HA   ALA   4           HA       ALA   4 -19.179  -4.173  -0.317
   18   1HB   ALA   4          1HB       ALA   4 -19.379  -1.720   0.274
   19   2HB   ALA   4          2HB       ALA   4 -17.937  -1.938   1.266
   20   3HB   ALA   4          3HB       ALA   4 -19.402  -2.852   1.627
   21    H    GLU   5           H        GLU   5 -16.689  -1.640  -0.358
   22    HA   GLU   5           HA       GLU   5 -15.542  -1.952  -2.797
   23   1HB   GLU   5          2HB       GLU   5 -18.340  -1.134  -3.083
   24   2HB   GLU   5          1HB       GLU   5 -17.221  -0.062  -3.912
   25   1HG   GLU   5          2HG       GLU   5 -16.860  -2.977  -4.294
   26   2HG   GLU   5          1HG       GLU   5 -18.252  -2.213  -5.062
   27    H    VAL   6           H        VAL   6 -14.346  -0.940  -0.861
   28    HA   VAL   6           HA       VAL   6 -14.359   1.988  -1.205
   29    HB   VAL   6           HB       VAL   6 -13.594   0.537   1.329
   30   1HG1  VAL   6          1HG1      VAL   6 -12.460   2.604   1.232
   31   2HG1  VAL   6          2HG1      VAL   6 -13.860   2.875   2.269
   32   3HG1  VAL   6          3HG1      VAL   6 -13.878   3.439   0.598
   33   1HG2  VAL   6          1HG2      VAL   6 -15.852   0.200   1.384
   34   2HG2  VAL   6          2HG2      VAL   6 -16.200   1.608   0.381
   35   3HG2  VAL   6          3HG2      VAL   6 -15.779   1.818   2.081
   36    H    MET   7           H        MET   7 -12.812   1.394  -2.950
   37    HA   MET   7           HA       MET   7 -10.225   0.406  -2.148
   38   1HB   MET   7          2HB       MET   7 -11.530   0.258  -4.479
   39   2HB   MET   7          1HB       MET   7 -10.604   1.720  -4.786
   40   1HG   MET   7          2HG       MET   7  -8.542   0.567  -4.448
   41   2HG   MET   7          1HG       MET   7  -9.384  -0.878  -3.890
   42   1HE   MET   7          1HE       MET   7  -9.062  -2.620  -4.987
   43   2HE   MET   7          2HE       MET   7  -8.821  -2.891  -6.713
   44   3HE   MET   7          3HE       MET   7 -10.455  -2.819  -6.052
   45    H    LYS   8           H        LYS   8  -8.658   1.608  -1.319
   46    HA   LYS   8           HA       LYS   8  -7.816   4.079  -2.307
   47   1HB   LYS   8          2HB       LYS   8  -9.697   5.186  -1.454
   48   2HB   LYS   8          1HB       LYS   8  -9.734   4.204   0.003
   49   1HG   LYS   8          2HG       LYS   8  -8.320   5.554   1.104
   50   2HG   LYS   8          1HG       LYS   8  -7.310   5.826  -0.317
   51   1HD   LYS   8          2HD       LYS   8  -8.389   7.892   0.420
   52   2HD   LYS   8          1HD       LYS   8  -8.947   7.415  -1.186
   53   1HE   LYS   8          2HE       LYS   8 -10.492   6.489   1.182
   54   2HE   LYS   8          1HE       LYS   8 -10.633   8.180   0.702
   55   1HZ   LYS   8          1HZ       LYS   8 -11.659   5.810  -0.584
   56   2HZ   LYS   8          2HZ       LYS   8 -10.917   6.898  -1.645
   57   3HZ   LYS   8          3HZ       LYS   8 -12.201   7.410  -0.671
   58    H    LYS   9           H        LYS   9  -5.879   2.862  -2.068
   59    HA   LYS   9           HA       LYS   9  -3.959   2.200  -1.037
   60   1HB   LYS   9          2HB       LYS   9  -4.698   4.111   1.169
   61   2HB   LYS   9          1HB       LYS   9  -3.095   3.665   0.610
   62   1HG   LYS   9          2HG       LYS   9  -3.078   5.250  -0.951
   63   2HG   LYS   9          1HG       LYS   9  -4.718   4.872  -1.480
   64   1HD   LYS   9          2HD       LYS   9  -5.357   6.034   0.798
   65   2HD   LYS   9          1HD       LYS   9  -3.780   6.798   0.590
   66   1HE   LYS   9          2HE       LYS   9  -4.413   7.838  -1.402
   67   2HE   LYS   9          1HE       LYS   9  -5.787   6.758  -1.636
   68   1HZ   LYS   9          1HZ       LYS   9  -5.588   9.184  -0.071
   69   2HZ   LYS   9          2HZ       LYS   9  -6.414   7.919   0.690
   70   3HZ   LYS   9          3HZ       LYS   9  -6.935   8.484  -0.817
   71    H    TYR  10           H        TYR  10  -5.897   0.401  -0.621
   72    HA   TYR  10           HA       TYR  10  -5.195  -0.672   1.983
   73   1HB   TYR  10          2HB       TYR  10  -7.325   0.733   2.229
   74   2HB   TYR  10          1HB       TYR  10  -8.115  -0.502   1.254
   75    HD1  TYR  10           1HD      TYR  10  -7.319   0.501   4.531
   76    HD2  TYR  10           2HD      TYR  10  -7.805  -2.970   2.118
   77    HE1  TYR  10           1HE      TYR  10  -7.695  -0.847   6.553
   78    HE2  TYR  10           2HE      TYR  10  -8.183  -4.326   4.133
   79    HH   TYR  10           HH       TYR  10  -8.944  -3.096   7.062
   80    H    CYS  11           H        CYS  11  -4.860  -2.803   1.842
   81    HA   CYS  11           HA       CYS  11  -5.450  -4.119  -0.669
   82   1HB   CYS  11          2HB       CYS  11  -3.255  -4.355   0.585
   83   2HB   CYS  11          1HB       CYS  11  -4.124  -5.362   1.738
   84    H    SER  12           H        SER  12  -7.098  -5.404  -1.054
   85    HA   SER  12           HA       SER  12  -8.973  -6.032   1.064
   86   1HB   SER  12          2HB       SER  12  -9.403  -5.277  -1.469
   87   2HB   SER  12          1HB       SER  12  -9.419  -7.025  -1.701
   88    HG   SER  12           HG       SER  12 -10.943  -5.752   0.312
   89    H    THR  13           H        THR  13  -6.268  -7.410   0.695
   90    HA   THR  13           HA       THR  13  -7.310 -10.134   0.905
   91    HB   THR  13           HB       THR  13  -4.790  -9.347  -0.563
   92    HG1  THR  13           1HG      THR  13  -7.196 -10.446  -1.580
   93   1HG2  THR  13          1HG2      THR  13  -4.921 -11.750  -1.353
   94   2HG2  THR  13          2HG2      THR  13  -6.018 -12.021   0.002
   95   3HG2  THR  13          3HG2      THR  13  -4.366 -11.479   0.300
   96    H    CYS  14           H        CYS  14  -4.811  -7.799   1.714
   97    HA   CYS  14           HA       CYS  14  -3.774  -9.615   3.773
   98   1HB   CYS  14          2HB       CYS  14  -2.667  -6.972   2.808
   99   2HB   CYS  14          1HB       CYS  14  -1.894  -8.056   3.959
  100    H    ASP  15           H        ASP  15  -6.086  -7.265   3.508
  101    HA   ASP  15           HA       ASP  15  -7.212  -5.954   4.982
  102   1HB   ASP  15          2HB       ASP  15  -6.552  -8.339   6.318
  103   2HB   ASP  15          1HB       ASP  15  -6.230  -7.046   7.467
  104    H    ILE  16           H        ILE  16  -4.727  -5.012   4.094
  105    HA   ILE  16           HA       ILE  16  -3.733  -3.544   6.448
  106    HB   ILE  16           HB       ILE  16  -2.232  -3.800   3.855
  107   1HG1  ILE  16          2HG1      ILE  16  -2.694  -6.074   4.705
  108   2HG1  ILE  16          1HG1      ILE  16  -0.984  -5.668   4.813
  109   1HG2  ILE  16          1HG2      ILE  16  -1.339  -2.083   5.165
  110   2HG2  ILE  16          2HG2      ILE  16  -0.303  -3.470   5.501
  111   3HG2  ILE  16          3HG2      ILE  16  -1.544  -2.995   6.661
  112   1HD1  ILE  16          1HD1      ILE  16  -2.031  -6.869   6.786
  113   2HD1  ILE  16          2HD1      ILE  16  -2.840  -5.343   7.142
  114   3HD1  ILE  16          3HD1      ILE  16  -1.078  -5.428   7.138
  115    H    SER  17           H        SER  17  -2.999  -1.311   6.004
  116    HA   SER  17           HA       SER  17  -4.476  -0.049   3.800
  117   1HB   SER  17          2HB       SER  17  -5.679   0.151   6.027
  118   2HB   SER  17          1HB       SER  17  -4.328   1.141   6.574
  119    HG   SER  17           HG       SER  17  -5.735   2.587   5.774
  120    H    PHE  18           H        PHE  18  -3.706   2.140   3.292
  121    HA   PHE  18           HA       PHE  18  -0.976   2.716   4.140
  122   1HB   PHE  18          2HB       PHE  18  -1.896   2.418   1.276
  123   2HB   PHE  18          1HB       PHE  18  -0.358   3.120   1.750
  124    HD1  PHE  18           1HD      PHE  18   1.207   1.629   3.164
  125    HD2  PHE  18           2HD      PHE  18  -2.089   0.151   0.913
  126    HE1  PHE  18           1HE      PHE  18   2.205  -0.622   3.184
  127    HE2  PHE  18           2HE      PHE  18  -1.098  -2.100   0.930
  128    HZ   PHE  18           HZ       PHE  18   1.049  -2.490   2.066
  129    H    ASN  19           H        ASN  19  -0.556   4.861   4.313
  130    HA   ASN  19           HA       ASN  19  -2.791   6.676   3.950
  131   1HB   ASN  19          2HB       ASN  19  -0.209   6.736   5.422
  132   2HB   ASN  19          1HB       ASN  19  -0.870   8.284   4.906
  133   1HD2  ASN  19          1HD2      ASN  19  -1.278   5.534   6.965
  134   2HD2  ASN  19          2HD2      ASN  19  -2.552   6.186   7.932
  135    H    TYR  20           H        TYR  20  -0.772   5.537   1.784
  136    HA   TYR  20           HA       TYR  20  -0.851   7.943   0.183
  137   1HB   TYR  20          2HB       TYR  20   1.721   6.653   1.058
  138   2HB   TYR  20          1HB       TYR  20   1.620   7.561  -0.445
  139    HD1  TYR  20           1HD      TYR  20   1.194   9.986  -0.403
  140    HD2  TYR  20           2HD      TYR  20   1.706   7.763   3.188
  141    HE1  TYR  20           1HE      TYR  20   1.560  12.080   0.833
  142    HE2  TYR  20           2HE      TYR  20   2.073   9.850   4.435
  143    HH   TYR  20           HH       TYR  20   1.394  12.915   3.131
  144    H    VAL  21           H        VAL  21  -1.540   7.372  -1.765
  145    HA   VAL  21           HA       VAL  21  -2.069   4.806  -2.606
  146    HB   VAL  21           HB       VAL  21  -1.348   7.029  -4.513
  147   1HG1  VAL  21          1HG1      VAL  21  -3.367   4.805  -4.774
  148   2HG1  VAL  21          2HG1      VAL  21  -1.729   4.743  -5.428
  149   3HG1  VAL  21          3HG1      VAL  21  -2.869   5.952  -6.020
  150   1HG2  VAL  21          1HG2      VAL  21  -3.817   6.618  -2.859
  151   2HG2  VAL  21          2HG2      VAL  21  -3.870   7.487  -4.393
  152   3HG2  VAL  21          3HG2      VAL  21  -2.860   8.084  -3.076
  153    H    LYS  22           H        LYS  22   0.929   6.559  -2.746
  154    HA   LYS  22           HA       LYS  22   2.255   4.971  -4.672
  155   1HB   LYS  22          2HB       LYS  22   3.483   6.481  -2.358
  156   2HB   LYS  22          1HB       LYS  22   4.307   5.956  -3.820
  157   1HG   LYS  22          2HG       LYS  22   3.246   7.553  -5.139
  158   2HG   LYS  22          1HG       LYS  22   1.965   7.817  -3.953
  159   1HD   LYS  22          2HD       LYS  22   3.273   9.169  -2.641
  160   2HD   LYS  22          1HD       LYS  22   4.776   8.408  -3.168
  161   1HE   LYS  22          2HE       LYS  22   3.116  10.009  -5.078
  162   2HE   LYS  22          1HE       LYS  22   4.230  10.807  -3.969
  163   1HZ   LYS  22          1HZ       LYS  22   5.306   8.571  -5.486
  164   2HZ   LYS  22          2HZ       LYS  22   6.022  10.049  -5.081
  165   3HZ   LYS  22          3HZ       LYS  22   4.937   9.962  -6.376
  166    H    THR  23           H        THR  23   1.893   4.720  -1.174
  167    HA   THR  23           HA       THR  23   3.696   2.541  -0.875
  168    HB   THR  23           HB       THR  23   1.468   2.818   1.058
  169    HG1  THR  23           1HG      THR  23   2.095   4.780   1.784
  170   1HG2  THR  23          1HG2      THR  23   3.137   1.494   1.913
  171   2HG2  THR  23          2HG2      THR  23   3.543   3.072   2.588
  172   3HG2  THR  23          3HG2      THR  23   4.422   2.458   1.187
  173    H    TYR  24           H        TYR  24   0.223   2.816  -1.376
  174    HA   TYR  24           HA       TYR  24  -0.400   0.086  -1.051
  175   1HB   TYR  24          2HB       TYR  24  -2.070   1.935  -1.087
  176   2HB   TYR  24          1HB       TYR  24  -1.801   2.101  -2.818
  177    HD1  TYR  24           1HD      TYR  24  -3.804   1.452  -3.813
  178    HD2  TYR  24           2HD      TYR  24  -2.133  -0.983  -0.752
  179    HE1  TYR  24           1HE      TYR  24  -5.519  -0.258  -4.246
  180    HE2  TYR  24           2HE      TYR  24  -3.841  -2.700  -1.177
  181    HH   TYR  24           HH       TYR  24  -5.562  -2.968  -3.820
  182    H    LEU  25           H        LEU  25   0.902   1.950  -3.679
  183    HA   LEU  25           HA       LEU  25   0.518  -0.072  -5.682
  184   1HB   LEU  25          2HB       LEU  25   1.983   2.529  -5.524
  185   2HB   LEU  25          1HB       LEU  25   2.379   1.412  -6.817
  186    HG   LEU  25           HG       LEU  25  -0.469   2.220  -6.352
  187   1HD1  LEU  25          1HD1      LEU  25   0.224   3.880  -8.327
  188   2HD1  LEU  25          2HD1      LEU  25   1.730   3.886  -7.410
  189   3HD1  LEU  25          3HD1      LEU  25   0.220   4.356  -6.629
  190   1HD2  LEU  25          1HD2      LEU  25  -0.833   1.449  -8.485
  191   2HD2  LEU  25          2HD2      LEU  25   0.444   0.358  -7.948
  192   3HD2  LEU  25          3HD2      LEU  25   0.834   1.728  -8.988
  193    H    ALA  26           H        ALA  26   3.166   1.034  -3.633
  194    HA   ALA  26           HA       ALA  26   5.151  -0.668  -4.645
  195   1HB   ALA  26          1HB       ALA  26   4.797   0.941  -2.178
  196   2HB   ALA  26          2HB       ALA  26   6.088   0.979  -3.381
  197   3HB   ALA  26          3HB       ALA  26   6.043  -0.307  -2.174
  198    H    HIS  27           H        HIS  27   2.568  -1.167  -2.338
  199    HA   HIS  27           HA       HIS  27   3.615  -3.567  -1.213
  200   1HB   HIS  27          2HB       HIS  27   1.985  -2.395   0.071
  201   2HB   HIS  27          1HB       HIS  27   0.842  -2.375  -1.267
  202    HD1  HIS  27           1HD      HIS  27   2.355  -4.791   1.237
  203    HD2  HIS  27           2HD      HIS  27  -0.821  -4.520  -1.424
  204    HE1  HIS  27           1HE      HIS  27   0.918  -6.834   1.632
  205    H    LYS  28           H        LYS  28   1.390  -2.861  -3.870
  206    HA   LYS  28           HA       LYS  28   0.779  -5.604  -4.390
  207   1HB   LYS  28          2HB       LYS  28  -0.429  -3.310  -5.075
  208   2HB   LYS  28          1HB       LYS  28   0.491  -3.585  -6.549
  209   1HG   LYS  28          2HG       LYS  28  -0.722  -5.417  -7.132
  210   2HG   LYS  28          1HG       LYS  28  -1.068  -5.860  -5.459
  211   1HD   LYS  28          2HD       LYS  28  -3.093  -5.114  -6.581
  212   2HD   LYS  28          1HD       LYS  28  -2.645  -3.986  -5.300
  213   1HE   LYS  28          2HE       LYS  28  -1.753  -2.434  -6.884
  214   2HE   LYS  28          1HE       LYS  28  -1.922  -3.597  -8.199
  215   1HZ   LYS  28          1HZ       LYS  28  -3.702  -1.696  -7.689
  216   2HZ   LYS  28          2HZ       LYS  28  -4.357  -2.943  -6.754
  217   3HZ   LYS  28          3HZ       LYS  28  -4.108  -3.170  -8.411
  218    H    GLN  29           H        GLN  29   3.137  -3.301  -5.599
  219    HA   GLN  29           HA       GLN  29   4.062  -5.103  -7.665
  220   1HB   GLN  29          2HB       GLN  29   4.084  -2.391  -7.425
  221   2HB   GLN  29          1HB       GLN  29   5.738  -2.782  -6.972
  222   1HG   GLN  29          2HG       GLN  29   5.837  -2.412  -9.264
  223   2HG   GLN  29          1HG       GLN  29   5.813  -4.168  -9.110
  224   1HE2  GLN  29          1HE2      GLN  29   4.483  -5.184 -10.416
  225   2HE2  GLN  29          2HE2      GLN  29   3.057  -4.528 -11.138
  226    H    PHE  30           H        PHE  30   4.663  -4.710  -4.353
  227    HA   PHE  30           HA       PHE  30   7.284  -6.030  -4.618
  228   1HB   PHE  30          2HB       PHE  30   7.105  -3.728  -3.461
  229   2HB   PHE  30          1HB       PHE  30   6.361  -4.611  -2.132
  230    HD1  PHE  30           1HD      PHE  30   9.374  -3.406  -3.417
  231    HD2  PHE  30           2HD      PHE  30   7.724  -6.740  -1.351
  232    HE1  PHE  30           1HE      PHE  30  11.607  -3.970  -2.553
  233    HE2  PHE  30           2HE      PHE  30   9.954  -7.309  -0.481
  234    HZ   PHE  30           HZ       PHE  30  11.899  -5.924  -1.082
  235    H    TYR  31           H        TYR  31   4.399  -5.897  -2.528
  236    HA   TYR  31           HA       TYR  31   5.042  -8.352  -1.209
  237   1HB   TYR  31          2HB       TYR  31   3.536  -6.322  -0.444
  238   2HB   TYR  31          1HB       TYR  31   2.263  -7.252  -1.228
  239    HD1  TYR  31           1HD      TYR  31   4.801  -7.340   1.462
  240    HD2  TYR  31           2HD      TYR  31   1.335  -9.171  -0.189
  241    HE1  TYR  31           1HE      TYR  31   4.570  -8.715   3.488
  242    HE2  TYR  31           2HE      TYR  31   1.093 -10.550   1.832
  243    HH   TYR  31           HH       TYR  31   2.416 -11.374   3.668
  244    H    HIS  32           H        HIS  32   2.749  -7.418  -3.748
  245    HA   HIS  32           HA       HIS  32   2.079 -10.244  -4.148
  246   1HB   HIS  32          2HB       HIS  32   0.782  -7.732  -5.222
  247   2HB   HIS  32          1HB       HIS  32   0.253  -9.367  -5.598
  248    HD1  HIS  32           1HD      HIS  32  -1.286 -10.494  -3.907
  249    HD2  HIS  32           2HD      HIS  32   0.395  -6.964  -2.500
  250    HE1  HIS  32           1HE      HIS  32  -2.465  -9.961  -1.729
  251    H    LYS  33           H        LYS  33   4.625  -9.622  -4.913
  252    HA   LYS  33           HA       LYS  33   4.460 -10.032  -7.796
  253   1HB   LYS  33          2HB       LYS  33   4.837  -7.598  -7.450
  254   2HB   LYS  33          1HB       LYS  33   6.311  -7.980  -6.570
  255   1HG   LYS  33          2HG       LYS  33   7.435  -8.645  -8.468
  256   2HG   LYS  33          1HG       LYS  33   5.949  -8.996  -9.351
  257   1HD   LYS  33          2HD       LYS  33   6.152  -7.001 -10.320
  258   2HD   LYS  33          1HD       LYS  33   5.808  -6.273  -8.751
  259   1HE   LYS  33          2HE       LYS  33   7.954  -5.671  -8.420
  260   2HE   LYS  33          1HE       LYS  33   8.586  -7.153  -9.133
  261   1HZ   LYS  33          1HZ       LYS  33   8.400  -6.275 -11.280
  262   2HZ   LYS  33          2HZ       LYS  33   9.043  -5.008 -10.362
  263   3HZ   LYS  33          3HZ       LYS  33   7.405  -5.000 -10.782
  264    H    ASN  34           H        ASN  34   4.924 -11.949  -5.886
  265    HA   ASN  34           HA       ASN  34   7.337 -13.098  -6.774
  266   1HB   ASN  34          2HB       ASN  34   8.212 -11.341  -5.169
  267   2HB   ASN  34          1HB       ASN  34   7.437 -12.252  -3.877
  268   1HD2  ASN  34          1HD2      ASN  34   8.377 -14.074  -3.121
  269   2HD2  ASN  34          2HD2      ASN  34   9.903 -14.673  -3.666
  270    H    LYS  35           H        LYS  35   4.597 -13.818  -6.493
  271    HA   LYS  35           HA       LYS  35   4.843 -16.433  -5.518
  272   1HB   LYS  35          2HB       LYS  35   4.850 -15.357  -3.312
  273   2HB   LYS  35          1HB       LYS  35   3.325 -14.566  -3.686
  274   1HG   LYS  35          2HG       LYS  35   3.357 -17.505  -3.930
  275   2HG   LYS  35          1HG       LYS  35   3.514 -16.849  -2.299
  276   1HD   LYS  35          2HD       LYS  35   1.494 -15.325  -3.277
  277   2HD   LYS  35          1HD       LYS  35   1.211 -16.845  -4.128
  278   1HE   LYS  35          2HE       LYS  35   0.073 -17.389  -2.264
  279   2HE   LYS  35          1HE       LYS  35   1.675 -17.758  -1.628
  280   1HZ   LYS  35          1HZ       LYS  35   1.753 -15.465  -0.754
  281   2HZ   LYS  35          2HZ       LYS  35   0.512 -16.389  -0.071
  282   3HZ   LYS  35          3HZ       LYS  35   0.153 -15.237  -1.256
  283    HA   PRO  36           HA       PRO  36   1.319 -15.687  -8.378
  284   1HB   PRO  36          2HB       PRO  36   1.689 -17.965  -9.806
  285   2HB   PRO  36          1HB       PRO  36   2.578 -16.473 -10.134
  286   1HG   PRO  36          2HG       PRO  36   3.441 -18.894  -8.597
  287   2HG   PRO  36          1HG       PRO  36   4.351 -17.936  -9.779
  288   1HD   PRO  36          2HD       PRO  36   4.686 -17.651  -7.109
  289   2HD   PRO  36          1HD       PRO  36   4.867 -16.297  -8.242
  Start of MODEL   11
    1   1H    GLY   1          1HT       GLY   1 -21.538 -11.453  -2.393
    2   2H    GLY   1          2HT       GLY   1 -23.153 -11.296  -1.917
    3   3H    GLY   1          3HT       GLY   1 -21.995 -10.204  -1.346
    4   1HA   GLY   1          1HA       GLY   1 -22.603 -10.491  -4.227
    5   2HA   GLY   1          2HA       GLY   1 -23.498  -9.389  -3.193
    6    H    SER   2           H        SER   2 -22.388  -7.614  -2.230
    7    HA   SER   2           HA       SER   2 -19.672  -7.069  -3.101
    8   1HB   SER   2          2HB       SER   2 -20.776  -6.178  -5.002
    9   2HB   SER   2          1HB       SER   2 -22.051  -5.459  -4.020
   10    HG   SER   2           HG       SER   2 -20.862  -3.745  -3.898
   11    H    ALA   3           H        ALA   3 -19.297  -7.178  -0.833
   12    HA   ALA   3           HA       ALA   3 -20.111  -4.726   0.578
   13   1HB   ALA   3          1HB       ALA   3 -20.684  -5.835   2.500
   14   2HB   ALA   3          2HB       ALA   3 -19.663  -7.226   2.133
   15   3HB   ALA   3          3HB       ALA   3 -21.197  -7.011   1.290
   16    H    ALA   4           H        ALA   4 -17.696  -5.320  -0.940
   17    HA   ALA   4           HA       ALA   4 -15.777  -4.439   0.990
   18   1HB   ALA   4          1HB       ALA   4 -15.513  -6.696   1.584
   19   2HB   ALA   4          2HB       ALA   4 -14.177  -6.356   0.484
   20   3HB   ALA   4          3HB       ALA   4 -15.593  -7.234  -0.093
   21    H    GLU   5           H        GLU   5 -14.371  -3.132   0.015
   22    HA   GLU   5           HA       GLU   5 -12.931  -3.448  -2.262
   23   1HB   GLU   5          2HB       GLU   5 -15.723  -2.831  -2.898
   24   2HB   GLU   5          1HB       GLU   5 -14.586  -1.712  -3.636
   25   1HG   GLU   5          2HG       GLU   5 -13.833  -4.525  -3.889
   26   2HG   GLU   5          1HG       GLU   5 -15.346  -4.099  -4.687
   27    H    VAL   6           H        VAL   6 -12.033  -2.295  -0.247
   28    HA   VAL   6           HA       VAL   6 -12.586   0.391   0.293
   29    HB   VAL   6           HB       VAL   6  -9.876  -0.912   0.546
   30   1HG1  VAL   6          1HG1      VAL   6  -9.724   1.423   0.936
   31   2HG1  VAL   6          2HG1      VAL   6  -9.735   0.647   2.520
   32   3HG1  VAL   6          3HG1      VAL   6 -11.195   1.425   1.909
   33   1HG2  VAL   6          1HG2      VAL   6 -12.387  -1.338   2.042
   34   2HG2  VAL   6          2HG2      VAL   6 -10.922  -1.151   3.005
   35   3HG2  VAL   6          3HG2      VAL   6 -11.019  -2.421   1.785
   36    H    MET   7           H        MET   7  -9.858  -0.915  -1.611
   37    HA   MET   7           HA       MET   7  -8.689  -0.064  -3.373
   38   1HB   MET   7          2HB       MET   7 -11.290   0.464  -3.970
   39   2HB   MET   7          1HB       MET   7 -10.610   2.085  -3.996
   40   1HG   MET   7          2HG       MET   7 -10.128   1.608  -6.121
   41   2HG   MET   7          1HG       MET   7  -8.762   0.729  -5.438
   42   1HE   MET   7          1HE       MET   7 -10.312  -2.919  -5.252
   43   2HE   MET   7          2HE       MET   7 -10.501  -1.673  -4.018
   44   3HE   MET   7          3HE       MET   7  -8.938  -1.909  -4.803
   45    H    LYS   8           H        LYS   8  -7.980   2.198  -4.334
   46    HA   LYS   8           HA       LYS   8  -6.972   4.227  -4.042
   47   1HB   LYS   8          2HB       LYS   8  -8.964   4.852  -2.665
   48   2HB   LYS   8          1HB       LYS   8  -8.119   4.251  -1.246
   49   1HG   LYS   8          2HG       LYS   8  -6.405   5.917  -1.489
   50   2HG   LYS   8          1HG       LYS   8  -7.110   6.468  -3.010
   51   1HD   LYS   8          2HD       LYS   8  -8.963   6.447  -0.733
   52   2HD   LYS   8          1HD       LYS   8  -7.615   7.575  -0.577
   53   1HE   LYS   8          2HE       LYS   8  -8.204   8.695  -2.578
   54   2HE   LYS   8          1HE       LYS   8  -9.336   7.425  -3.040
   55   1HZ   LYS   8          1HZ       LYS   8 -10.892   8.137  -1.523
   56   2HZ   LYS   8          2HZ       LYS   8 -10.221   9.608  -2.017
   57   3HZ   LYS   8          3HZ       LYS   8  -9.759   8.923  -0.542
   58    H    LYS   9           H        LYS   9  -6.834   2.796  -0.775
   59    HA   LYS   9           HA       LYS   9  -4.055   2.094  -1.120
   60   1HB   LYS   9          2HB       LYS   9  -3.432   3.495   0.941
   61   2HB   LYS   9          1HB       LYS   9  -3.591   4.327  -0.596
   62   1HG   LYS   9          2HG       LYS   9  -6.022   4.774   0.181
   63   2HG   LYS   9          1HG       LYS   9  -5.392   4.393   1.785
   64   1HD   LYS   9          2HD       LYS   9  -3.504   6.099   1.032
   65   2HD   LYS   9          1HD       LYS   9  -4.808   6.700   0.005
   66   1HE   LYS   9          2HE       LYS   9  -6.110   6.442   2.358
   67   2HE   LYS   9          1HE       LYS   9  -4.486   6.819   2.931
   68   1HZ   LYS   9          1HZ       LYS   9  -5.621   8.857   2.667
   69   2HZ   LYS   9          2HZ       LYS   9  -6.188   8.444   1.128
   70   3HZ   LYS   9          3HZ       LYS   9  -4.542   8.755   1.368
   71    H    TYR  10           H        TYR  10  -5.867   0.288  -0.692
   72    HA   TYR  10           HA       TYR  10  -5.278  -0.692   1.963
   73   1HB   TYR  10          2HB       TYR  10  -7.295   0.588   2.424
   74   2HB   TYR  10          1HB       TYR  10  -8.130  -0.188   1.084
   75    HD1  TYR  10           1HD      TYR  10  -7.439  -0.313   4.569
   76    HD2  TYR  10           2HD      TYR  10  -8.445  -2.747   1.230
   77    HE1  TYR  10           1HE      TYR  10  -8.244  -2.063   6.096
   78    HE2  TYR  10           2HE      TYR  10  -9.255  -4.504   2.747
   79    HH   TYR  10           HH       TYR  10  -9.013  -5.233   5.017
   80    H    CYS  11           H        CYS  11  -4.887  -2.818   1.833
   81    HA   CYS  11           HA       CYS  11  -5.471  -4.178  -0.657
   82   1HB   CYS  11          2HB       CYS  11  -3.267  -4.362   0.606
   83   2HB   CYS  11          1HB       CYS  11  -4.123  -5.386   1.754
   84    H    SER  12           H        SER  12  -7.110  -5.477  -1.018
   85    HA   SER  12           HA       SER  12  -8.961  -6.109   1.120
   86   1HB   SER  12          2HB       SER  12 -10.160  -7.225  -0.964
   87   2HB   SER  12          1HB       SER  12 -10.184  -5.478  -0.726
   88    HG   SER  12           HG       SER  12  -9.539  -5.764  -2.796
   89    H    THR  13           H        THR  13  -6.243  -7.463   0.733
   90    HA   THR  13           HA       THR  13  -7.254 -10.194   0.986
   91    HB   THR  13           HB       THR  13  -4.761  -9.400  -0.524
   92    HG1  THR  13           1HG      THR  13  -6.707  -8.998  -1.669
   93   1HG2  THR  13          1HG2      THR  13  -5.041 -11.736   0.735
   94   2HG2  THR  13          2HG2      THR  13  -4.213 -11.562  -0.812
   95   3HG2  THR  13          3HG2      THR  13  -5.888 -12.111  -0.765
   96    H    CYS  14           H        CYS  14  -4.769  -7.826   1.735
   97    HA   CYS  14           HA       CYS  14  -3.673  -9.605   3.793
   98   1HB   CYS  14          2HB       CYS  14  -2.645  -6.944   2.787
   99   2HB   CYS  14          1HB       CYS  14  -1.836  -7.981   3.956
  100    H    ASP  15           H        ASP  15  -6.015  -7.261   3.527
  101    HA   ASP  15           HA       ASP  15  -7.164  -5.985   5.012
  102   1HB   ASP  15          2HB       ASP  15  -6.454  -8.354   6.345
  103   2HB   ASP  15          1HB       ASP  15  -6.137  -7.057   7.489
  104    H    ILE  16           H        ILE  16  -4.708  -4.994   4.104
  105    HA   ILE  16           HA       ILE  16  -3.745  -3.485   6.446
  106    HB   ILE  16           HB       ILE  16  -2.205  -3.765   3.879
  107   1HG1  ILE  16          2HG1      ILE  16  -2.648  -6.032   4.749
  108   2HG1  ILE  16          1HG1      ILE  16  -0.946  -5.602   4.888
  109   1HG2  ILE  16          1HG2      ILE  16  -1.559  -2.923   6.686
  110   2HG2  ILE  16          2HG2      ILE  16  -1.361  -2.015   5.187
  111   3HG2  ILE  16          3HG2      ILE  16  -0.302  -3.382   5.536
  112   1HD1  ILE  16          1HD1      ILE  16  -2.046  -6.791   6.854
  113   2HD1  ILE  16          2HD1      ILE  16  -2.840  -5.250   7.179
  114   3HD1  ILE  16          3HD1      ILE  16  -1.080  -5.357   7.201
  115    H    SER  17           H        SER  17  -3.037  -1.256   5.981
  116    HA   SER  17           HA       SER  17  -4.496  -0.039   3.739
  117   1HB   SER  17          2HB       SER  17  -4.658   1.902   5.665
  118   2HB   SER  17          1HB       SER  17  -5.948   0.762   5.283
  119    HG   SER  17           HG       SER  17  -3.947   0.389   7.262
  120    H    PHE  18           H        PHE  18  -3.719   2.145   3.193
  121    HA   PHE  18           HA       PHE  18  -0.980   2.692   4.053
  122   1HB   PHE  18          2HB       PHE  18  -1.929   2.445   1.194
  123   2HB   PHE  18          1HB       PHE  18  -0.386   3.143   1.659
  124    HD1  PHE  18           1HD      PHE  18   1.293   1.690   2.844
  125    HD2  PHE  18           2HD      PHE  18  -2.222   0.133   1.020
  126    HE1  PHE  18           1HE      PHE  18   2.293  -0.559   2.845
  127    HE2  PHE  18           2HE      PHE  18  -1.230  -2.118   1.018
  128    HZ   PHE  18           HZ       PHE  18   1.029  -2.467   1.932
  129    H    ASN  19           H        ASN  19  -0.525   4.811   4.281
  130    HA   ASN  19           HA       ASN  19  -2.719   6.683   4.001
  131   1HB   ASN  19          2HB       ASN  19  -0.045   6.727   5.342
  132   2HB   ASN  19          1HB       ASN  19  -0.843   8.255   4.983
  133   1HD2  ASN  19          1HD2      ASN  19  -3.199   8.309   5.668
  134   2HD2  ASN  19          2HD2      ASN  19  -3.555   7.660   7.229
  135    H    TYR  20           H        TYR  20  -0.627   5.561   1.821
  136    HA   TYR  20           HA       TYR  20  -0.751   7.999   0.250
  137   1HB   TYR  20          2HB       TYR  20   1.821   6.662   1.059
  138   2HB   TYR  20          1HB       TYR  20   1.708   7.614  -0.418
  139    HD1  TYR  20           1HD      TYR  20   1.431  10.028  -0.325
  140    HD2  TYR  20           2HD      TYR  20   1.717   7.724   3.239
  141    HE1  TYR  20           1HE      TYR  20   1.834  12.083   0.964
  142    HE2  TYR  20           2HE      TYR  20   2.120   9.773   4.539
  143    HH   TYR  20           HH       TYR  20   1.632  12.227   4.307
  144    H    VAL  21           H        VAL  21  -1.453   7.488  -1.710
  145    HA   VAL  21           HA       VAL  21  -2.050   4.964  -2.610
  146    HB   VAL  21           HB       VAL  21  -1.265   7.236  -4.436
  147   1HG1  VAL  21          1HG1      VAL  21  -2.751   4.683  -4.759
  148   2HG1  VAL  21          2HG1      VAL  21  -1.639   5.494  -5.863
  149   3HG1  VAL  21          3HG1      VAL  21  -3.292   6.083  -5.684
  150   1HG2  VAL  21          1HG2      VAL  21  -2.818   8.344  -3.196
  151   2HG2  VAL  21          2HG2      VAL  21  -3.626   6.864  -2.680
  152   3HG2  VAL  21          3HG2      VAL  21  -3.907   7.502  -4.299
  153    H    LYS  22           H        LYS  22   0.998   6.644  -2.757
  154    HA   LYS  22           HA       LYS  22   2.261   5.035  -4.705
  155   1HB   LYS  22          2HB       LYS  22   3.549   6.510  -2.402
  156   2HB   LYS  22          1HB       LYS  22   4.347   5.967  -3.871
  157   1HG   LYS  22          2HG       LYS  22   2.213   8.080  -3.666
  158   2HG   LYS  22          1HG       LYS  22   3.930   8.337  -3.984
  159   1HD   LYS  22          2HD       LYS  22   3.491   6.715  -5.992
  160   2HD   LYS  22          1HD       LYS  22   1.813   7.212  -5.764
  161   1HE   LYS  22          2HE       LYS  22   4.185   8.970  -6.360
  162   2HE   LYS  22          1HE       LYS  22   2.796   8.653  -7.398
  163   1HZ   LYS  22          1HZ       LYS  22   2.377  10.728  -6.462
  164   2HZ   LYS  22          2HZ       LYS  22   2.906  10.264  -4.924
  165   3HZ   LYS  22          3HZ       LYS  22   1.439   9.676  -5.526
  166    H    THR  23           H        THR  23   1.873   4.734  -1.223
  167    HA   THR  23           HA       THR  23   3.669   2.546  -0.940
  168    HB   THR  23           HB       THR  23   1.432   2.806   0.983
  169    HG1  THR  23           1HG      THR  23   3.355   4.855   0.614
  170   1HG2  THR  23          1HG2      THR  23   4.418   2.759   1.328
  171   2HG2  THR  23          2HG2      THR  23   3.321   1.393   1.525
  172   3HG2  THR  23          3HG2      THR  23   3.230   2.764   2.630
  173    H    TYR  24           H        TYR  24   0.197   2.836  -1.458
  174    HA   TYR  24           HA       TYR  24  -0.438   0.108  -1.163
  175   1HB   TYR  24          2HB       TYR  24  -2.118   1.933  -1.215
  176   2HB   TYR  24          1HB       TYR  24  -1.791   2.160  -2.928
  177    HD1  TYR  24           1HD      TYR  24  -3.662   1.481  -4.112
  178    HD2  TYR  24           2HD      TYR  24  -2.285  -0.929  -0.887
  179    HE1  TYR  24           1HE      TYR  24  -5.356  -0.214  -4.662
  180    HE2  TYR  24           2HE      TYR  24  -3.976  -2.631  -1.428
  181    HH   TYR  24           HH       TYR  24  -5.565  -2.804  -4.273
  182    H    LEU  25           H        LEU  25   0.887   1.983  -3.776
  183    HA   LEU  25           HA       LEU  25   0.559  -0.058  -5.775
  184   1HB   LEU  25          2HB       LEU  25   2.237   2.450  -5.679
  185   2HB   LEU  25          1HB       LEU  25   2.185   1.378  -7.066
  186    HG   LEU  25           HG       LEU  25  -0.332   2.601  -5.977
  187   1HD1  LEU  25          1HD1      LEU  25   0.149   4.222  -8.016
  188   2HD1  LEU  25          2HD1      LEU  25   1.820   3.898  -7.554
  189   3HD1  LEU  25          3HD1      LEU  25   0.700   4.588  -6.381
  190   1HD2  LEU  25          1HD2      LEU  25  -0.952   2.367  -8.415
  191   2HD2  LEU  25          2HD2      LEU  25  -0.733   0.860  -7.525
  192   3HD2  LEU  25          3HD2      LEU  25   0.532   1.434  -8.611
  193    H    ALA  26           H        ALA  26   3.137   1.088  -3.671
  194    HA   ALA  26           HA       ALA  26   5.179  -0.568  -4.646
  195   1HB   ALA  26          1HB       ALA  26   5.729   1.321  -3.276
  196   2HB   ALA  26          2HB       ALA  26   6.264  -0.138  -2.443
  197   3HB   ALA  26          3HB       ALA  26   4.787   0.678  -1.930
  198    H    HIS  27           H        HIS  27   2.649  -1.075  -2.241
  199    HA   HIS  27           HA       HIS  27   3.652  -3.478  -1.162
  200   1HB   HIS  27          2HB       HIS  27   1.922  -2.337   0.030
  201   2HB   HIS  27          1HB       HIS  27   0.845  -2.378  -1.361
  202    HD1  HIS  27           1HD      HIS  27   2.442  -4.812   1.102
  203    HD2  HIS  27           2HD      HIS  27  -0.844  -4.476  -1.416
  204    HE1  HIS  27           1HE      HIS  27   1.019  -6.863   1.509
  205    H    LYS  28           H        LYS  28   1.133  -2.964  -3.638
  206    HA   LYS  28           HA       LYS  28   0.772  -5.658  -4.297
  207   1HB   LYS  28          2HB       LYS  28  -0.503  -3.433  -5.007
  208   2HB   LYS  28          1HB       LYS  28   0.513  -3.593  -6.432
  209   1HG   LYS  28          2HG       LYS  28  -0.577  -5.435  -7.175
  210   2HG   LYS  28          1HG       LYS  28  -0.951  -6.007  -5.547
  211   1HD   LYS  28          2HD       LYS  28  -2.252  -3.484  -6.332
  212   2HD   LYS  28          1HD       LYS  28  -2.767  -4.914  -7.231
  213   1HE   LYS  28          2HE       LYS  28  -4.200  -4.621  -5.318
  214   2HE   LYS  28          1HE       LYS  28  -3.206  -6.059  -5.085
  215   1HZ   LYS  28          1HZ       LYS  28  -3.246  -4.827  -3.062
  216   2HZ   LYS  28          2HZ       LYS  28  -2.806  -3.393  -3.843
  217   3HZ   LYS  28          3HZ       LYS  28  -1.697  -4.665  -3.724
  218    H    GLN  29           H        GLN  29   3.144  -3.311  -5.352
  219    HA   GLN  29           HA       GLN  29   4.183  -5.045  -7.425
  220   1HB   GLN  29          2HB       GLN  29   4.210  -2.317  -7.013
  221   2HB   GLN  29          1HB       GLN  29   5.864  -2.785  -6.641
  222   1HG   GLN  29          2HG       GLN  29   5.651  -2.158  -8.966
  223   2HG   GLN  29          1HG       GLN  29   6.049  -3.869  -8.820
  224   1HE2  GLN  29          1HE2      GLN  29   3.780  -1.556  -9.921
  225   2HE2  GLN  29          2HE2      GLN  29   2.652  -2.661 -10.623
  226    H    PHE  30           H        PHE  30   4.549  -4.873  -4.092
  227    HA   PHE  30           HA       PHE  30   7.259  -6.012  -4.225
  228   1HB   PHE  30          2HB       PHE  30   5.844  -4.380  -2.156
  229   2HB   PHE  30          1HB       PHE  30   7.097  -5.504  -1.647
  230    HD1  PHE  30           1HD      PHE  30   6.830  -3.276  -4.622
  231    HD2  PHE  30           2HD      PHE  30   8.965  -4.288  -1.082
  232    HE1  PHE  30           1HE      PHE  30   8.550  -1.610  -5.187
  233    HE2  PHE  30           2HE      PHE  30  10.689  -2.623  -1.641
  234    HZ   PHE  30           HZ       PHE  30  10.483  -1.281  -3.697
  235    H    TYR  31           H        TYR  31   4.305  -6.287  -2.231
  236    HA   TYR  31           HA       TYR  31   4.997  -8.916  -1.342
  237   1HB   TYR  31          2HB       TYR  31   3.386  -6.995  -0.344
  238   2HB   TYR  31          1HB       TYR  31   2.183  -8.019  -1.121
  239    HD1  TYR  31           1HD      TYR  31   5.072  -8.205   1.231
  240    HD2  TYR  31           2HD      TYR  31   1.346  -9.863   0.018
  241    HE1  TYR  31           1HE      TYR  31   5.123  -9.721   3.166
  242    HE2  TYR  31           2HE      TYR  31   1.386 -11.383   1.949
  243    HH   TYR  31           HH       TYR  31   2.868 -11.066   4.510
  244    H    HIS  32           H        HIS  32   2.581  -7.631  -3.612
  245    HA   HIS  32           HA       HIS  32   1.929 -10.352  -4.452
  246   1HB   HIS  32          2HB       HIS  32   0.683  -7.727  -5.289
  247   2HB   HIS  32          1HB       HIS  32   0.083  -9.332  -5.687
  248    HD1  HIS  32           1HD      HIS  32  -1.326 -10.529  -3.901
  249    HD2  HIS  32           2HD      HIS  32   0.327  -6.947  -2.600
  250    HE1  HIS  32           1HE      HIS  32  -2.433  -9.996  -1.687
  251    H    LYS  33           H        LYS  33   4.504  -9.581  -5.107
  252    HA   LYS  33           HA       LYS  33   4.487  -9.992  -7.930
  253   1HB   LYS  33          2HB       LYS  33   4.130  -7.451  -7.563
  254   2HB   LYS  33          1HB       LYS  33   5.824  -7.436  -7.092
  255   1HG   LYS  33          2HG       LYS  33   5.753  -6.842  -9.373
  256   2HG   LYS  33          1HG       LYS  33   6.342  -8.504  -9.308
  257   1HD   LYS  33          2HD       LYS  33   3.798  -9.086  -9.582
  258   2HD   LYS  33          1HD       LYS  33   3.712  -7.453 -10.247
  259   1HE   LYS  33          2HE       LYS  33   4.072  -9.254 -11.944
  260   2HE   LYS  33          1HE       LYS  33   5.292  -7.980 -11.950
  261   1HZ   LYS  33          1HZ       LYS  33   6.030 -10.432 -12.054
  262   2HZ   LYS  33          2HZ       LYS  33   5.734 -10.439 -10.389
  263   3HZ   LYS  33          3HZ       LYS  33   6.871  -9.369 -11.040
  264    H    ASN  34           H        ASN  34   5.509 -11.489  -5.872
  265    HA   ASN  34           HA       ASN  34   8.216 -11.804  -6.686
  266   1HB   ASN  34          2HB       ASN  34   9.295 -11.385  -4.517
  267   2HB   ASN  34          1HB       ASN  34   8.556  -9.920  -5.156
  268   1HD2  ASN  34          1HD2      ASN  34   9.060  -9.708  -2.651
  269   2HD2  ASN  34          2HD2      ASN  34   7.673  -9.942  -1.649
  270    H    LYS  35           H        LYS  35   5.804 -13.366  -6.491
  271    HA   LYS  35           HA       LYS  35   6.536 -15.359  -4.457
  272   1HB   LYS  35          2HB       LYS  35   3.970 -14.577  -5.749
  273   2HB   LYS  35          1HB       LYS  35   4.171 -16.263  -5.293
  274   1HG   LYS  35          2HG       LYS  35   4.363 -15.747  -3.021
  275   2HG   LYS  35          1HG       LYS  35   4.677 -14.041  -3.346
  276   1HD   LYS  35          2HD       LYS  35   2.276 -14.195  -4.458
  277   2HD   LYS  35          1HD       LYS  35   2.107 -15.538  -3.325
  278   1HE   LYS  35          2HE       LYS  35   2.880 -12.710  -2.613
  279   2HE   LYS  35          1HE       LYS  35   1.293 -13.436  -2.368
  280   1HZ   LYS  35          1HZ       LYS  35   3.172 -13.379  -0.500
  281   2HZ   LYS  35          2HZ       LYS  35   3.547 -14.865  -1.215
  282   3HZ   LYS  35          3HZ       LYS  35   1.999 -14.597  -0.588
  283    HA   PRO  36           HA       PRO  36   8.014 -17.323  -8.345
  284   1HB   PRO  36          2HB       PRO  36  10.013 -18.722  -7.161
  285   2HB   PRO  36          1HB       PRO  36  10.190 -17.036  -7.661
  286   1HG   PRO  36          2HG       PRO  36   9.617 -18.156  -4.944
  287   2HG   PRO  36          1HG       PRO  36  10.726 -16.851  -5.405
  288   1HD   PRO  36          2HD       PRO  36   8.270 -16.378  -4.364
  289   2HD   PRO  36          1HD       PRO  36   9.034 -15.291  -5.542
  Start of MODEL   12
    1   1H    GLY   1          1HT       GLY   1 -18.775  16.123   3.629
    2   2H    GLY   1          2HT       GLY   1 -17.925  17.514   4.077
    3   3H    GLY   1          3HT       GLY   1 -17.096  16.188   3.435
    4   1HA   GLY   1          1HA       GLY   1 -18.838  18.127   2.060
    5   2HA   GLY   1          2HA       GLY   1 -17.200  17.642   1.650
    6    H    SER   2           H        SER   2 -17.559  16.995  -0.428
    7    HA   SER   2           HA       SER   2 -19.731  15.212  -1.082
    8   1HB   SER   2          2HB       SER   2 -19.198  16.728  -2.811
    9   2HB   SER   2          1HB       SER   2 -17.468  16.425  -2.660
   10    HG   SER   2           HG       SER   2 -19.433  14.633  -3.651
   11    H    ALA   3           H        ALA   3 -19.526  13.077  -1.844
   12    HA   ALA   3           HA       ALA   3 -16.954  11.745  -1.479
   13   1HB   ALA   3          1HB       ALA   3 -18.641  11.725   0.613
   14   2HB   ALA   3          2HB       ALA   3 -17.537  10.401   0.239
   15   3HB   ALA   3          3HB       ALA   3 -19.225  10.310  -0.263
   16    H    ALA   4           H        ALA   4 -16.796  11.172  -3.598
   17    HA   ALA   4           HA       ALA   4 -19.046   9.840  -4.895
   18   1HB   ALA   4          1HB       ALA   4 -16.467  11.004  -5.867
   19   2HB   ALA   4          2HB       ALA   4 -18.119  11.379  -6.358
   20   3HB   ALA   4          3HB       ALA   4 -17.370   9.867  -6.870
   21    H    GLU   5           H        GLU   5 -15.613   9.226  -4.194
   22    HA   GLU   5           HA       GLU   5 -15.764   6.674  -3.282
   23   1HB   GLU   5          2HB       GLU   5 -15.070   5.381  -5.413
   24   2HB   GLU   5          1HB       GLU   5 -16.774   5.737  -5.167
   25   1HG   GLU   5          2HG       GLU   5 -16.889   7.065  -6.964
   26   2HG   GLU   5          1HG       GLU   5 -15.309   7.785  -6.661
   27    H    VAL   6           H        VAL   6 -14.081   8.310  -2.443
   28    HA   VAL   6           HA       VAL   6 -11.555   8.115  -3.919
   29    HB   VAL   6           HB       VAL   6 -12.057   9.714  -1.411
   30   1HG1  VAL   6          1HG1      VAL   6  -9.951  10.426  -1.606
   31   2HG1  VAL   6          2HG1      VAL   6 -10.120  10.703  -3.341
   32   3HG1  VAL   6          3HG1      VAL   6  -9.719   9.095  -2.738
   33   1HG2  VAL   6          1HG2      VAL   6 -13.547  10.804  -2.745
   34   2HG2  VAL   6          2HG2      VAL   6 -12.753  10.298  -4.235
   35   3HG2  VAL   6          3HG2      VAL   6 -12.071  11.610  -3.275
   36    H    MET   7           H        MET   7 -12.738   5.839  -2.497
   37    HA   MET   7           HA       MET   7 -11.048   5.478  -0.168
   38   1HB   MET   7          2HB       MET   7 -12.947   3.500  -1.433
   39   2HB   MET   7          1HB       MET   7 -12.247   3.413   0.178
   40   1HG   MET   7          2HG       MET   7 -13.482   5.817   0.290
   41   2HG   MET   7          1HG       MET   7 -14.548   4.943  -0.808
   42   1HE   MET   7          1HE       MET   7 -14.345   6.223   2.195
   43   2HE   MET   7          2HE       MET   7 -14.914   5.119   3.448
   44   3HE   MET   7          3HE       MET   7 -16.025   5.689   2.202
   45    H    LYS   8           H        LYS   8  -8.970   5.066  -0.621
   46    HA   LYS   8           HA       LYS   8  -8.361   2.701  -2.192
   47   1HB   LYS   8          2HB       LYS   8  -6.735   3.780  -3.606
   48   2HB   LYS   8          1HB       LYS   8  -8.282   4.591  -3.799
   49   1HG   LYS   8          2HG       LYS   8  -5.924   5.571  -2.209
   50   2HG   LYS   8          1HG       LYS   8  -6.513   6.215  -3.737
   51   1HD   LYS   8          2HD       LYS   8  -8.751   6.459  -2.325
   52   2HD   LYS   8          1HD       LYS   8  -7.597   6.527  -0.991
   53   1HE   LYS   8          2HE       LYS   8  -7.838   8.360  -3.358
   54   2HE   LYS   8          1HE       LYS   8  -7.929   8.762  -1.644
   55   1HZ   LYS   8          1HZ       LYS   8  -5.819   9.437  -2.157
   56   2HZ   LYS   8          2HZ       LYS   8  -5.568   8.214  -3.300
   57   3HZ   LYS   8          3HZ       LYS   8  -5.504   7.853  -1.648
   58    H    LYS   9           H        LYS   9  -5.780   2.479  -2.163
   59    HA   LYS   9           HA       LYS   9  -3.889   2.148  -0.936
   60   1HB   LYS   9          2HB       LYS   9  -4.780   3.977   1.244
   61   2HB   LYS   9          1HB       LYS   9  -3.180   3.747   0.561
   62   1HG   LYS   9          2HG       LYS   9  -4.214   4.851  -1.550
   63   2HG   LYS   9          1HG       LYS   9  -5.426   5.440  -0.409
   64   1HD   LYS   9          2HD       LYS   9  -2.631   5.764   0.449
   65   2HD   LYS   9          1HD       LYS   9  -3.102   6.716  -0.960
   66   1HE   LYS   9          2HE       LYS   9  -3.406   7.794   1.330
   67   2HE   LYS   9          1HE       LYS   9  -4.776   7.850   0.221
   68   1HZ   LYS   9          1HZ       LYS   9  -4.522   5.699   2.228
   69   2HZ   LYS   9          2HZ       LYS   9  -5.908   6.235   1.422
   70   3HZ   LYS   9          3HZ       LYS   9  -5.211   7.190   2.630
   71    H    TYR  10           H        TYR  10  -5.826   0.298  -0.662
   72    HA   TYR  10           HA       TYR  10  -5.343  -0.673   2.019
   73   1HB   TYR  10          2HB       TYR  10  -7.383   0.674   2.318
   74   2HB   TYR  10          1HB       TYR  10  -8.177  -0.247   1.046
   75    HD1  TYR  10           1HD      TYR  10  -7.628   0.009   4.526
   76    HD2  TYR  10           2HD      TYR  10  -8.311  -2.829   1.431
   77    HE1  TYR  10           1HE      TYR  10  -8.397  -1.621   6.198
   78    HE2  TYR  10           2HE      TYR  10  -9.083  -4.467   3.095
   79    HH   TYR  10           HH       TYR  10  -8.902  -4.931   5.444
   80    H    CYS  11           H        CYS  11  -5.021  -2.813   1.970
   81    HA   CYS  11           HA       CYS  11  -5.679  -4.232  -0.502
   82   1HB   CYS  11          2HB       CYS  11  -3.350  -4.279   0.617
   83   2HB   CYS  11          1HB       CYS  11  -4.078  -5.387   1.769
   84    H    SER  12           H        SER  12  -7.351  -5.545  -0.635
   85    HA   SER  12           HA       SER  12  -8.940  -6.144   1.689
   86   1HB   SER  12          2HB       SER  12 -10.528  -7.089   0.155
   87   2HB   SER  12          1HB       SER  12  -9.897  -5.618  -0.586
   88    HG   SER  12           HG       SER  12  -9.742  -7.079  -2.175
   89    H    THR  13           H        THR  13  -6.461  -7.704  -0.120
   90    HA   THR  13           HA       THR  13  -7.128 -10.371   0.736
   91    HB   THR  13           HB       THR  13  -4.546  -9.402  -0.494
   92    HG1  THR  13           1HG      THR  13  -6.905 -10.324  -1.770
   93   1HG2  THR  13          1HG2      THR  13  -3.902 -11.511  -0.543
   94   2HG2  THR  13          2HG2      THR  13  -5.392 -11.981  -1.361
   95   3HG2  THR  13          3HG2      THR  13  -5.327 -11.946   0.401
   96    H    CYS  14           H        CYS  14  -4.763  -7.881   1.619
   97    HA   CYS  14           HA       CYS  14  -3.826  -9.590   3.813
   98   1HB   CYS  14          2HB       CYS  14  -2.681  -6.957   2.873
   99   2HB   CYS  14          1HB       CYS  14  -1.941  -8.094   3.994
  100    H    ASP  15           H        ASP  15  -6.167  -7.329   3.338
  101    HA   ASP  15           HA       ASP  15  -7.344  -5.906   4.656
  102   1HB   ASP  15          2HB       ASP  15  -6.252  -7.742   6.795
  103   2HB   ASP  15          1HB       ASP  15  -7.574  -6.604   7.023
  104    H    ILE  16           H        ILE  16  -4.790  -5.002   3.956
  105    HA   ILE  16           HA       ILE  16  -3.910  -3.560   6.368
  106    HB   ILE  16           HB       ILE  16  -2.342  -3.743   3.808
  107   1HG1  ILE  16          2HG1      ILE  16  -2.825  -6.033   4.635
  108   2HG1  ILE  16          1HG1      ILE  16  -1.116  -5.626   4.730
  109   1HG2  ILE  16          1HG2      ILE  16  -1.749  -2.953   6.637
  110   2HG2  ILE  16          2HG2      ILE  16  -1.471  -2.050   5.147
  111   3HG2  ILE  16          3HG2      ILE  16  -0.461  -3.443   5.534
  112   1HD1  ILE  16          1HD1      ILE  16  -1.351  -5.185   7.114
  113   2HD1  ILE  16          2HD1      ILE  16  -1.857  -6.825   6.706
  114   3HD1  ILE  16          3HD1      ILE  16  -3.067  -5.580   7.019
  115    H    SER  17           H        SER  17  -3.169  -1.308   5.999
  116    HA   SER  17           HA       SER  17  -4.654   0.008   3.828
  117   1HB   SER  17          2HB       SER  17  -4.780   1.907   5.738
  118   2HB   SER  17          1HB       SER  17  -6.039   0.695   5.505
  119    HG   SER  17           HG       SER  17  -5.285  -0.436   7.214
  120    H    PHE  18           H        PHE  18  -3.858   2.175   3.302
  121    HA   PHE  18           HA       PHE  18  -1.114   2.733   4.114
  122   1HB   PHE  18          2HB       PHE  18  -2.060   2.365   1.267
  123   2HB   PHE  18          1HB       PHE  18  -0.532   3.120   1.695
  124    HD1  PHE  18           1HD      PHE  18   0.805   1.587   3.537
  125    HD2  PHE  18           2HD      PHE  18  -1.908   0.209   0.561
  126    HE1  PHE  18           1HE      PHE  18   1.863  -0.635   3.605
  127    HE2  PHE  18           2HE      PHE  18  -0.856  -2.014   0.624
  128    HZ   PHE  18           HZ       PHE  18   1.032  -2.439   2.147
  129    H    ASN  19           H        ASN  19  -0.650   4.891   4.191
  130    HA   ASN  19           HA       ASN  19  -2.887   6.703   3.679
  131   1HB   ASN  19          2HB       ASN  19  -0.519   6.735   5.468
  132   2HB   ASN  19          1HB       ASN  19  -1.044   8.296   4.842
  133   1HD2  ASN  19          1HD2      ASN  19  -2.287   5.374   6.406
  134   2HD2  ASN  19          2HD2      ASN  19  -3.476   6.183   7.363
  135    H    TYR  20           H        TYR  20  -0.842   5.526   1.691
  136    HA   TYR  20           HA       TYR  20  -0.584   7.945   0.137
  137   1HB   TYR  20          2HB       TYR  20   1.805   6.402   1.131
  138   2HB   TYR  20          1HB       TYR  20   1.875   7.392  -0.320
  139    HD1  TYR  20           1HD      TYR  20   0.900   9.866   0.048
  140    HD2  TYR  20           2HD      TYR  20   2.498   7.373   3.103
  141    HE1  TYR  20           1HE      TYR  20   1.358  11.853   1.421
  142    HE2  TYR  20           2HE      TYR  20   2.960   9.353   4.486
  143    HH   TYR  20           HH       TYR  20   1.627  12.147   4.201
  144    H    VAL  21           H        VAL  21  -1.310   7.399  -1.801
  145    HA   VAL  21           HA       VAL  21  -1.904   4.864  -2.690
  146    HB   VAL  21           HB       VAL  21  -1.076   7.065  -4.576
  147   1HG1  VAL  21          1HG1      VAL  21  -2.402   6.024  -6.158
  148   2HG1  VAL  21          2HG1      VAL  21  -3.356   5.169  -4.947
  149   3HG1  VAL  21          3HG1      VAL  21  -1.707   4.650  -5.297
  150   1HG2  VAL  21          1HG2      VAL  21  -3.550   6.807  -2.902
  151   2HG2  VAL  21          2HG2      VAL  21  -3.579   7.650  -4.451
  152   3HG2  VAL  21          3HG2      VAL  21  -2.524   8.218  -3.158
  153    H    LYS  22           H        LYS  22   1.147   6.517  -2.737
  154    HA   LYS  22           HA       LYS  22   2.462   4.931  -4.671
  155   1HB   LYS  22          2HB       LYS  22   3.687   6.359  -2.304
  156   2HB   LYS  22          1HB       LYS  22   4.524   5.838  -3.759
  157   1HG   LYS  22          2HG       LYS  22   4.199   7.923  -4.472
  158   2HG   LYS  22          1HG       LYS  22   2.540   7.409  -4.781
  159   1HD   LYS  22          2HD       LYS  22   2.313   8.039  -2.192
  160   2HD   LYS  22          1HD       LYS  22   3.633   9.126  -2.629
  161   1HE   LYS  22          2HE       LYS  22   1.973  10.515  -3.237
  162   2HE   LYS  22          1HE       LYS  22   1.935   9.529  -4.699
  163   1HZ   LYS  22          1HZ       LYS  22   0.170   9.323  -2.328
  164   2HZ   LYS  22          2HZ       LYS  22   0.247   8.123  -3.518
  165   3HZ   LYS  22          3HZ       LYS  22  -0.270   9.683  -3.922
  166    H    THR  23           H        THR  23   2.074   4.645  -1.175
  167    HA   THR  23           HA       THR  23   3.791   2.405  -0.886
  168    HB   THR  23           HB       THR  23   1.487   3.222   0.893
  169    HG1  THR  23           1HG      THR  23   3.008   4.914   0.560
  170   1HG2  THR  23          1HG2      THR  23   2.428   0.991   1.380
  171   2HG2  THR  23          2HG2      THR  23   2.667   2.157   2.680
  172   3HG2  THR  23          3HG2      THR  23   4.006   1.746   1.608
  173    H    TYR  24           H        TYR  24   0.332   2.773  -1.439
  174    HA   TYR  24           HA       TYR  24  -0.358   0.054  -1.158
  175   1HB   TYR  24          2HB       TYR  24  -1.980   1.965  -1.217
  176   2HB   TYR  24          1HB       TYR  24  -1.688   2.101  -2.945
  177    HD1  TYR  24           1HD      TYR  24  -3.815   1.583  -3.813
  178    HD2  TYR  24           2HD      TYR  24  -2.012  -1.035  -0.985
  179    HE1  TYR  24           1HE      TYR  24  -5.572  -0.082  -4.242
  180    HE2  TYR  24           2HE      TYR  24  -3.764  -2.708  -1.407
  181    HH   TYR  24           HH       TYR  24  -6.585  -2.128  -2.706
  182    H    LEU  25           H        LEU  25   1.031   1.916  -3.746
  183    HA   LEU  25           HA       LEU  25   0.652  -0.088  -5.770
  184   1HB   LEU  25          2HB       LEU  25   2.150   2.492  -5.567
  185   2HB   LEU  25          1HB       LEU  25   2.563   1.376  -6.855
  186    HG   LEU  25           HG       LEU  25  -0.277   2.258  -6.443
  187   1HD1  LEU  25          1HD1      LEU  25   1.508   3.645  -8.388
  188   2HD1  LEU  25          2HD1      LEU  25   1.476   4.174  -6.706
  189   3HD1  LEU  25          3HD1      LEU  25  -0.006   4.186  -7.663
  190   1HD2  LEU  25          1HD2      LEU  25  -0.375   0.612  -7.999
  191   2HD2  LEU  25          2HD2      LEU  25   1.297   0.843  -8.511
  192   3HD2  LEU  25          3HD2      LEU  25   0.042   1.946  -9.074
  193    H    ALA  26           H        ALA  26   3.274   0.968  -3.665
  194    HA   ALA  26           HA       ALA  26   5.246  -0.772  -4.645
  195   1HB   ALA  26          1HB       ALA  26   6.231   0.835  -3.384
  196   2HB   ALA  26          2HB       ALA  26   6.080  -0.403  -2.136
  197   3HB   ALA  26          3HB       ALA  26   4.896   0.901  -2.232
  198    H    HIS  27           H        HIS  27   2.662  -1.185  -2.309
  199    HA   HIS  27           HA       HIS  27   3.640  -3.592  -1.163
  200   1HB   HIS  27          2HB       HIS  27   1.999  -2.381   0.075
  201   2HB   HIS  27          1HB       HIS  27   0.879  -2.375  -1.285
  202    HD1  HIS  27           1HD      HIS  27   2.340  -4.769   1.275
  203    HD2  HIS  27           2HD      HIS  27  -0.802  -4.505  -1.428
  204    HE1  HIS  27           1HE      HIS  27   0.885  -6.799   1.672
  205    H    LYS  28           H        LYS  28   1.451  -2.896  -3.854
  206    HA   LYS  28           HA       LYS  28   0.835  -5.641  -4.356
  207   1HB   LYS  28          2HB       LYS  28  -0.382  -3.379  -5.066
  208   2HB   LYS  28          1HB       LYS  28   0.586  -3.607  -6.516
  209   1HG   LYS  28          2HG       LYS  28  -1.209  -4.780  -7.186
  210   2HG   LYS  28          1HG       LYS  28  -0.439  -6.074  -6.266
  211   1HD   LYS  28          2HD       LYS  28  -2.436  -6.203  -5.234
  212   2HD   LYS  28          1HD       LYS  28  -1.838  -4.821  -4.313
  213   1HE   LYS  28          2HE       LYS  28  -3.614  -4.766  -6.747
  214   2HE   LYS  28          1HE       LYS  28  -4.053  -4.325  -5.098
  215   1HZ   LYS  28          1HZ       LYS  28  -2.021  -2.912  -6.739
  216   2HZ   LYS  28          2HZ       LYS  28  -2.562  -2.460  -5.201
  217   3HZ   LYS  28          3HZ       LYS  28  -3.616  -2.392  -6.521
  218    H    GLN  29           H        GLN  29   3.216  -3.358  -5.554
  219    HA   GLN  29           HA       GLN  29   4.164  -5.183  -7.592
  220   1HB   GLN  29          2HB       GLN  29   4.184  -2.472  -7.390
  221   2HB   GLN  29          1HB       GLN  29   5.826  -2.851  -6.891
  222   1HG   GLN  29          2HG       GLN  29   6.161  -4.104  -8.968
  223   2HG   GLN  29          1HG       GLN  29   4.521  -3.695  -9.469
  224   1HE2  GLN  29          1HE2      GLN  29   4.311  -1.982 -10.713
  225   2HE2  GLN  29          2HE2      GLN  29   5.444  -0.685 -10.864
  226    H    PHE  30           H        PHE  30   4.735  -4.739  -4.274
  227    HA   PHE  30           HA       PHE  30   7.347  -6.083  -4.499
  228   1HB   PHE  30          2HB       PHE  30   7.164  -3.755  -3.381
  229   2HB   PHE  30          1HB       PHE  30   6.430  -4.624  -2.036
  230    HD1  PHE  30           1HD      PHE  30   9.408  -3.349  -3.243
  231    HD2  PHE  30           2HD      PHE  30   7.827  -6.816  -1.348
  232    HE1  PHE  30           1HE      PHE  30  11.648  -3.896  -2.384
  233    HE2  PHE  30           2HE      PHE  30  10.064  -7.369  -0.484
  234    HZ   PHE  30           HZ       PHE  30  11.978  -5.908  -1.002
  235    H    TYR  31           H        TYR  31   4.440  -5.902  -2.440
  236    HA   TYR  31           HA       TYR  31   5.073  -8.326  -1.061
  237   1HB   TYR  31          2HB       TYR  31   3.492  -6.246  -0.446
  238   2HB   TYR  31          1HB       TYR  31   2.273  -7.339  -1.093
  239    HD1  TYR  31           1HD      TYR  31   4.755  -6.843   1.573
  240    HD2  TYR  31           2HD      TYR  31   1.649  -9.342   0.087
  241    HE1  TYR  31           1HE      TYR  31   4.684  -8.026   3.728
  242    HE2  TYR  31           2HE      TYR  31   1.568 -10.531   2.238
  243    HH   TYR  31           HH       TYR  31   2.953 -10.953   4.162
  244    H    HIS  32           H        HIS  32   2.824  -7.457  -3.662
  245    HA   HIS  32           HA       HIS  32   2.132 -10.285  -3.978
  246   1HB   HIS  32          2HB       HIS  32   0.899  -7.790  -5.156
  247   2HB   HIS  32          1HB       HIS  32   0.363  -9.426  -5.520
  248    HD1  HIS  32           1HD      HIS  32  -1.227 -10.514  -3.852
  249    HD2  HIS  32           2HD      HIS  32   0.438  -6.970  -2.461
  250    HE1  HIS  32           1HE      HIS  32  -2.451  -9.942  -1.711
  251    H    LYS  33           H        LYS  33   4.685  -8.850  -4.860
  252    HA   LYS  33           HA       LYS  33   6.079  -8.738  -6.666
  253   1HB   LYS  33          2HB       LYS  33   5.535 -11.281  -6.151
  254   2HB   LYS  33          1HB       LYS  33   4.819 -11.211  -7.756
  255   1HG   LYS  33          2HG       LYS  33   6.934 -11.875  -8.282
  256   2HG   LYS  33          1HG       LYS  33   7.128 -10.124  -8.383
  257   1HD   LYS  33          2HD       LYS  33   7.568 -11.304  -5.719
  258   2HD   LYS  33          1HD       LYS  33   8.748 -11.751  -6.953
  259   1HE   LYS  33          2HE       LYS  33   7.986  -8.963  -6.094
  260   2HE   LYS  33          1HE       LYS  33   9.516  -9.784  -5.790
  261   1HZ   LYS  33          1HZ       LYS  33   8.501  -8.605  -8.274
  262   2HZ   LYS  33          2HZ       LYS  33   9.535  -9.939  -8.384
  263   3HZ   LYS  33          3HZ       LYS  33  10.052  -8.532  -7.601
  264    H    ASN  34           H        ASN  34   3.823  -7.176  -7.074
  265    HA   ASN  34           HA       ASN  34   2.584  -6.125  -8.674
  266   1HB   ASN  34          2HB       ASN  34   4.933  -5.753  -9.481
  267   2HB   ASN  34          1HB       ASN  34   4.725  -7.135 -10.553
  268   1HD2  ASN  34          1HD2      ASN  34   4.476  -6.437 -12.542
  269   2HD2  ASN  34          2HD2      ASN  34   3.478  -5.119 -13.043
  270    H    LYS  35           H        LYS  35   1.957  -8.943  -8.153
  271    HA   LYS  35           HA       LYS  35   0.315  -9.387 -10.506
  272   1HB   LYS  35          2HB       LYS  35   0.988 -11.796 -10.626
  273   2HB   LYS  35          1HB       LYS  35   2.238 -10.667 -11.131
  274   1HG   LYS  35          2HG       LYS  35   3.398 -12.189  -9.837
  275   2HG   LYS  35          1HG       LYS  35   3.090 -10.868  -8.707
  276   1HD   LYS  35          2HD       LYS  35   1.688 -12.108  -7.440
  277   2HD   LYS  35          1HD       LYS  35   1.014 -12.958  -8.833
  278   1HE   LYS  35          2HE       LYS  35   2.517 -14.637  -8.699
  279   2HE   LYS  35          1HE       LYS  35   3.828 -13.563  -8.213
  280   1HZ   LYS  35          1HZ       LYS  35   1.668 -14.070  -6.300
  281   2HZ   LYS  35          2HZ       LYS  35   3.307 -13.768  -6.018
  282   3HZ   LYS  35          3HZ       LYS  35   2.810 -15.293  -6.554
  283    HA   PRO  36           HA       PRO  36  -2.594 -10.630  -7.432
  284   1HB   PRO  36          2HB       PRO  36  -4.224 -12.239  -8.889
  285   2HB   PRO  36          1HB       PRO  36  -4.210 -10.480  -9.058
  286   1HG   PRO  36          2HG       PRO  36  -2.877 -12.556 -10.754
  287   2HG   PRO  36          1HG       PRO  36  -3.765 -11.104 -11.254
  288   1HD   PRO  36          2HD       PRO  36  -1.062 -11.204 -11.190
  289   2HD   PRO  36          1HD       PRO  36  -1.969  -9.714 -10.856
  Start of MODEL   13
    1   1H    GLY   1          1HT       GLY   1 -20.950   3.434 -11.900
    2   2H    GLY   1          2HT       GLY   1 -21.855   2.009 -11.807
    3   3H    GLY   1          3HT       GLY   1 -20.239   1.953 -12.304
    4   1HA   GLY   1          1HA       GLY   1 -19.424   2.448 -10.177
    5   2HA   GLY   1          2HA       GLY   1 -21.018   2.946  -9.630
    6    H    SER   2           H        SER   2 -20.426   0.078 -11.558
    7    HA   SER   2           HA       SER   2 -21.552  -1.546  -9.415
    8   1HB   SER   2          2HB       SER   2 -22.317  -1.675 -11.853
    9   2HB   SER   2          1HB       SER   2 -20.793  -2.502 -12.173
   10    HG   SER   2           HG       SER   2 -22.539  -3.944 -11.719
   11    H    ALA   3           H        ALA   3 -20.583  -3.739  -9.055
   12    HA   ALA   3           HA       ALA   3 -18.861  -5.033  -8.322
   13   1HB   ALA   3          1HB       ALA   3 -18.329  -4.823 -10.823
   14   2HB   ALA   3          2HB       ALA   3 -17.040  -5.362  -9.745
   15   3HB   ALA   3          3HB       ALA   3 -17.070  -3.695 -10.320
   16    H    ALA   4           H        ALA   4 -18.661  -4.141  -6.279
   17    HA   ALA   4           HA       ALA   4 -17.241  -1.749  -5.726
   18   1HB   ALA   4          1HB       ALA   4 -17.867  -2.075  -3.583
   19   2HB   ALA   4          2HB       ALA   4 -17.404  -3.776  -3.591
   20   3HB   ALA   4          3HB       ALA   4 -18.939  -3.277  -4.301
   21    H    GLU   5           H        GLU   5 -15.146  -1.379  -5.256
   22    HA   GLU   5           HA       GLU   5 -13.222  -2.991  -4.225
   23   1HB   GLU   5          2HB       GLU   5 -11.962  -3.646  -6.389
   24   2HB   GLU   5          1HB       GLU   5 -13.306  -4.651  -5.864
   25   1HG   GLU   5          2HG       GLU   5 -14.520  -4.191  -7.681
   26   2HG   GLU   5          1HG       GLU   5 -14.080  -2.484  -7.664
   27    H    VAL   6           H        VAL   6 -13.325  -0.544  -3.762
   28    HA   VAL   6           HA       VAL   6 -12.109   1.235  -5.623
   29    HB   VAL   6           HB       VAL   6 -13.591   2.074  -3.877
   30   1HG1  VAL   6          1HG1      VAL   6 -11.603   1.832  -1.721
   31   2HG1  VAL   6          2HG1      VAL   6 -12.388   0.329  -2.205
   32   3HG1  VAL   6          3HG1      VAL   6 -13.360   1.699  -1.669
   33   1HG2  VAL   6          1HG2      VAL   6 -12.058   3.674  -4.743
   34   2HG2  VAL   6          2HG2      VAL   6 -10.749   3.059  -3.734
   35   3HG2  VAL   6          3HG2      VAL   6 -12.109   3.903  -2.996
   36    H    MET   7           H        MET   7 -10.119   0.571  -6.300
   37    HA   MET   7           HA       MET   7  -8.117  -0.351  -4.452
   38   1HB   MET   7          2HB       MET   7  -8.141   0.200  -7.410
   39   2HB   MET   7          1HB       MET   7  -6.649  -0.182  -6.564
   40   1HG   MET   7          2HG       MET   7  -8.849  -2.036  -6.028
   41   2HG   MET   7          1HG       MET   7  -8.314  -1.998  -7.708
   42   1HE   MET   7          1HE       MET   7  -4.916  -2.961  -7.919
   43   2HE   MET   7          2HE       MET   7  -6.494  -2.619  -8.628
   44   3HE   MET   7          3HE       MET   7  -6.101  -4.254  -8.099
   45    H    LYS   8           H        LYS   8  -8.295   1.658  -3.130
   46    HA   LYS   8           HA       LYS   8  -6.902   3.960  -4.266
   47   1HB   LYS   8          2HB       LYS   8  -8.909   4.534  -3.098
   48   2HB   LYS   8          1HB       LYS   8  -8.449   3.565  -1.705
   49   1HG   LYS   8          2HG       LYS   8  -6.525   5.141  -1.366
   50   2HG   LYS   8          1HG       LYS   8  -7.230   6.159  -2.620
   51   1HD   LYS   8          2HD       LYS   8  -7.832   6.868  -0.320
   52   2HD   LYS   8          1HD       LYS   8  -9.232   6.469  -1.319
   53   1HE   LYS   8          2HE       LYS   8  -8.190   4.186   0.168
   54   2HE   LYS   8          1HE       LYS   8  -8.718   5.508   1.209
   55   1HZ   LYS   8          1HZ       LYS   8 -10.478   3.870   0.669
   56   2HZ   LYS   8          2HZ       LYS   8 -10.384   4.341  -0.952
   57   3HZ   LYS   8          3HZ       LYS   8 -10.872   5.454   0.224
   58    H    LYS   9           H        LYS   9  -6.814   2.694  -0.956
   59    HA   LYS   9           HA       LYS   9  -3.982   2.097  -1.159
   60   1HB   LYS   9          2HB       LYS   9  -3.409   3.595   0.741
   61   2HB   LYS   9          1HB       LYS   9  -3.888   4.463  -0.710
   62   1HG   LYS   9          2HG       LYS   9  -6.256   4.393   0.440
   63   2HG   LYS   9          1HG       LYS   9  -5.283   4.208   1.900
   64   1HD   LYS   9          2HD       LYS   9  -3.971   6.233   1.098
   65   2HD   LYS   9          1HD       LYS   9  -5.262   6.472  -0.081
   66   1HE   LYS   9          2HE       LYS   9  -6.799   6.275   2.037
   67   2HE   LYS   9          1HE       LYS   9  -5.324   6.732   2.888
   68   1HZ   LYS   9          1HZ       LYS   9  -5.253   8.778   1.830
   69   2HZ   LYS   9          2HZ       LYS   9  -6.906   8.571   2.124
   70   3HZ   LYS   9          3HZ       LYS   9  -6.280   8.296   0.576
   71    H    TYR  10           H        TYR  10  -5.879   0.268  -0.763
   72    HA   TYR  10           HA       TYR  10  -5.293  -0.684   1.907
   73   1HB   TYR  10          2HB       TYR  10  -7.325   0.591   2.327
   74   2HB   TYR  10          1HB       TYR  10  -8.140  -0.212   0.991
   75    HD1  TYR  10           1HD      TYR  10  -7.488  -0.272   4.485
   76    HD2  TYR  10           2HD      TYR  10  -8.431  -2.773   1.175
   77    HE1  TYR  10           1HE      TYR  10  -8.299  -2.004   6.031
   78    HE2  TYR  10           2HE      TYR  10  -9.247  -4.510   2.712
   79    HH   TYR  10           HH       TYR  10  -9.038  -5.200   4.992
   80    H    CYS  11           H        CYS  11  -4.885  -2.809   1.809
   81    HA   CYS  11           HA       CYS  11  -5.437  -4.205  -0.667
   82   1HB   CYS  11          2HB       CYS  11  -3.244  -4.364   0.615
   83   2HB   CYS  11          1HB       CYS  11  -4.103  -5.373   1.771
   84    H    SER  12           H        SER  12  -7.074  -5.503  -1.027
   85    HA   SER  12           HA       SER  12  -8.934  -6.129   1.105
   86   1HB   SER  12          2HB       SER  12  -9.403  -5.401  -1.417
   87   2HB   SER  12          1HB       SER  12  -9.352  -7.146  -1.664
   88    HG   SER  12           HG       SER  12 -10.941  -5.902   0.325
   89    H    THR  13           H        THR  13  -6.215  -7.473   0.754
   90    HA   THR  13           HA       THR  13  -7.217 -10.209   0.998
   91    HB   THR  13           HB       THR  13  -4.706  -9.405  -0.477
   92    HG1  THR  13           1HG      THR  13  -6.431  -9.005  -1.788
   93   1HG2  THR  13          1HG2      THR  13  -5.626 -11.968   0.541
   94   2HG2  THR  13          2HG2      THR  13  -4.038 -11.482  -0.053
   95   3HG2  THR  13          3HG2      THR  13  -5.291 -11.978  -1.191
   96    H    CYS  14           H        CYS  14  -4.752  -7.828   1.778
   97    HA   CYS  14           HA       CYS  14  -3.707  -9.598   3.875
   98   1HB   CYS  14          2HB       CYS  14  -2.602  -6.970   2.869
   99   2HB   CYS  14          1HB       CYS  14  -1.828  -8.044   4.028
  100    H    ASP  15           H        ASP  15  -6.073  -7.348   3.583
  101    HA   ASP  15           HA       ASP  15  -7.201  -5.983   5.000
  102   1HB   ASP  15          2HB       ASP  15  -5.896  -7.800   7.033
  103   2HB   ASP  15          1HB       ASP  15  -7.219  -6.693   7.378
  104    H    ILE  16           H        ILE  16  -4.781  -4.954   4.102
  105    HA   ILE  16           HA       ILE  16  -3.823  -3.450   6.451
  106    HB   ILE  16           HB       ILE  16  -2.255  -3.731   3.902
  107   1HG1  ILE  16          2HG1      ILE  16  -2.718  -6.001   4.751
  108   2HG1  ILE  16          1HG1      ILE  16  -1.017  -5.580   4.910
  109   1HG2  ILE  16          1HG2      ILE  16  -1.421  -1.993   5.232
  110   2HG2  ILE  16          2HG2      ILE  16  -0.372  -3.366   5.587
  111   3HG2  ILE  16          3HG2      ILE  16  -1.642  -2.909   6.723
  112   1HD1  ILE  16          1HD1      ILE  16  -1.640  -6.687   6.896
  113   2HD1  ILE  16          2HD1      ILE  16  -3.095  -5.705   7.070
  114   3HD1  ILE  16          3HD1      ILE  16  -1.507  -4.975   7.299
  115    H    SER  17           H        SER  17  -3.113  -1.223   5.980
  116    HA   SER  17           HA       SER  17  -4.556  -0.021   3.718
  117   1HB   SER  17          2HB       SER  17  -4.714   1.938   5.627
  118   2HB   SER  17          1HB       SER  17  -6.008   0.801   5.250
  119    HG   SER  17           HG       SER  17  -4.003   0.357   7.209
  120    H    PHE  18           H        PHE  18  -3.771   2.159   3.158
  121    HA   PHE  18           HA       PHE  18  -1.028   2.697   4.014
  122   1HB   PHE  18          2HB       PHE  18  -1.983   2.417   1.161
  123   2HB   PHE  18          1HB       PHE  18  -0.444   3.140   1.608
  124    HD1  PHE  18           1HD      PHE  18   1.203   1.700   2.921
  125    HD2  PHE  18           2HD      PHE  18  -2.192   0.122   0.897
  126    HE1  PHE  18           1HE      PHE  18   2.233  -0.536   2.943
  127    HE2  PHE  18           2HE      PHE  18  -1.171  -2.115   0.918
  128    HZ   PHE  18           HZ       PHE  18   1.043  -2.448   1.941
  129    H    ASN  19           H        ASN  19  -0.595   4.808   4.289
  130    HA   ASN  19           HA       ASN  19  -2.763   6.692   3.970
  131   1HB   ASN  19          2HB       ASN  19  -0.131   6.673   5.359
  132   2HB   ASN  19          1HB       ASN  19  -0.792   8.240   4.901
  133   1HD2  ASN  19          1HD2      ASN  19  -3.122   8.561   5.523
  134   2HD2  ASN  19          2HD2      ASN  19  -3.593   8.000   7.087
  135    H    TYR  20           H        TYR  20  -0.624   5.549   1.820
  136    HA   TYR  20           HA       TYR  20  -0.768   7.966   0.212
  137   1HB   TYR  20          2HB       TYR  20   1.795   6.674   1.098
  138   2HB   TYR  20          1HB       TYR  20   1.710   7.521  -0.443
  139    HD1  TYR  20           1HD      TYR  20   0.031   9.825   0.160
  140    HD2  TYR  20           2HD      TYR  20   3.062   7.995   2.519
  141    HE1  TYR  20           1HE      TYR  20   0.415  11.963   1.312
  142    HE2  TYR  20           2HE      TYR  20   3.455  10.128   3.678
  143    HH   TYR  20           HH       TYR  20   1.334  12.749   3.474
  144    H    VAL  21           H        VAL  21  -1.397   7.454  -1.776
  145    HA   VAL  21           HA       VAL  21  -2.016   4.915  -2.642
  146    HB   VAL  21           HB       VAL  21  -1.197   7.156  -4.491
  147   1HG1  VAL  21          1HG1      VAL  21  -3.455   5.366  -5.114
  148   2HG1  VAL  21          2HG1      VAL  21  -1.853   4.628  -5.142
  149   3HG1  VAL  21          3HG1      VAL  21  -2.199   6.022  -6.165
  150   1HG2  VAL  21          1HG2      VAL  21  -3.556   6.848  -2.729
  151   2HG2  VAL  21          2HG2      VAL  21  -3.852   7.425  -4.369
  152   3HG2  VAL  21          3HG2      VAL  21  -2.754   8.308  -3.308
  153    H    LYS  22           H        LYS  22   1.040   6.593  -2.810
  154    HA   LYS  22           HA       LYS  22   2.306   4.930  -4.711
  155   1HB   LYS  22          2HB       LYS  22   4.430   5.806  -3.643
  156   2HB   LYS  22          1HB       LYS  22   3.322   7.026  -4.255
  157   1HG   LYS  22          2HG       LYS  22   2.729   7.742  -2.151
  158   2HG   LYS  22          1HG       LYS  22   3.167   6.209  -1.392
  159   1HD   LYS  22          2HD       LYS  22   5.383   7.642  -2.692
  160   2HD   LYS  22          1HD       LYS  22   4.680   8.458  -1.294
  161   1HE   LYS  22          2HE       LYS  22   5.628   5.596  -1.310
  162   2HE   LYS  22          1HE       LYS  22   6.583   6.960  -0.731
  163   1HZ   LYS  22          1HZ       LYS  22   5.637   6.204   1.197
  164   2HZ   LYS  22          2HZ       LYS  22   4.194   5.728   0.454
  165   3HZ   LYS  22          3HZ       LYS  22   4.495   7.368   0.740
  166    H    THR  23           H        THR  23   1.861   4.699  -1.238
  167    HA   THR  23           HA       THR  23   3.680   2.538  -0.872
  168    HB   THR  23           HB       THR  23   1.407   2.818   1.005
  169    HG1  THR  23           1HG      THR  23   2.047   4.782   1.753
  170   1HG2  THR  23          1HG2      THR  23   4.369   2.925   1.498
  171   2HG2  THR  23          2HG2      THR  23   3.408   1.446   1.505
  172   3HG2  THR  23          3HG2      THR  23   3.090   2.710   2.692
  173    H    TYR  24           H        TYR  24   0.214   2.783  -1.453
  174    HA   TYR  24           HA       TYR  24  -0.398   0.056  -1.110
  175   1HB   TYR  24          2HB       TYR  24  -2.078   1.900  -1.244
  176   2HB   TYR  24          1HB       TYR  24  -1.756   2.019  -2.969
  177    HD1  TYR  24           1HD      TYR  24  -3.710   1.319  -4.021
  178    HD2  TYR  24           2HD      TYR  24  -2.148  -0.996  -0.812
  179    HE1  TYR  24           1HE      TYR  24  -5.399  -0.414  -4.458
  180    HE2  TYR  24           2HE      TYR  24  -3.832  -2.737  -1.241
  181    HH   TYR  24           HH       TYR  24  -5.396  -3.175  -3.878
  182    H    LEU  25           H        LEU  25   0.960   1.882  -3.742
  183    HA   LEU  25           HA       LEU  25   0.674  -0.202  -5.701
  184   1HB   LEU  25          2HB       LEU  25   2.276   2.349  -5.607
  185   2HB   LEU  25          1HB       LEU  25   2.383   1.228  -6.951
  186    HG   LEU  25           HG       LEU  25  -0.195   2.521  -6.067
  187   1HD1  LEU  25          1HD1      LEU  25   1.310   3.336  -8.511
  188   2HD1  LEU  25          2HD1      LEU  25   1.731   4.038  -6.948
  189   3HD1  LEU  25          3HD1      LEU  25   0.097   4.223  -7.588
  190   1HD2  LEU  25          1HD2      LEU  25  -0.672   1.896  -8.557
  191   2HD2  LEU  25          2HD2      LEU  25  -0.815   0.675  -7.292
  192   3HD2  LEU  25          3HD2      LEU  25   0.626   0.729  -8.308
  193    H    ALA  26           H        ALA  26   3.221   1.011  -3.593
  194    HA   ALA  26           HA       ALA  26   5.286  -0.657  -4.487
  195   1HB   ALA  26          1HB       ALA  26   5.378   1.408  -2.944
  196   2HB   ALA  26          2HB       ALA  26   6.511   0.087  -2.657
  197   3HB   ALA  26          3HB       ALA  26   5.077   0.254  -1.644
  198    H    HIS  27           H        HIS  27   2.644  -1.179  -2.236
  199    HA   HIS  27           HA       HIS  27   3.709  -3.569  -1.099
  200   1HB   HIS  27          2HB       HIS  27   2.076  -2.419   0.191
  201   2HB   HIS  27          1HB       HIS  27   0.936  -2.379  -1.151
  202    HD1  HIS  27           1HD      HIS  27   2.430  -4.826   1.335
  203    HD2  HIS  27           2HD      HIS  27  -0.735  -4.518  -1.336
  204    HE1  HIS  27           1HE      HIS  27   0.983  -6.868   1.706
  205    H    LYS  28           H        LYS  28   1.386  -2.899  -3.693
  206    HA   LYS  28           HA       LYS  28   0.848  -5.647  -4.229
  207   1HB   LYS  28          2HB       LYS  28  -0.299  -3.255  -4.959
  208   2HB   LYS  28          1HB       LYS  28   0.442  -3.788  -6.461
  209   1HG   LYS  28          2HG       LYS  28  -1.265  -5.648  -4.856
  210   2HG   LYS  28          1HG       LYS  28  -1.986  -4.470  -5.954
  211   1HD   LYS  28          2HD       LYS  28  -0.285  -5.448  -7.672
  212   2HD   LYS  28          1HD       LYS  28  -0.248  -6.825  -6.569
  213   1HE   LYS  28          2HE       LYS  28  -1.914  -7.396  -8.089
  214   2HE   LYS  28          1HE       LYS  28  -2.815  -6.745  -6.722
  215   1HZ   LYS  28          1HZ       LYS  28  -2.159  -5.328  -9.248
  216   2HZ   LYS  28          2HZ       LYS  28  -2.899  -4.602  -7.912
  217   3HZ   LYS  28          3HZ       LYS  28  -3.690  -5.844  -8.743
  218    H    GLN  29           H        GLN  29   3.295  -3.405  -5.243
  219    HA   GLN  29           HA       GLN  29   4.131  -5.016  -7.494
  220   1HB   GLN  29          2HB       GLN  29   4.701  -2.353  -6.456
  221   2HB   GLN  29          1HB       GLN  29   6.146  -3.180  -7.019
  222   1HG   GLN  29          2HG       GLN  29   3.818  -3.326  -8.811
  223   2HG   GLN  29          1HG       GLN  29   4.524  -1.725  -8.595
  224   1HE2  GLN  29          1HE2      GLN  29   4.567  -2.895 -11.043
  225   2HE2  GLN  29          2HE2      GLN  29   6.181  -3.355 -11.455
  226    H    PHE  30           H        PHE  30   4.885  -4.807  -4.126
  227    HA   PHE  30           HA       PHE  30   7.268  -6.482  -4.568
  228   1HB   PHE  30          2HB       PHE  30   6.664  -4.342  -2.596
  229   2HB   PHE  30          1HB       PHE  30   7.643  -5.695  -2.046
  230    HD1  PHE  30           1HD      PHE  30   7.422  -3.143  -4.737
  231    HD2  PHE  30           2HD      PHE  30   9.923  -5.727  -2.463
  232    HE1  PHE  30           1HE      PHE  30   9.408  -2.109  -5.756
  233    HE2  PHE  30           2HE      PHE  30  11.915  -4.698  -3.476
  234    HZ   PHE  30           HZ       PHE  30  11.660  -2.886  -5.125
  235    H    TYR  31           H        TYR  31   4.463  -6.028  -2.431
  236    HA   TYR  31           HA       TYR  31   4.907  -8.477  -1.024
  237   1HB   TYR  31          2HB       TYR  31   3.477  -6.258  -0.460
  238   2HB   TYR  31          1HB       TYR  31   2.186  -7.307  -1.037
  239    HD1  TYR  31           1HD      TYR  31   4.406  -6.539   1.691
  240    HD2  TYR  31           2HD      TYR  31   1.833  -9.530   0.099
  241    HE1  TYR  31           1HE      TYR  31   4.320  -7.629   3.893
  242    HE2  TYR  31           2HE      TYR  31   1.739 -10.628   2.296
  243    HH   TYR  31           HH       TYR  31   2.064 -10.028   4.670
  244    H    HIS  32           H        HIS  32   3.059  -7.534  -3.841
  245    HA   HIS  32           HA       HIS  32   2.102 -10.311  -4.082
  246   1HB   HIS  32          2HB       HIS  32   0.876  -7.758  -5.138
  247   2HB   HIS  32          1HB       HIS  32   0.300  -9.372  -5.538
  248    HD1  HIS  32           1HD      HIS  32  -1.214 -10.524  -3.827
  249    HD2  HIS  32           2HD      HIS  32   0.467  -6.987  -2.436
  250    HE1  HIS  32           1HE      HIS  32  -2.388  -9.983  -1.649
  251    H    LYS  33           H        LYS  33   4.654  -8.918  -5.007
  252    HA   LYS  33           HA       LYS  33   5.999  -8.808  -6.847
  253   1HB   LYS  33          2HB       LYS  33   4.406 -11.257  -7.625
  254   2HB   LYS  33          1HB       LYS  33   5.997 -10.821  -8.232
  255   1HG   LYS  33          2HG       LYS  33   5.390 -11.407  -5.343
  256   2HG   LYS  33          1HG       LYS  33   6.020 -12.588  -6.492
  257   1HD   LYS  33          2HD       LYS  33   8.097 -11.703  -6.462
  258   2HD   LYS  33          1HD       LYS  33   7.500 -10.046  -6.350
  259   1HE   LYS  33          2HE       LYS  33   6.776 -11.006  -3.926
  260   2HE   LYS  33          1HE       LYS  33   8.237 -11.947  -4.224
  261   1HZ   LYS  33          1HZ       LYS  33   8.266  -9.035  -4.648
  262   2HZ   LYS  33          2HZ       LYS  33   9.544 -10.071  -4.257
  263   3HZ   LYS  33          3HZ       LYS  33   8.406  -9.652  -3.079
  264    H    ASN  34           H        ASN  34   3.835  -7.093  -7.081
  265    HA   ASN  34           HA       ASN  34   2.619  -5.872  -8.571
  266   1HB   ASN  34          2HB       ASN  34   4.895  -5.540  -9.480
  267   2HB   ASN  34          1HB       ASN  34   4.671  -6.942 -10.521
  268   1HD2  ASN  34          1HD2      ASN  34   3.962  -6.572 -12.491
  269   2HD2  ASN  34          2HD2      ASN  34   3.143  -5.148 -13.026
  270    H    LYS  35           H        LYS  35   0.903  -7.539  -8.208
  271    HA   LYS  35           HA       LYS  35  -0.813  -8.806  -8.996
  272   1HB   LYS  35          2HB       LYS  35  -0.137  -7.017 -11.058
  273   2HB   LYS  35          1HB       LYS  35  -0.359  -8.576 -11.838
  274   1HG   LYS  35          2HG       LYS  35  -2.356  -7.228 -10.031
  275   2HG   LYS  35          1HG       LYS  35  -2.419  -7.260 -11.794
  276   1HD   LYS  35          2HD       LYS  35  -3.181  -9.380 -11.852
  277   2HD   LYS  35          1HD       LYS  35  -2.147  -9.893 -10.517
  278   1HE   LYS  35          2HE       LYS  35  -4.569 -10.008  -9.994
  279   2HE   LYS  35          1HE       LYS  35  -3.664  -8.955  -8.908
  280   1HZ   LYS  35          1HZ       LYS  35  -5.411  -8.128 -11.159
  281   2HZ   LYS  35          2HZ       LYS  35  -4.411  -7.063 -10.308
  282   3HZ   LYS  35          3HZ       LYS  35  -5.671  -7.859  -9.509
  283    HA   PRO  36           HA       PRO  36   1.834 -12.455  -9.733
  284   1HB   PRO  36          2HB       PRO  36   0.278 -14.178  -8.334
  285   2HB   PRO  36          1HB       PRO  36   1.452 -13.107  -7.561
  286   1HG   PRO  36          2HG       PRO  36  -1.509 -12.776  -7.850
  287   2HG   PRO  36          1HG       PRO  36  -0.483 -12.473  -6.436
  288   1HD   PRO  36          2HD       PRO  36  -1.353 -10.488  -8.063
  289   2HD   PRO  36          1HD       PRO  36   0.210 -10.421  -7.225
  Start of MODEL   14
    1   1H    GLY   1          1HT       GLY   1 -17.461  -8.609   7.015
    2   2H    GLY   1          2HT       GLY   1 -17.181  -9.531   8.405
    3   3H    GLY   1          3HT       GLY   1 -18.756  -9.341   7.821
    4   1HA   GLY   1          1HA       GLY   1 -17.260 -11.484   7.330
    5   2HA   GLY   1          2HA       GLY   1 -18.553 -10.931   6.277
    6    H    SER   2           H        SER   2 -17.508  -8.783   5.022
    7    HA   SER   2           HA       SER   2 -14.859  -9.267   4.048
    8   1HB   SER   2          2HB       SER   2 -16.033 -11.027   2.818
    9   2HB   SER   2          1HB       SER   2 -17.197  -9.848   2.215
   10    HG   SER   2           HG       SER   2 -15.735  -9.063   0.861
   11    H    ALA   3           H        ALA   3 -14.008  -7.421   3.297
   12    HA   ALA   3           HA       ALA   3 -13.811  -5.237   2.690
   13   1HB   ALA   3          1HB       ALA   3 -16.191  -6.172   1.206
   14   2HB   ALA   3          2HB       ALA   3 -14.694  -5.452   0.615
   15   3HB   ALA   3          3HB       ALA   3 -15.952  -4.428   1.307
   16    H    ALA   4           H        ALA   4 -13.834  -4.162   4.607
   17    HA   ALA   4           HA       ALA   4 -16.444  -3.123   5.500
   18   1HB   ALA   4          1HB       ALA   4 -15.034  -4.867   6.958
   19   2HB   ALA   4          2HB       ALA   4 -16.026  -3.598   7.675
   20   3HB   ALA   4          3HB       ALA   4 -14.286  -3.367   7.506
   21    H    GLU   5           H        GLU   5 -14.782  -1.848   3.616
   22    HA   GLU   5           HA       GLU   5 -14.761   0.757   4.377
   23   1HB   GLU   5          2HB       GLU   5 -12.225   1.101   4.763
   24   2HB   GLU   5          1HB       GLU   5 -13.212   0.556   6.111
   25   1HG   GLU   5          2HG       GLU   5 -12.323  -1.563   6.084
   26   2HG   GLU   5          1HG       GLU   5 -11.853  -1.460   4.388
   27    H    VAL   6           H        VAL   6 -15.391   0.027   2.078
   28    HA   VAL   6           HA       VAL   6 -13.488  -0.529   0.115
   29    HB   VAL   6           HB       VAL   6 -15.987   1.110  -0.310
   30   1HG1  VAL   6          1HG1      VAL   6 -14.177  -0.479  -2.086
   31   2HG1  VAL   6          2HG1      VAL   6 -14.812   1.152  -2.308
   32   3HG1  VAL   6          3HG1      VAL   6 -15.871  -0.243  -2.516
   33   1HG2  VAL   6          1HG2      VAL   6 -16.904  -1.251  -0.906
   34   2HG2  VAL   6          2HG2      VAL   6 -16.854  -0.734   0.779
   35   3HG2  VAL   6          3HG2      VAL   6 -15.612  -1.819   0.152
   36    H    MET   7           H        MET   7 -11.707   0.635  -0.224
   37    HA   MET   7           HA       MET   7 -11.793   3.223  -1.303
   38   1HB   MET   7          2HB       MET   7 -10.683   4.486   0.506
   39   2HB   MET   7          1HB       MET   7 -12.301   3.961   0.952
   40   1HG   MET   7          2HG       MET   7 -11.555   2.543   2.551
   41   2HG   MET   7          1HG       MET   7 -10.059   2.183   1.692
   42   1HE   MET   7          1HE       MET   7 -11.003   2.716   4.581
   43   2HE   MET   7          2HE       MET   7 -11.136   4.417   5.032
   44   3HE   MET   7          3HE       MET   7  -9.640   3.536   5.344
   45    H    LYS   8           H        LYS   8  -9.808   3.858  -2.141
   46    HA   LYS   8           HA       LYS   8  -7.970   1.875  -2.755
   47   1HB   LYS   8          2HB       LYS   8  -6.764   3.499  -3.889
   48   2HB   LYS   8          1HB       LYS   8  -8.371   4.206  -3.834
   49   1HG   LYS   8          2HG       LYS   8  -6.127   4.881  -1.938
   50   2HG   LYS   8          1HG       LYS   8  -6.576   5.824  -3.358
   51   1HD   LYS   8          2HD       LYS   8  -8.971   5.597  -2.090
   52   2HD   LYS   8          1HD       LYS   8  -7.858   5.650  -0.722
   53   1HE   LYS   8          2HE       LYS   8  -8.210   7.886  -1.023
   54   2HE   LYS   8          1HE       LYS   8  -6.826   7.656  -2.089
   55   1HZ   LYS   8          1HZ       LYS   8  -8.244   8.784  -3.454
   56   2HZ   LYS   8          2HZ       LYS   8  -9.640   8.116  -2.771
   57   3HZ   LYS   8          3HZ       LYS   8  -8.696   7.197  -3.831
   58    H    LYS   9           H        LYS   9  -5.449   2.571  -2.339
   59    HA   LYS   9           HA       LYS   9  -3.774   2.119  -0.864
   60   1HB   LYS   9          2HB       LYS   9  -3.550   3.820   0.905
   61   2HB   LYS   9          1HB       LYS   9  -3.940   4.522  -0.654
   62   1HG   LYS   9          2HG       LYS   9  -6.268   4.770   0.032
   63   2HG   LYS   9          1HG       LYS   9  -5.887   4.049   1.596
   64   1HD   LYS   9          2HD       LYS   9  -5.488   6.126   2.310
   65   2HD   LYS   9          1HD       LYS   9  -4.022   6.076   1.331
   66   1HE   LYS   9          2HE       LYS   9  -6.674   6.917   0.198
   67   2HE   LYS   9          1HE       LYS   9  -5.593   8.058   0.996
   68   1HZ   LYS   9          1HZ       LYS   9  -3.855   7.154  -0.638
   69   2HZ   LYS   9          2HZ       LYS   9  -5.020   8.231  -1.223
   70   3HZ   LYS   9          3HZ       LYS   9  -5.179   6.574  -1.518
   71    H    TYR  10           H        TYR  10  -5.845   0.322  -0.576
   72    HA   TYR  10           HA       TYR  10  -5.386  -0.576   2.136
   73   1HB   TYR  10          2HB       TYR  10  -7.355   0.825   2.469
   74   2HB   TYR  10          1HB       TYR  10  -8.190   0.007   1.152
   75    HD1  TYR  10           1HD      TYR  10  -6.712  -0.565   4.516
   76    HD2  TYR  10           2HD      TYR  10  -9.473  -1.906   1.571
   77    HE1  TYR  10           1HE      TYR  10  -7.617  -2.198   6.117
   78    HE2  TYR  10           2HE      TYR  10 -10.387  -3.542   3.164
   79    HH   TYR  10           HH       TYR  10 -10.523  -3.818   5.646
   80    H    CYS  11           H        CYS  11  -4.800  -2.631   1.872
   81    HA   CYS  11           HA       CYS  11  -5.697  -4.102  -0.462
   82   1HB   CYS  11          2HB       CYS  11  -3.314  -4.143   0.547
   83   2HB   CYS  11          1HB       CYS  11  -3.985  -5.269   1.714
   84    H    SER  12           H        SER  12  -7.410  -5.346  -0.496
   85    HA   SER  12           HA       SER  12  -8.832  -5.991   1.924
   86   1HB   SER  12          2HB       SER  12 -10.509  -6.972   0.432
   87   2HB   SER  12          1HB       SER  12 -10.038  -5.374  -0.143
   88    HG   SER  12           HG       SER  12  -9.598  -7.872  -1.265
   89    H    THR  13           H        THR  13  -6.529  -7.515  -0.127
   90    HA   THR  13           HA       THR  13  -7.165 -10.207   0.651
   91    HB   THR  13           HB       THR  13  -4.675  -9.152  -0.699
   92    HG1  THR  13           1HG      THR  13  -6.231  -8.683  -2.108
   93   1HG2  THR  13          1HG2      THR  13  -5.788 -11.905  -0.354
   94   2HG2  THR  13          2HG2      THR  13  -4.150 -11.322  -0.065
   95   3HG2  THR  13          3HG2      THR  13  -4.746 -11.497  -1.716
   96    H    CYS  14           H        CYS  14  -4.718  -7.785   1.517
   97    HA   CYS  14           HA       CYS  14  -3.686  -9.606   3.572
   98   1HB   CYS  14          2HB       CYS  14  -2.592  -6.928   2.696
   99   2HB   CYS  14          1HB       CYS  14  -1.801  -8.089   3.756
  100    H    ASP  15           H        ASP  15  -6.035  -7.300   3.331
  101    HA   ASP  15           HA       ASP  15  -7.166  -5.995   4.807
  102   1HB   ASP  15          2HB       ASP  15  -6.503  -8.408   6.110
  103   2HB   ASP  15          1HB       ASP  15  -6.248  -7.127   7.289
  104    H    ILE  16           H        ILE  16  -4.679  -5.017   3.982
  105    HA   ILE  16           HA       ILE  16  -3.677  -3.654   6.393
  106    HB   ILE  16           HB       ILE  16  -2.251  -3.711   3.745
  107   1HG1  ILE  16          2HG1      ILE  16  -2.645  -6.043   4.483
  108   2HG1  ILE  16          1HG1      ILE  16  -0.940  -5.606   4.535
  109   1HG2  ILE  16          1HG2      ILE  16  -0.280  -3.437   5.355
  110   2HG2  ILE  16          2HG2      ILE  16  -1.497  -3.055   6.572
  111   3HG2  ILE  16          3HG2      ILE  16  -1.353  -2.056   5.126
  112   1HD1  ILE  16          1HD1      ILE  16  -1.069  -5.306   6.935
  113   2HD1  ILE  16          2HD1      ILE  16  -1.625  -6.916   6.479
  114   3HD1  ILE  16          3HD1      ILE  16  -2.795  -5.668   6.903
  115    H    SER  17           H        SER  17  -3.002  -1.377   6.068
  116    HA   SER  17           HA       SER  17  -4.675  -0.026   4.058
  117   1HB   SER  17          2HB       SER  17  -4.632   1.830   6.007
  118   2HB   SER  17          1HB       SER  17  -5.888   0.598   5.891
  119    HG   SER  17           HG       SER  17  -5.153   0.484   7.951
  120    H    PHE  18           H        PHE  18  -3.963   2.128   3.477
  121    HA   PHE  18           HA       PHE  18  -1.174   2.756   4.033
  122   1HB   PHE  18          2HB       PHE  18  -2.365   2.328   1.290
  123   2HB   PHE  18          1HB       PHE  18  -0.854   3.183   1.558
  124    HD1  PHE  18           1HD      PHE  18   0.975   1.888   2.868
  125    HD2  PHE  18           2HD      PHE  18  -2.364   0.048   0.978
  126    HE1  PHE  18           1HE      PHE  18   2.178  -0.258   2.841
  127    HE2  PHE  18           2HE      PHE  18  -1.168  -2.101   0.948
  128    HZ   PHE  18           HZ       PHE  18   1.105  -2.257   1.880
  129    H    ASN  19           H        ASN  19  -0.730   4.938   3.941
  130    HA   ASN  19           HA       ASN  19  -3.076   6.673   3.790
  131   1HB   ASN  19          2HB       ASN  19  -0.350   6.944   5.016
  132   2HB   ASN  19          1HB       ASN  19  -1.317   8.380   4.695
  133   1HD2  ASN  19          1HD2      ASN  19  -3.470   8.450   5.644
  134   2HD2  ASN  19          2HD2      ASN  19  -3.733   7.689   7.172
  135    H    TYR  20           H        TYR  20  -0.571   5.696   1.798
  136    HA   TYR  20           HA       TYR  20  -1.008   8.011   0.056
  137   1HB   TYR  20          2HB       TYR  20   1.686   6.796   0.704
  138   2HB   TYR  20          1HB       TYR  20   1.401   7.980  -0.566
  139    HD1  TYR  20           1HD      TYR  20   1.295  10.291  -0.074
  140    HD2  TYR  20           2HD      TYR  20   1.301   7.456   3.098
  141    HE1  TYR  20           1HE      TYR  20   1.629  12.112   1.545
  142    HE2  TYR  20           2HE      TYR  20   1.634   9.269   4.725
  143    HH   TYR  20           HH       TYR  20   2.591  12.349   3.877
  144    H    VAL  21           H        VAL  21  -1.607   7.406  -1.917
  145    HA   VAL  21           HA       VAL  21  -2.079   4.821  -2.717
  146    HB   VAL  21           HB       VAL  21  -1.322   7.010  -4.651
  147   1HG1  VAL  21          1HG1      VAL  21  -3.476   4.992  -5.078
  148   2HG1  VAL  21          2HG1      VAL  21  -1.792   4.520  -5.305
  149   3HG1  VAL  21          3HG1      VAL  21  -2.474   5.838  -6.259
  150   1HG2  VAL  21          1HG2      VAL  21  -2.892   8.123  -3.372
  151   2HG2  VAL  21          2HG2      VAL  21  -3.780   6.648  -2.990
  152   3HG2  VAL  21          3HG2      VAL  21  -3.904   7.359  -4.598
  153    H    LYS  22           H        LYS  22   0.906   6.598  -2.808
  154    HA   LYS  22           HA       LYS  22   2.306   4.981  -4.658
  155   1HB   LYS  22          2HB       LYS  22   4.324   6.000  -3.749
  156   2HB   LYS  22          1HB       LYS  22   3.078   7.220  -3.978
  157   1HG   LYS  22          2HG       LYS  22   3.774   7.826  -1.914
  158   2HG   LYS  22          1HG       LYS  22   2.574   6.623  -1.440
  159   1HD   LYS  22          2HD       LYS  22   4.274   5.765  -0.235
  160   2HD   LYS  22          1HD       LYS  22   4.753   5.053  -1.776
  161   1HE   LYS  22          2HE       LYS  22   6.700   6.059  -0.922
  162   2HE   LYS  22          1HE       LYS  22   6.108   7.163  -2.163
  163   1HZ   LYS  22          1HZ       LYS  22   5.634   7.466   0.754
  164   2HZ   LYS  22          2HZ       LYS  22   5.146   8.546  -0.454
  165   3HZ   LYS  22          3HZ       LYS  22   6.792   8.320  -0.137
  166    H    THR  23           H        THR  23   1.810   4.800  -1.176
  167    HA   THR  23           HA       THR  23   3.645   2.696  -0.701
  168    HB   THR  23           HB       THR  23   1.212   2.919   0.996
  169    HG1  THR  23           1HG      THR  23   1.617   4.904   1.660
  170   1HG2  THR  23          1HG2      THR  23   4.131   2.984   1.714
  171   2HG2  THR  23          2HG2      THR  23   3.136   1.529   1.666
  172   3HG2  THR  23          3HG2      THR  23   2.766   2.814   2.817
  173    H    TYR  24           H        TYR  24   0.205   2.784  -1.469
  174    HA   TYR  24           HA       TYR  24  -0.269   0.014  -1.206
  175   1HB   TYR  24          2HB       TYR  24  -2.003   1.858  -1.341
  176   2HB   TYR  24          1HB       TYR  24  -1.719   1.889  -3.077
  177    HD1  TYR  24           1HD      TYR  24  -3.734   1.114  -3.974
  178    HD2  TYR  24           2HD      TYR  24  -1.892  -1.064  -0.817
  179    HE1  TYR  24           1HE      TYR  24  -5.369  -0.698  -4.278
  180    HE2  TYR  24           2HE      TYR  24  -3.520  -2.882  -1.112
  181    HH   TYR  24           HH       TYR  24  -5.379  -3.274  -3.767
  182    H    LEU  25           H        LEU  25   1.133   1.970  -3.702
  183    HA   LEU  25           HA       LEU  25   0.909   0.008  -5.785
  184   1HB   LEU  25          2HB       LEU  25   2.291   2.630  -5.447
  185   2HB   LEU  25          1HB       LEU  25   2.858   1.557  -6.712
  186    HG   LEU  25           HG       LEU  25  -0.059   2.162  -6.569
  187   1HD1  LEU  25          1HD1      LEU  25   1.828   4.000  -8.000
  188   2HD1  LEU  25          2HD1      LEU  25   1.309   4.315  -6.345
  189   3HD1  LEU  25          3HD1      LEU  25   0.117   4.227  -7.642
  190   1HD2  LEU  25          1HD2      LEU  25   1.948   1.364  -8.628
  191   2HD2  LEU  25          2HD2      LEU  25   0.463   2.176  -9.123
  192   3HD2  LEU  25          3HD2      LEU  25   0.382   0.647  -8.247
  193    H    ALA  26           H        ALA  26   3.460   1.115  -3.598
  194    HA   ALA  26           HA       ALA  26   5.480  -0.596  -4.519
  195   1HB   ALA  26          1HB       ALA  26   6.008   1.311  -3.137
  196   2HB   ALA  26          2HB       ALA  26   6.560  -0.159  -2.335
  197   3HB   ALA  26          3HB       ALA  26   5.082   0.637  -1.796
  198    H    HIS  27           H        HIS  27   2.830  -1.057  -2.273
  199    HA   HIS  27           HA       HIS  27   3.768  -3.481  -1.132
  200   1HB   HIS  27          2HB       HIS  27   2.063  -2.304   0.053
  201   2HB   HIS  27          1HB       HIS  27   1.011  -2.266  -1.358
  202    HD1  HIS  27           1HD      HIS  27   2.434  -4.805   1.101
  203    HD2  HIS  27           2HD      HIS  27  -0.753  -4.304  -1.515
  204    HE1  HIS  27           1HE      HIS  27   0.927  -6.811   1.420
  205    H    LYS  28           H        LYS  28   1.323  -2.857  -3.652
  206    HA   LYS  28           HA       LYS  28   0.885  -5.542  -4.329
  207   1HB   LYS  28          2HB       LYS  28  -0.286  -3.231  -5.041
  208   2HB   LYS  28          1HB       LYS  28   0.682  -3.510  -6.482
  209   1HG   LYS  28          2HG       LYS  28  -0.462  -5.435  -7.041
  210   2HG   LYS  28          1HG       LYS  28  -1.030  -5.698  -5.391
  211   1HD   LYS  28          2HD       LYS  28  -2.662  -4.020  -5.569
  212   2HD   LYS  28          1HD       LYS  28  -1.909  -3.322  -7.004
  213   1HE   LYS  28          2HE       LYS  28  -4.020  -4.667  -7.384
  214   2HE   LYS  28          1HE       LYS  28  -2.625  -5.106  -8.369
  215   1HZ   LYS  28          1HZ       LYS  28  -2.435  -7.101  -7.370
  216   2HZ   LYS  28          2HZ       LYS  28  -4.078  -6.876  -7.037
  217   3HZ   LYS  28          3HZ       LYS  28  -2.920  -6.532  -5.852
  218    H    GLN  29           H        GLN  29   3.384  -3.296  -5.251
  219    HA   GLN  29           HA       GLN  29   4.350  -4.950  -7.416
  220   1HB   GLN  29          2HB       GLN  29   4.523  -2.294  -6.928
  221   2HB   GLN  29          1HB       GLN  29   6.090  -2.822  -6.334
  222   1HG   GLN  29          2HG       GLN  29   6.862  -3.303  -8.390
  223   2HG   GLN  29          1HG       GLN  29   5.299  -3.885  -8.960
  224   1HE2  GLN  29          1HE2      GLN  29   6.413  -2.537 -10.793
  225   2HE2  GLN  29          2HE2      GLN  29   5.866  -0.902 -10.907
  226    H    PHE  30           H        PHE  30   4.737  -4.895  -4.040
  227    HA   PHE  30           HA       PHE  30   7.283  -6.359  -4.241
  228   1HB   PHE  30          2HB       PHE  30   6.142  -4.547  -2.167
  229   2HB   PHE  30          1HB       PHE  30   7.193  -5.855  -1.638
  230    HD1  PHE  30           1HD      PHE  30   7.261  -3.541  -4.565
  231    HD2  PHE  30           2HD      PHE  30   9.277  -5.047  -1.134
  232    HE1  PHE  30           1HE      PHE  30   9.229  -2.178  -5.130
  233    HE2  PHE  30           2HE      PHE  30  11.250  -3.686  -1.692
  234    HZ   PHE  30           HZ       PHE  30  11.227  -2.250  -3.692
  235    H    TYR  31           H        TYR  31   4.346  -6.293  -2.207
  236    HA   TYR  31           HA       TYR  31   4.727  -8.989  -1.334
  237   1HB   TYR  31          2HB       TYR  31   3.357  -6.885  -0.327
  238   2HB   TYR  31          1HB       TYR  31   2.040  -7.781  -1.077
  239    HD1  TYR  31           1HD      TYR  31   4.438  -7.689   1.648
  240    HD2  TYR  31           2HD      TYR  31   1.523 -10.081  -0.321
  241    HE1  TYR  31           1HE      TYR  31   4.359  -9.184   3.597
  242    HE2  TYR  31           2HE      TYR  31   1.434 -11.584   1.624
  243    HH   TYR  31           HH       TYR  31   2.891 -10.795   4.625
  244    H    HIS  32           H        HIS  32   2.984  -7.458  -3.933
  245    HA   HIS  32           HA       HIS  32   1.870 -10.080  -4.686
  246   1HB   HIS  32          2HB       HIS  32   0.828  -7.323  -5.372
  247   2HB   HIS  32          1HB       HIS  32   0.130  -8.843  -5.924
  248    HD1  HIS  32           1HD      HIS  32  -1.285 -10.186  -4.206
  249    HD2  HIS  32           2HD      HIS  32   0.334  -6.664  -2.708
  250    HE1  HIS  32           1HE      HIS  32  -2.443  -9.751  -1.998
  251    H    LYS  33           H        LYS  33   4.395  -9.831  -5.391
  252    HA   LYS  33           HA       LYS  33   4.249  -9.532  -8.285
  253   1HB   LYS  33          2HB       LYS  33   5.846  -7.818  -6.487
  254   2HB   LYS  33          1HB       LYS  33   6.709  -8.456  -7.879
  255   1HG   LYS  33          2HG       LYS  33   4.157  -6.858  -7.960
  256   2HG   LYS  33          1HG       LYS  33   5.774  -6.267  -8.354
  257   1HD   LYS  33          2HD       LYS  33   5.656  -8.394  -9.991
  258   2HD   LYS  33          1HD       LYS  33   3.942  -7.984  -9.915
  259   1HE   LYS  33          2HE       LYS  33   5.813  -5.736 -10.330
  260   2HE   LYS  33          1HE       LYS  33   5.660  -6.880 -11.663
  261   1HZ   LYS  33          1HZ       LYS  33   3.120  -6.522 -11.166
  262   2HZ   LYS  33          2HZ       LYS  33   3.977  -5.457 -12.161
  263   3HZ   LYS  33          3HZ       LYS  33   3.672  -5.045 -10.550
  264    H    ASN  34           H        ASN  34   4.209 -11.918  -7.579
  265    HA   ASN  34           HA       ASN  34   5.224 -13.948  -7.307
  266   1HB   ASN  34          2HB       ASN  34   7.015 -14.373  -8.924
  267   2HB   ASN  34          1HB       ASN  34   5.721 -13.426  -9.651
  268   1HD2  ASN  34          1HD2      ASN  34   9.029 -13.583  -8.899
  269   2HD2  ASN  34          2HD2      ASN  34   9.480 -12.022  -9.486
  270    H    LYS  35           H        LYS  35   5.681 -12.912  -5.024
  271    HA   LYS  35           HA       LYS  35   8.366 -12.307  -4.349
  272   1HB   LYS  35          2HB       LYS  35   7.615 -12.638  -2.010
  273   2HB   LYS  35          1HB       LYS  35   6.554 -11.575  -2.924
  274   1HG   LYS  35          2HG       LYS  35   5.329 -13.936  -3.341
  275   2HG   LYS  35          1HG       LYS  35   6.033 -14.221  -1.748
  276   1HD   LYS  35          2HD       LYS  35   4.738 -11.605  -2.059
  277   2HD   LYS  35          1HD       LYS  35   3.646 -12.984  -2.201
  278   1HE   LYS  35          2HE       LYS  35   5.571 -13.110   0.024
  279   2HE   LYS  35          1HE       LYS  35   4.357 -11.837   0.144
  280   1HZ   LYS  35          1HZ       LYS  35   2.838 -13.904  -0.557
  281   2HZ   LYS  35          2HZ       LYS  35   3.152 -13.487   1.052
  282   3HZ   LYS  35          3HZ       LYS  35   4.043 -14.718   0.308
  283    HA   PRO  36           HA       PRO  36  10.221 -16.295  -4.063
  284   1HB   PRO  36          2HB       PRO  36  11.949 -15.955  -1.998
  285   2HB   PRO  36          1HB       PRO  36  12.202 -15.229  -3.590
  286   1HG   PRO  36          2HG       PRO  36  11.090 -13.994  -1.099
  287   2HG   PRO  36          1HG       PRO  36  12.252 -13.322  -2.258
  288   1HD   PRO  36          2HD       PRO  36   9.629 -12.654  -2.274
  289   2HD   PRO  36          1HD       PRO  36  10.605 -12.723  -3.755
  Start of MODEL   15
    1   1H    GLY   1          1HT       GLY   1 -12.515   0.594 -12.910
    2   2H    GLY   1          2HT       GLY   1 -13.053  -0.128 -11.477
    3   3H    GLY   1          3HT       GLY   1 -11.408   0.201 -11.692
    4   1HA   GLY   1          1HA       GLY   1 -11.817   2.037 -10.506
    5   2HA   GLY   1          2HA       GLY   1 -12.424   2.643 -12.039
    6    H    SER   2           H        SER   2 -14.806   1.442 -12.353
    7    HA   SER   2           HA       SER   2 -17.001   1.617 -11.785
    8   1HB   SER   2          2HB       SER   2 -17.654   0.719  -9.725
    9   2HB   SER   2          1HB       SER   2 -16.068  -0.007  -9.984
   10    HG   SER   2           HG       SER   2 -16.011   0.765  -7.940
   11    H    ALA   3           H        ALA   3 -15.557   4.030 -12.048
   12    HA   ALA   3           HA       ALA   3 -15.800   6.267 -11.715
   13   1HB   ALA   3          1HB       ALA   3 -18.304   5.700 -10.160
   14   2HB   ALA   3          2HB       ALA   3 -18.239   5.523 -11.914
   15   3HB   ALA   3          3HB       ALA   3 -17.922   7.092 -11.174
   16    H    ALA   4           H        ALA   4 -14.378   7.202 -10.409
   17    HA   ALA   4           HA       ALA   4 -13.317   7.951  -8.541
   18   1HB   ALA   4          1HB       ALA   4 -15.742   8.658  -8.077
   19   2HB   ALA   4          2HB       ALA   4 -14.612   8.628  -6.724
   20   3HB   ALA   4          3HB       ALA   4 -15.768   7.313  -6.936
   21    H    GLU   5           H        GLU   5 -13.258   7.212  -5.933
   22    HA   GLU   5           HA       GLU   5 -13.435   4.631  -5.119
   23   1HB   GLU   5          2HB       GLU   5 -11.323   4.925  -7.126
   24   2HB   GLU   5          1HB       GLU   5 -10.749   4.211  -5.625
   25   1HG   GLU   5          2HG       GLU   5 -13.264   3.108  -6.676
   26   2HG   GLU   5          1HG       GLU   5 -11.827   2.811  -7.652
   27    H    VAL   6           H        VAL   6 -13.679   6.555  -3.559
   28    HA   VAL   6           HA       VAL   6 -11.466   7.863  -2.463
   29    HB   VAL   6           HB       VAL   6 -13.789   8.538  -2.014
   30   1HG1  VAL   6          1HG1      VAL   6 -13.990   6.304  -0.023
   31   2HG1  VAL   6          2HG1      VAL   6 -14.538   6.107  -1.688
   32   3HG1  VAL   6          3HG1      VAL   6 -15.266   7.341  -0.660
   33   1HG2  VAL   6          1HG2      VAL   6 -12.613   9.626  -0.438
   34   2HG2  VAL   6          2HG2      VAL   6 -11.749   8.173   0.064
   35   3HG2  VAL   6          3HG2      VAL   6 -13.376   8.486   0.671
   36    H    MET   7           H        MET   7 -12.957   4.765  -1.626
   37    HA   MET   7           HA       MET   7 -11.256   4.282   0.615
   38   1HB   MET   7          2HB       MET   7 -13.468   3.242   0.426
   39   2HB   MET   7          1HB       MET   7 -12.943   2.364  -1.004
   40   1HG   MET   7          2HG       MET   7 -11.578   0.944   0.207
   41   2HG   MET   7          1HG       MET   7 -11.481   2.045   1.579
   42   1HE   MET   7          1HE       MET   7 -12.747   1.929   3.559
   43   2HE   MET   7          2HE       MET   7 -14.345   1.220   3.792
   44   3HE   MET   7          3HE       MET   7 -14.163   2.688   2.830
   45    H    LYS   8           H        LYS   8  -9.332   4.937  -0.830
   46    HA   LYS   8           HA       LYS   8  -8.277   2.606  -2.264
   47   1HB   LYS   8          2HB       LYS   8  -6.721   4.126  -3.333
   48   2HB   LYS   8          1HB       LYS   8  -8.358   4.740  -3.513
   49   1HG   LYS   8          2HG       LYS   8  -7.967   6.562  -2.227
   50   2HG   LYS   8          1HG       LYS   8  -6.820   5.717  -1.184
   51   1HD   LYS   8          2HD       LYS   8  -5.547   7.292  -2.397
   52   2HD   LYS   8          1HD       LYS   8  -5.229   5.732  -3.157
   53   1HE   LYS   8          2HE       LYS   8  -7.482   7.313  -4.243
   54   2HE   LYS   8          1HE       LYS   8  -5.861   7.937  -4.541
   55   1HZ   LYS   8          1HZ       LYS   8  -5.521   5.382  -5.175
   56   2HZ   LYS   8          2HZ       LYS   8  -5.990   6.557  -6.297
   57   3HZ   LYS   8          3HZ       LYS   8  -7.154   5.555  -5.588
   58    H    LYS   9           H        LYS   9  -5.689   2.730  -2.146
   59    HA   LYS   9           HA       LYS   9  -3.865   2.227  -0.888
   60   1HB   LYS   9          2HB       LYS   9  -4.878   4.104   1.226
   61   2HB   LYS   9          1HB       LYS   9  -3.222   3.782   0.743
   62   1HG   LYS   9          2HG       LYS   9  -3.256   5.324  -0.880
   63   2HG   LYS   9          1HG       LYS   9  -4.902   4.923  -1.370
   64   1HD   LYS   9          2HD       LYS   9  -5.408   6.922  -0.466
   65   2HD   LYS   9          1HD       LYS   9  -5.344   6.041   1.062
   66   1HE   LYS   9          2HE       LYS   9  -3.479   7.096   1.723
   67   2HE   LYS   9          1HE       LYS   9  -2.736   6.978   0.128
   68   1HZ   LYS   9          1HZ       LYS   9  -3.365   9.281   1.077
   69   2HZ   LYS   9          2HZ       LYS   9  -4.932   8.884   0.582
   70   3HZ   LYS   9          3HZ       LYS   9  -3.679   8.947  -0.552
   71    H    TYR  10           H        TYR  10  -5.790   0.362  -0.639
   72    HA   TYR  10           HA       TYR  10  -5.279  -0.673   2.010
   73   1HB   TYR  10          2HB       TYR  10  -7.461   0.764   2.020
   74   2HB   TYR  10          1HB       TYR  10  -8.162  -0.614   1.177
   75    HD1  TYR  10           1HD      TYR  10  -7.701   0.817   4.309
   76    HD2  TYR  10           2HD      TYR  10  -7.570  -2.961   2.355
   77    HE1  TYR  10           1HE      TYR  10  -8.072  -0.304   6.465
   78    HE2  TYR  10           2HE      TYR  10  -7.942  -4.092   4.507
   79    HH   TYR  10           HH       TYR  10  -7.414  -2.922   7.317
   80    H    CYS  11           H        CYS  11  -4.872  -2.790   1.847
   81    HA   CYS  11           HA       CYS  11  -5.419  -4.118  -0.668
   82   1HB   CYS  11          2HB       CYS  11  -3.230  -4.324   0.604
   83   2HB   CYS  11          1HB       CYS  11  -4.093  -5.342   1.748
   84    H    SER  12           H        SER  12  -7.043  -5.426  -1.066
   85    HA   SER  12           HA       SER  12  -8.928  -6.077   1.036
   86   1HB   SER  12          2HB       SER  12 -10.331  -6.932  -0.831
   87   2HB   SER  12          1HB       SER  12  -9.824  -5.260  -1.068
   88    HG   SER  12           HG       SER  12  -9.236  -6.049  -2.946
   89    H    THR  13           H        THR  13  -6.204  -7.422   0.693
   90    HA   THR  13           HA       THR  13  -7.217 -10.158   0.898
   91    HB   THR  13           HB       THR  13  -4.693  -9.344  -0.551
   92    HG1  THR  13           1HG      THR  13  -6.738  -8.974  -1.654
   93   1HG2  THR  13          1HG2      THR  13  -4.137 -11.505  -0.854
   94   2HG2  THR  13          2HG2      THR  13  -5.813 -12.056  -0.838
   95   3HG2  THR  13          3HG2      THR  13  -4.989 -11.692   0.679
   96    H    CYS  14           H        CYS  14  -4.748  -7.796   1.726
   97    HA   CYS  14           HA       CYS  14  -3.725  -9.600   3.805
   98   1HB   CYS  14          2HB       CYS  14  -2.598  -6.963   2.849
   99   2HB   CYS  14          1HB       CYS  14  -1.835  -8.067   3.986
  100    H    ASP  15           H        ASP  15  -6.081  -7.342   3.535
  101    HA   ASP  15           HA       ASP  15  -7.205  -5.986   4.963
  102   1HB   ASP  15          2HB       ASP  15  -5.921  -7.836   6.980
  103   2HB   ASP  15          1HB       ASP  15  -7.238  -6.724   7.333
  104    H    ILE  16           H        ILE  16  -4.746  -4.993   4.094
  105    HA   ILE  16           HA       ILE  16  -3.781  -3.523   6.460
  106    HB   ILE  16           HB       ILE  16  -2.241  -3.754   3.889
  107   1HG1  ILE  16          2HG1      ILE  16  -2.706  -6.039   4.702
  108   2HG1  ILE  16          1HG1      ILE  16  -1.001  -5.629   4.841
  109   1HG2  ILE  16          1HG2      ILE  16  -0.349  -3.464   5.618
  110   2HG2  ILE  16          2HG2      ILE  16  -1.635  -2.940   6.705
  111   3HG2  ILE  16          3HG2      ILE  16  -1.339  -2.065   5.203
  112   1HD1  ILE  16          1HD1      ILE  16  -1.820  -6.842   6.792
  113   2HD1  ILE  16          2HD1      ILE  16  -2.998  -5.564   7.089
  114   3HD1  ILE  16          3HD1      ILE  16  -1.273  -5.219   7.214
  115    H    SER  17           H        SER  17  -3.066  -1.285   6.023
  116    HA   SER  17           HA       SER  17  -4.546  -0.039   3.808
  117   1HB   SER  17          2HB       SER  17  -5.625   0.148   6.168
  118   2HB   SER  17          1HB       SER  17  -4.336   1.308   6.490
  119    HG   SER  17           HG       SER  17  -6.141   2.392   5.701
  120    H    PHE  18           H        PHE  18  -3.776   2.161   3.291
  121    HA   PHE  18           HA       PHE  18  -1.021   2.701   4.090
  122   1HB   PHE  18          2HB       PHE  18  -2.012   2.412   1.250
  123   2HB   PHE  18          1HB       PHE  18  -0.474   3.147   1.675
  124    HD1  PHE  18           1HD      PHE  18   1.243   1.731   2.875
  125    HD2  PHE  18           2HD      PHE  18  -2.246   0.101   1.067
  126    HE1  PHE  18           1HE      PHE  18   2.289  -0.496   2.872
  127    HE2  PHE  18           2HE      PHE  18  -1.208  -2.129   1.060
  128    HZ   PHE  18           HZ       PHE  18   1.062  -2.430   1.963
  129    H    ASN  19           H        ASN  19  -0.542   4.838   4.228
  130    HA   ASN  19           HA       ASN  19  -2.763   6.694   3.917
  131   1HB   ASN  19          2HB       ASN  19  -0.195   6.686   5.413
  132   2HB   ASN  19          1HB       ASN  19  -0.825   8.252   4.915
  133   1HD2  ASN  19          1HD2      ASN  19  -1.109   8.774   7.117
  134   2HD2  ASN  19          2HD2      ASN  19  -2.454   8.158   8.010
  135    H    TYR  20           H        TYR  20  -0.825   5.539   1.733
  136    HA   TYR  20           HA       TYR  20  -0.810   7.957   0.163
  137   1HB   TYR  20          2HB       TYR  20   1.721   6.624   1.077
  138   2HB   TYR  20          1HB       TYR  20   1.666   7.486  -0.455
  139    HD1  TYR  20           1HD      TYR  20   0.186   9.859  -0.003
  140    HD2  TYR  20           2HD      TYR  20   2.819   7.863   2.678
  141    HE1  TYR  20           1HE      TYR  20   0.586  11.981   1.174
  142    HE2  TYR  20           2HE      TYR  20   3.226   9.980   3.863
  143    HH   TYR  20           HH       TYR  20   2.216  13.009   2.614
  144    H    VAL  21           H        VAL  21  -1.476   7.417  -1.805
  145    HA   VAL  21           HA       VAL  21  -2.062   4.860  -2.650
  146    HB   VAL  21           HB       VAL  21  -1.286   7.051  -4.571
  147   1HG1  VAL  21          1HG1      VAL  21  -2.586   5.965  -6.133
  148   2HG1  VAL  21          2HG1      VAL  21  -3.554   5.139  -4.912
  149   3HG1  VAL  21          3HG1      VAL  21  -1.905   4.606  -5.240
  150   1HG2  VAL  21          1HG2      VAL  21  -3.957   7.344  -4.328
  151   2HG2  VAL  21          2HG2      VAL  21  -2.779   8.310  -3.438
  152   3HG2  VAL  21          3HG2      VAL  21  -3.535   6.914  -2.669
  153    H    LYS  22           H        LYS  22   0.964   6.570  -2.798
  154    HA   LYS  22           HA       LYS  22   2.265   4.944  -4.711
  155   1HB   LYS  22          2HB       LYS  22   3.499   6.482  -2.417
  156   2HB   LYS  22          1HB       LYS  22   4.335   5.905  -3.851
  157   1HG   LYS  22          2HG       LYS  22   3.413   7.514  -5.207
  158   2HG   LYS  22          1HG       LYS  22   2.012   7.745  -4.160
  159   1HD   LYS  22          2HD       LYS  22   3.094   9.210  -2.806
  160   2HD   LYS  22          1HD       LYS  22   4.653   8.405  -3.004
  161   1HE   LYS  22          2HE       LYS  22   3.351  10.004  -5.195
  162   2HE   LYS  22          1HE       LYS  22   4.444  10.721  -4.011
  163   1HZ   LYS  22          1HZ       LYS  22   5.026   8.883  -6.206
  164   2HZ   LYS  22          2HZ       LYS  22   5.946   8.718  -4.797
  165   3HZ   LYS  22          3HZ       LYS  22   5.926  10.193  -5.624
  166    H    THR  23           H        THR  23   1.935   4.753  -1.204
  167    HA   THR  23           HA       THR  23   3.708   2.572  -0.858
  168    HB   THR  23           HB       THR  23   1.404   2.948   0.999
  169    HG1  THR  23           1HG      THR  23   3.552   4.789   0.829
  170   1HG2  THR  23          1HG2      THR  23   3.176   2.810   2.704
  171   2HG2  THR  23          2HG2      THR  23   4.361   2.594   1.416
  172   3HG2  THR  23          3HG2      THR  23   3.099   1.387   1.666
  173    H    TYR  24           H        TYR  24   0.234   2.817  -1.406
  174    HA   TYR  24           HA       TYR  24  -0.362   0.082  -1.073
  175   1HB   TYR  24          2HB       TYR  24  -2.030   1.964  -1.160
  176   2HB   TYR  24          1HB       TYR  24  -1.781   2.028  -2.901
  177    HD1  TYR  24           1HD      TYR  24  -3.849   1.363  -3.769
  178    HD2  TYR  24           2HD      TYR  24  -2.027  -0.972  -0.716
  179    HE1  TYR  24           1HE      TYR  24  -5.564  -0.372  -4.080
  180    HE2  TYR  24           2HE      TYR  24  -3.735  -2.714  -1.019
  181    HH   TYR  24           HH       TYR  24  -5.383  -3.291  -3.346
  182    H    LEU  25           H        LEU  25   0.965   1.935  -3.698
  183    HA   LEU  25           HA       LEU  25   0.615  -0.106  -5.690
  184   1HB   LEU  25          2HB       LEU  25   2.144   2.473  -5.545
  185   2HB   LEU  25          1HB       LEU  25   2.429   1.351  -6.863
  186    HG   LEU  25           HG       LEU  25  -0.385   2.147  -6.315
  187   1HD1  LEU  25          1HD1      LEU  25   0.238   4.321  -6.329
  188   2HD1  LEU  25          2HD1      LEU  25   0.267   4.052  -8.073
  189   3HD1  LEU  25          3HD1      LEU  25   1.767   3.993  -7.147
  190   1HD2  LEU  25          1HD2      LEU  25  -0.142   2.227  -8.939
  191   2HD2  LEU  25          2HD2      LEU  25  -0.319   0.698  -8.079
  192   3HD2  LEU  25          3HD2      LEU  25   1.276   1.234  -8.605
  193    H    ALA  26           H        ALA  26   3.227   1.033  -3.615
  194    HA   ALA  26           HA       ALA  26   5.239  -0.664  -4.577
  195   1HB   ALA  26          1HB       ALA  26   5.201   1.384  -2.835
  196   2HB   ALA  26          2HB       ALA  26   6.537   0.240  -2.963
  197   3HB   ALA  26          3HB       ALA  26   5.312   0.029  -1.712
  198    H    HIS  27           H        HIS  27   2.639  -1.158  -2.275
  199    HA   HIS  27           HA       HIS  27   3.689  -3.583  -1.189
  200   1HB   HIS  27          2HB       HIS  27   2.123  -2.413   0.170
  201   2HB   HIS  27          1HB       HIS  27   0.944  -2.328  -1.135
  202    HD1  HIS  27           1HD      HIS  27   2.418  -4.800   1.324
  203    HD2  HIS  27           2HD      HIS  27  -0.735  -4.475  -1.360
  204    HE1  HIS  27           1HE      HIS  27   0.965  -6.839   1.683
  205    H    LYS  28           H        LYS  28   1.343  -2.814  -3.727
  206    HA   LYS  28           HA       LYS  28   0.692  -5.538  -4.266
  207   1HB   LYS  28          2HB       LYS  28  -0.544  -3.249  -4.853
  208   2HB   LYS  28          1HB       LYS  28   0.332  -3.458  -6.364
  209   1HG   LYS  28          2HG       LYS  28  -0.669  -5.870  -6.266
  210   2HG   LYS  28          1HG       LYS  28  -1.844  -5.114  -5.188
  211   1HD   LYS  28          2HD       LYS  28  -1.171  -4.064  -7.931
  212   2HD   LYS  28          1HD       LYS  28  -2.506  -5.171  -7.608
  213   1HE   LYS  28          2HE       LYS  28  -3.775  -3.568  -6.648
  214   2HE   LYS  28          1HE       LYS  28  -2.391  -2.777  -5.896
  215   1HZ   LYS  28          1HZ       LYS  28  -2.097  -1.422  -7.654
  216   2HZ   LYS  28          2HZ       LYS  28  -3.736  -1.735  -7.928
  217   3HZ   LYS  28          3HZ       LYS  28  -2.557  -2.587  -8.791
  218    H    GLN  29           H        GLN  29   3.180  -3.366  -5.334
  219    HA   GLN  29           HA       GLN  29   3.896  -4.985  -7.621
  220   1HB   GLN  29          2HB       GLN  29   4.581  -2.350  -6.582
  221   2HB   GLN  29          1HB       GLN  29   5.984  -3.219  -7.188
  222   1HG   GLN  29          2HG       GLN  29   5.167  -1.968  -8.997
  223   2HG   GLN  29          1HG       GLN  29   4.665  -3.632  -9.297
  224   1HE2  GLN  29          1HE2      GLN  29   3.677  -0.481  -9.276
  225   2HE2  GLN  29          2HE2      GLN  29   1.968  -0.721  -9.200
  226    H    PHE  30           H        PHE  30   4.787  -4.783  -4.278
  227    HA   PHE  30           HA       PHE  30   7.068  -6.576  -4.801
  228   1HB   PHE  30          2HB       PHE  30   6.674  -4.357  -2.875
  229   2HB   PHE  30          1HB       PHE  30   7.561  -5.760  -2.288
  230    HD1  PHE  30           1HD      PHE  30   7.599  -2.903  -4.540
  231    HD2  PHE  30           2HD      PHE  30   9.700  -6.382  -3.277
  232    HE1  PHE  30           1HE      PHE  30   9.637  -2.063  -5.632
  233    HE2  PHE  30           2HE      PHE  30  11.743  -5.548  -4.366
  234    HZ   PHE  30           HZ       PHE  30  11.713  -3.386  -5.545
  235    H    TYR  31           H        TYR  31   4.449  -5.931  -2.480
  236    HA   TYR  31           HA       TYR  31   4.818  -8.410  -1.107
  237   1HB   TYR  31          2HB       TYR  31   3.607  -6.085  -0.450
  238   2HB   TYR  31          1HB       TYR  31   2.201  -7.049  -0.893
  239    HD1  TYR  31           1HD      TYR  31   4.799  -6.498   1.571
  240    HD2  TYR  31           2HD      TYR  31   1.710  -9.152   0.340
  241    HE1  TYR  31           1HE      TYR  31   4.843  -7.566   3.786
  242    HE2  TYR  31           2HE      TYR  31   1.744 -10.227   2.552
  243    HH   TYR  31           HH       TYR  31   2.420  -9.762   4.816
  244    H    HIS  32           H        HIS  32   3.509  -7.758  -4.109
  245    HA   HIS  32           HA       HIS  32   2.059 -10.304  -4.050
  246   1HB   HIS  32          2HB       HIS  32   1.003  -7.686  -5.107
  247   2HB   HIS  32          1HB       HIS  32   0.336  -9.241  -5.593
  248    HD1  HIS  32           1HD      HIS  32  -1.166 -10.465  -3.880
  249    HD2  HIS  32           2HD      HIS  32   0.490  -6.929  -2.456
  250    HE1  HIS  32           1HE      HIS  32  -2.368  -9.935  -1.716
  251    H    LYS  33           H        LYS  33   4.672  -9.133  -5.154
  252    HA   LYS  33           HA       LYS  33   4.952 -10.756  -7.368
  253   1HB   LYS  33          2HB       LYS  33   5.049  -8.970  -9.184
  254   2HB   LYS  33          1HB       LYS  33   3.450  -9.476  -8.660
  255   1HG   LYS  33          2HG       LYS  33   3.809  -7.404  -7.008
  256   2HG   LYS  33          1HG       LYS  33   4.814  -6.877  -8.360
  257   1HD   LYS  33          2HD       LYS  33   1.926  -7.731  -8.550
  258   2HD   LYS  33          1HD       LYS  33   2.505  -6.064  -8.559
  259   1HE   LYS  33          2HE       LYS  33   3.033  -8.203 -10.612
  260   2HE   LYS  33          1HE       LYS  33   2.098  -6.723 -10.822
  261   1HZ   LYS  33          1HZ       LYS  33   5.021  -7.040 -10.582
  262   2HZ   LYS  33          2HZ       LYS  33   4.285  -5.559 -10.231
  263   3HZ   LYS  33          3HZ       LYS  33   4.135  -6.231 -11.776
  264    H    ASN  34           H        ASN  34   6.773 -10.816  -5.787
  265    HA   ASN  34           HA       ASN  34   8.762  -8.711  -6.287
  266   1HB   ASN  34          2HB       ASN  34   7.966  -9.671  -3.903
  267   2HB   ASN  34          1HB       ASN  34   9.278 -10.796  -4.240
  268   1HD2  ASN  34          1HD2      ASN  34   9.525  -9.221  -2.101
  269   2HD2  ASN  34          2HD2      ASN  34  10.698  -7.983  -2.373
  270    H    LYS  35           H        LYS  35   8.178 -10.742  -8.239
  271    HA   LYS  35           HA       LYS  35   9.984 -12.881  -8.204
  272   1HB   LYS  35          2HB       LYS  35   8.754 -11.375 -10.515
  273   2HB   LYS  35          1HB       LYS  35   9.700 -12.845 -10.707
  274   1HG   LYS  35          2HG       LYS  35   8.017 -13.876  -9.047
  275   2HG   LYS  35          1HG       LYS  35   7.009 -12.485  -9.454
  276   1HD   LYS  35          2HD       LYS  35   8.187 -13.911 -11.746
  277   2HD   LYS  35          1HD       LYS  35   6.997 -14.824 -10.816
  278   1HE   LYS  35          2HE       LYS  35   6.095 -13.472 -12.752
  279   2HE   LYS  35          1HE       LYS  35   5.318 -13.206 -11.192
  280   1HZ   LYS  35          1HZ       LYS  35   7.515 -11.474 -12.151
  281   2HZ   LYS  35          2HZ       LYS  35   6.381 -11.157 -10.938
  282   3HZ   LYS  35          3HZ       LYS  35   5.901 -11.171 -12.559
  283    HA   PRO  36           HA       PRO  36  13.906 -11.000  -8.944
  284   1HB   PRO  36          2HB       PRO  36  15.185 -12.989 -10.277
  285   2HB   PRO  36          1HB       PRO  36  14.840 -13.064  -8.545
  286   1HG   PRO  36          2HG       PRO  36  13.361 -14.315 -10.828
  287   2HG   PRO  36          1HG       PRO  36  13.792 -15.015  -9.256
  288   1HD   PRO  36          2HD       PRO  36  11.315 -14.061  -9.798
  289   2HD   PRO  36          1HD       PRO  36  12.033 -13.986  -8.176
  Start of MODEL   16
    1   1H    GLY   1          1HT       GLY   1 -16.041  -4.273 -13.776
    2   2H    GLY   1          2HT       GLY   1 -17.367  -4.719 -12.825
    3   3H    GLY   1          3HT       GLY   1 -17.390  -5.001 -14.492
    4   1HA   GLY   1          1HA       GLY   1 -16.935  -7.082 -13.576
    5   2HA   GLY   1          2HA       GLY   1 -15.391  -6.475 -14.154
    6    H    SER   2           H        SER   2 -14.017  -5.361 -12.533
    7    HA   SER   2           HA       SER   2 -14.165  -6.808  -9.991
    8   1HB   SER   2          2HB       SER   2 -11.927  -5.453 -11.479
    9   2HB   SER   2          1HB       SER   2 -11.765  -5.863  -9.771
   10    HG   SER   2           HG       SER   2 -12.438  -8.055 -10.496
   11    H    ALA   3           H        ALA   3 -15.918  -4.598 -10.427
   12    HA   ALA   3           HA       ALA   3 -16.700  -2.749  -9.355
   13   1HB   ALA   3          1HB       ALA   3 -15.377  -2.343  -7.062
   14   2HB   ALA   3          2HB       ALA   3 -14.910  -4.015  -7.373
   15   3HB   ALA   3          3HB       ALA   3 -16.615  -3.584  -7.253
   16    H    ALA   4           H        ALA   4 -14.526  -2.500 -11.281
   17    HA   ALA   4           HA       ALA   4 -13.284  -0.821 -12.192
   18   1HB   ALA   4          1HB       ALA   4 -13.596   1.413 -11.493
   19   2HB   ALA   4          2HB       ALA   4 -14.057   0.920  -9.864
   20   3HB   ALA   4          3HB       ALA   4 -15.139   0.603 -11.220
   21    H    GLU   5           H        GLU   5 -12.933  -0.246  -8.689
   22    HA   GLU   5           HA       GLU   5 -10.577  -1.485  -8.155
   23   1HB   GLU   5          2HB       GLU   5  -8.948   0.516  -8.369
   24   2HB   GLU   5          1HB       GLU   5  -9.303  -0.433  -9.805
   25   1HG   GLU   5          2HG       GLU   5 -10.545   1.237 -10.773
   26   2HG   GLU   5          1HG       GLU   5 -10.931   1.992  -9.227
   27    H    VAL   6           H        VAL   6 -12.374  -1.208  -6.452
   28    HA   VAL   6           HA       VAL   6 -12.690   1.151  -4.993
   29    HB   VAL   6           HB       VAL   6 -14.154  -0.811  -4.734
   30   1HG1  VAL   6          1HG1      VAL   6 -12.686  -2.649  -4.783
   31   2HG1  VAL   6          2HG1      VAL   6 -13.343  -2.618  -3.147
   32   3HG1  VAL   6          3HG1      VAL   6 -11.716  -2.014  -3.455
   33   1HG2  VAL   6          1HG2      VAL   6 -13.787   1.016  -2.947
   34   2HG2  VAL   6          2HG2      VAL   6 -12.971  -0.256  -2.040
   35   3HG2  VAL   6          3HG2      VAL   6 -14.663  -0.447  -2.497
   36    H    MET   7           H        MET   7 -11.897   1.656  -2.827
   37    HA   MET   7           HA       MET   7 -10.256   2.049  -1.302
   38   1HB   MET   7          2HB       MET   7  -8.940  -0.502  -2.229
   39   2HB   MET   7          1HB       MET   7  -8.780   0.286  -0.665
   40   1HG   MET   7          2HG       MET   7 -11.210  -1.111  -1.752
   41   2HG   MET   7          1HG       MET   7 -10.169  -1.649  -0.436
   42   1HE   MET   7          1HE       MET   7 -12.058  -2.105   1.034
   43   2HE   MET   7          2HE       MET   7 -12.702  -0.886   2.133
   44   3HE   MET   7          3HE       MET   7 -10.973  -1.229   2.113
   45    H    LYS   8           H        LYS   8  -8.774   3.574  -1.543
   46    HA   LYS   8           HA       LYS   8  -7.279   3.748  -4.024
   47   1HB   LYS   8          2HB       LYS   8  -6.700   5.977  -3.334
   48   2HB   LYS   8          1HB       LYS   8  -8.415   5.735  -3.034
   49   1HG   LYS   8          2HG       LYS   8  -7.171   4.983  -0.662
   50   2HG   LYS   8          1HG       LYS   8  -6.301   6.421  -1.198
   51   1HD   LYS   8          2HD       LYS   8  -8.018   7.338   0.043
   52   2HD   LYS   8          1HD       LYS   8  -8.686   7.388  -1.590
   53   1HE   LYS   8          2HE       LYS   8  -9.209   4.901  -0.119
   54   2HE   LYS   8          1HE       LYS   8  -9.952   6.339   0.578
   55   1HZ   LYS   8          1HZ       LYS   8 -11.373   6.534  -1.128
   56   2HZ   LYS   8          2HZ       LYS   8 -11.044   4.895  -1.383
   57   3HZ   LYS   8          3HZ       LYS   8 -10.236   6.071  -2.292
   58    H    LYS   9           H        LYS   9  -6.745   2.975  -0.674
   59    HA   LYS   9           HA       LYS   9  -4.093   2.018  -1.282
   60   1HB   LYS   9          2HB       LYS   9  -3.674   3.538   1.067
   61   2HB   LYS   9          1HB       LYS   9  -2.919   3.749  -0.503
   62   1HG   LYS   9          2HG       LYS   9  -4.693   5.269  -1.172
   63   2HG   LYS   9          1HG       LYS   9  -5.500   5.026   0.379
   64   1HD   LYS   9          2HD       LYS   9  -3.987   6.300   1.519
   65   2HD   LYS   9          1HD       LYS   9  -2.663   5.901   0.423
   66   1HE   LYS   9          2HE       LYS   9  -2.952   7.886  -0.535
   67   2HE   LYS   9          1HE       LYS   9  -4.511   7.313  -1.126
   68   1HZ   LYS   9          1HZ       LYS   9  -4.856   9.336   0.049
   69   2HZ   LYS   9          2HZ       LYS   9  -3.988   8.788   1.393
   70   3HZ   LYS   9          3HZ       LYS   9  -5.479   8.088   1.008
   71    H    TYR  10           H        TYR  10  -5.837   0.294  -0.739
   72    HA   TYR  10           HA       TYR  10  -5.237  -0.652   1.931
   73   1HB   TYR  10          2HB       TYR  10  -7.337   0.760   2.124
   74   2HB   TYR  10          1HB       TYR  10  -8.132  -0.421   1.088
   75    HD1  TYR  10           1HD      TYR  10  -7.589   0.514   4.398
   76    HD2  TYR  10           2HD      TYR  10  -7.818  -2.947   1.935
   77    HE1  TYR  10           1HE      TYR  10  -8.111  -0.850   6.376
   78    HE2  TYR  10           2HE      TYR  10  -8.340  -4.322   3.906
   79    HH   TYR  10           HH       TYR  10  -8.004  -3.155   7.103
   80    H    CYS  11           H        CYS  11  -4.844  -2.778   1.825
   81    HA   CYS  11           HA       CYS  11  -5.462  -4.173  -0.637
   82   1HB   CYS  11          2HB       CYS  11  -3.244  -4.350   0.606
   83   2HB   CYS  11          1HB       CYS  11  -4.091  -5.365   1.768
   84    H    SER  12           H        SER  12  -7.139  -5.421  -0.960
   85    HA   SER  12           HA       SER  12  -8.938  -6.061   1.221
   86   1HB   SER  12          2HB       SER  12  -9.106  -6.026  -1.746
   87   2HB   SER  12          1HB       SER  12 -10.155  -7.163  -0.899
   88    HG   SER  12           HG       SER  12 -10.017  -4.353  -0.544
   89    H    THR  13           H        THR  13  -6.251  -7.429   0.764
   90    HA   THR  13           HA       THR  13  -7.276 -10.159   0.977
   91    HB   THR  13           HB       THR  13  -4.795  -9.350  -0.545
   92    HG1  THR  13           1HG      THR  13  -6.589  -8.894  -1.773
   93   1HG2  THR  13          1HG2      THR  13  -5.653 -11.900   0.491
   94   2HG2  THR  13          2HG2      THR  13  -4.133 -11.444  -0.280
   95   3HG2  THR  13          3HG2      THR  13  -5.514 -11.923  -1.267
   96    H    CYS  14           H        CYS  14  -4.767  -7.819   1.743
   97    HA   CYS  14           HA       CYS  14  -3.687  -9.648   3.772
   98   1HB   CYS  14          2HB       CYS  14  -2.578  -7.013   2.784
   99   2HB   CYS  14          1HB       CYS  14  -1.789  -8.110   3.910
  100    H    ASP  15           H        ASP  15  -6.051  -7.399   3.605
  101    HA   ASP  15           HA       ASP  15  -7.126  -6.051   5.080
  102   1HB   ASP  15          2HB       ASP  15  -5.759  -7.903   7.039
  103   2HB   ASP  15          1HB       ASP  15  -7.069  -6.802   7.444
  104    H    ILE  16           H        ILE  16  -4.791  -4.950   4.116
  105    HA   ILE  16           HA       ILE  16  -3.739  -3.512   6.464
  106    HB   ILE  16           HB       ILE  16  -2.247  -3.741   3.866
  107   1HG1  ILE  16          2HG1      ILE  16  -2.679  -6.028   4.686
  108   2HG1  ILE  16          1HG1      ILE  16  -0.976  -5.605   4.803
  109   1HG2  ILE  16          1HG2      ILE  16  -1.576  -2.940   6.674
  110   2HG2  ILE  16          2HG2      ILE  16  -1.351  -2.037   5.177
  111   3HG2  ILE  16          3HG2      ILE  16  -0.321  -3.423   5.534
  112   1HD1  ILE  16          1HD1      ILE  16  -2.908  -5.459   7.101
  113   2HD1  ILE  16          2HD1      ILE  16  -1.155  -5.274   7.161
  114   3HD1  ILE  16          3HD1      ILE  16  -1.863  -6.839   6.761
  115    H    SER  17           H        SER  17  -3.048  -1.273   6.011
  116    HA   SER  17           HA       SER  17  -4.588  -0.040   3.828
  117   1HB   SER  17          2HB       SER  17  -4.720   1.913   5.679
  118   2HB   SER  17          1HB       SER  17  -5.959   0.669   5.513
  119    HG   SER  17           HG       SER  17  -5.151  -0.387   7.245
  120    H    PHE  18           H        PHE  18  -3.842   2.191   3.321
  121    HA   PHE  18           HA       PHE  18  -1.061   2.709   4.028
  122   1HB   PHE  18          2HB       PHE  18  -2.140   2.426   1.222
  123   2HB   PHE  18          1HB       PHE  18  -0.599   3.183   1.594
  124    HD1  PHE  18           1HD      PHE  18   1.065   1.737   2.985
  125    HD2  PHE  18           2HD      PHE  18  -2.236   0.168   0.805
  126    HE1  PHE  18           1HE      PHE  18   2.140  -0.477   2.957
  127    HE2  PHE  18           2HE      PHE  18  -1.169  -2.047   0.775
  128    HZ   PHE  18           HZ       PHE  18   1.021  -2.373   1.852
  129    H    ASN  19           H        ASN  19  -0.556   4.840   4.151
  130    HA   ASN  19           HA       ASN  19  -2.758   6.709   4.092
  131   1HB   ASN  19          2HB       ASN  19   0.030   6.718   5.128
  132   2HB   ASN  19          1HB       ASN  19  -0.687   8.277   4.732
  133   1HD2  ASN  19          1HD2      ASN  19  -0.772   5.532   6.831
  134   2HD2  ASN  19          2HD2      ASN  19  -1.869   6.190   7.992
  135    H    TYR  20           H        TYR  20  -0.198   5.783   2.001
  136    HA   TYR  20           HA       TYR  20  -0.821   8.066   0.253
  137   1HB   TYR  20          2HB       TYR  20   1.823   6.977   1.089
  138   2HB   TYR  20          1HB       TYR  20   1.659   7.554  -0.567
  139    HD1  TYR  20           1HD      TYR  20   2.036   9.795  -1.010
  140    HD2  TYR  20           2HD      TYR  20   0.972   8.632   2.942
  141    HE1  TYR  20           1HE      TYR  20   2.386  12.105  -0.241
  142    HE2  TYR  20           2HE      TYR  20   1.318  10.940   3.721
  143    HH   TYR  20           HH       TYR  20   2.841  13.324   1.786
  144    H    VAL  21           H        VAL  21  -1.417   7.558  -1.764
  145    HA   VAL  21           HA       VAL  21  -2.097   4.995  -2.544
  146    HB   VAL  21           HB       VAL  21  -1.329   7.223  -4.435
  147   1HG1  VAL  21          1HG1      VAL  21  -3.140   6.112  -5.829
  148   2HG1  VAL  21          2HG1      VAL  21  -3.010   4.748  -4.718
  149   3HG1  VAL  21          3HG1      VAL  21  -1.614   5.242  -5.676
  150   1HG2  VAL  21          1HG2      VAL  21  -3.816   7.711  -4.368
  151   2HG2  VAL  21          2HG2      VAL  21  -2.888   8.181  -2.943
  152   3HG2  VAL  21          3HG2      VAL  21  -3.873   6.718  -2.912
  153    H    LYS  22           H        LYS  22   0.960   6.649  -2.796
  154    HA   LYS  22           HA       LYS  22   2.188   4.960  -4.700
  155   1HB   LYS  22          2HB       LYS  22   3.198   6.856  -2.608
  156   2HB   LYS  22          1HB       LYS  22   4.328   5.806  -3.454
  157   1HG   LYS  22          2HG       LYS  22   4.141   6.938  -5.399
  158   2HG   LYS  22          1HG       LYS  22   2.440   7.328  -5.138
  159   1HD   LYS  22          2HD       LYS  22   2.931   9.180  -3.837
  160   2HD   LYS  22          1HD       LYS  22   4.539   8.586  -3.420
  161   1HE   LYS  22          2HE       LYS  22   4.065   9.086  -6.284
  162   2HE   LYS  22          1HE       LYS  22   4.064  10.515  -5.251
  163   1HZ   LYS  22          1HZ       LYS  22   6.235   9.491  -4.337
  164   2HZ   LYS  22          2HZ       LYS  22   6.269  10.308  -5.818
  165   3HZ   LYS  22          3HZ       LYS  22   6.248   8.616  -5.787
  166    H    THR  23           H        THR  23   1.730   4.741  -1.236
  167    HA   THR  23           HA       THR  23   3.569   2.610  -0.826
  168    HB   THR  23           HB       THR  23   1.242   2.845   0.991
  169    HG1  THR  23           1HG      THR  23   1.361   4.943   0.956
  170   1HG2  THR  23          1HG2      THR  23   4.199   2.969   1.518
  171   2HG2  THR  23          2HG2      THR  23   3.211   1.511   1.589
  172   3HG2  THR  23          3HG2      THR  23   2.917   2.831   2.721
  173    H    TYR  24           H        TYR  24   0.102   2.787  -1.454
  174    HA   TYR  24           HA       TYR  24  -0.460   0.047  -1.149
  175   1HB   TYR  24          2HB       TYR  24  -2.178   1.847  -1.286
  176   2HB   TYR  24          1HB       TYR  24  -1.823   2.014  -3.000
  177    HD1  TYR  24           1HD      TYR  24  -3.635   1.229  -4.205
  178    HD2  TYR  24           2HD      TYR  24  -2.300  -0.992  -0.831
  179    HE1  TYR  24           1HE      TYR  24  -5.276  -0.529  -4.720
  180    HE2  TYR  24           2HE      TYR  24  -3.936  -2.755  -1.336
  181    HH   TYR  24           HH       TYR  24  -5.300  -3.272  -4.070
  182    H    LEU  25           H        LEU  25   0.908   1.919  -3.740
  183    HA   LEU  25           HA       LEU  25   0.681  -0.145  -5.728
  184   1HB   LEU  25          2HB       LEU  25   2.324   2.385  -5.602
  185   2HB   LEU  25          1HB       LEU  25   2.315   1.305  -6.983
  186    HG   LEU  25           HG       LEU  25  -0.095   2.779  -5.918
  187   1HD1  LEU  25          1HD1      LEU  25   0.196   4.375  -7.527
  188   2HD1  LEU  25          2HD1      LEU  25   1.131   3.308  -8.575
  189   3HD1  LEU  25          3HD1      LEU  25   1.878   4.013  -7.141
  190   1HD2  LEU  25          1HD2      LEU  25  -0.817   2.034  -8.361
  191   2HD2  LEU  25          2HD2      LEU  25  -1.078   1.007  -6.951
  192   3HD2  LEU  25          3HD2      LEU  25   0.302   0.715  -8.011
  193    H    ALA  26           H        ALA  26   3.181   1.071  -3.565
  194    HA   ALA  26           HA       ALA  26   5.280  -0.558  -4.455
  195   1HB   ALA  26          1HB       ALA  26   5.391   1.478  -2.925
  196   2HB   ALA  26          2HB       ALA  26   6.455   0.125  -2.543
  197   3HB   ALA  26          3HB       ALA  26   4.974   0.371  -1.618
  198    H    HIS  27           H        HIS  27   2.602  -1.147  -2.272
  199    HA   HIS  27           HA       HIS  27   3.683  -3.543  -1.147
  200   1HB   HIS  27          2HB       HIS  27   2.031  -2.417   0.143
  201   2HB   HIS  27          1HB       HIS  27   0.901  -2.372  -1.207
  202    HD1  HIS  27           1HD      HIS  27   2.427  -4.867   1.222
  203    HD2  HIS  27           2HD      HIS  27  -0.781  -4.490  -1.388
  204    HE1  HIS  27           1HE      HIS  27   0.977  -6.909   1.576
  205    H    LYS  28           H        LYS  28   1.451  -2.828  -3.799
  206    HA   LYS  28           HA       LYS  28   0.892  -5.571  -4.372
  207   1HB   LYS  28          2HB       LYS  28  -0.427  -3.380  -4.993
  208   2HB   LYS  28          1HB       LYS  28   0.593  -3.416  -6.425
  209   1HG   LYS  28          2HG       LYS  28  -0.267  -5.953  -6.434
  210   2HG   LYS  28          1HG       LYS  28  -1.637  -5.176  -5.638
  211   1HD   LYS  28          2HD       LYS  28  -1.205  -3.449  -7.671
  212   2HD   LYS  28          1HD       LYS  28  -0.686  -4.961  -8.419
  213   1HE   LYS  28          2HE       LYS  28  -2.870  -5.186  -8.903
  214   2HE   LYS  28          1HE       LYS  28  -2.985  -5.750  -7.237
  215   1HZ   LYS  28          1HZ       LYS  28  -4.571  -4.156  -7.186
  216   2HZ   LYS  28          2HZ       LYS  28  -3.864  -3.229  -8.411
  217   3HZ   LYS  28          3HZ       LYS  28  -3.247  -3.161  -6.837
  218    H    GLN  29           H        GLN  29   3.358  -3.313  -5.319
  219    HA   GLN  29           HA       GLN  29   4.253  -4.920  -7.553
  220   1HB   GLN  29          2HB       GLN  29   4.415  -2.279  -7.064
  221   2HB   GLN  29          1HB       GLN  29   5.992  -2.781  -6.472
  222   1HG   GLN  29          2HG       GLN  29   4.901  -3.326  -9.223
  223   2HG   GLN  29          1HG       GLN  29   6.070  -2.074  -8.806
  224   1HE2  GLN  29          1HE2      GLN  29   5.840  -4.948 -10.213
  225   2HE2  GLN  29          2HE2      GLN  29   7.386  -5.622  -9.837
  226    H    PHE  30           H        PHE  30   4.848  -4.803  -4.173
  227    HA   PHE  30           HA       PHE  30   7.298  -6.399  -4.539
  228   1HB   PHE  30          2HB       PHE  30   6.520  -4.361  -2.516
  229   2HB   PHE  30          1HB       PHE  30   7.509  -5.709  -1.973
  230    HD1  PHE  30           1HD      PHE  30   7.510  -2.517  -3.504
  231    HD2  PHE  30           2HD      PHE  30   9.657  -6.186  -3.314
  232    HE1  PHE  30           1HE      PHE  30   9.518  -1.381  -4.358
  233    HE2  PHE  30           2HE      PHE  30  11.669  -5.058  -4.168
  234    HZ   PHE  30           HZ       PHE  30  11.602  -2.653  -4.692
  235    H    TYR  31           H        TYR  31   4.396  -6.067  -2.506
  236    HA   TYR  31           HA       TYR  31   4.791  -8.590  -1.218
  237   1HB   TYR  31          2HB       TYR  31   3.354  -6.405  -0.573
  238   2HB   TYR  31          1HB       TYR  31   2.077  -7.397  -1.271
  239    HD1  TYR  31           1HD      TYR  31   4.609  -7.217   1.410
  240    HD2  TYR  31           2HD      TYR  31   1.227  -9.303  -0.114
  241    HE1  TYR  31           1HE      TYR  31   4.418  -8.448   3.531
  242    HE2  TYR  31           2HE      TYR  31   1.027 -10.538   2.003
  243    HH   TYR  31           HH       TYR  31   3.473 -10.539   4.370
  244    H    HIS  32           H        HIS  32   2.781  -7.442  -3.891
  245    HA   HIS  32           HA       HIS  32   1.947 -10.220  -4.382
  246   1HB   HIS  32          2HB       HIS  32   0.685  -7.632  -5.310
  247   2HB   HIS  32          1HB       HIS  32   0.107  -9.243  -5.724
  248    HD1  HIS  32           1HD      HIS  32  -1.403 -10.397  -4.021
  249    HD2  HIS  32           2HD      HIS  32   0.379  -6.939  -2.559
  250    HE1  HIS  32           1HE      HIS  32  -2.515  -9.905  -1.799
  251    H    LYS  33           H        LYS  33   4.468  -9.735  -5.157
  252    HA   LYS  33           HA       LYS  33   4.288 -10.030  -8.024
  253   1HB   LYS  33          2HB       LYS  33   5.236  -7.558  -6.782
  254   2HB   LYS  33          1HB       LYS  33   6.408  -8.261  -7.888
  255   1HG   LYS  33          2HG       LYS  33   3.639  -8.125  -8.877
  256   2HG   LYS  33          1HG       LYS  33   4.455  -6.579  -8.640
  257   1HD   LYS  33          2HD       LYS  33   5.203  -6.971 -10.737
  258   2HD   LYS  33          1HD       LYS  33   6.404  -7.951  -9.894
  259   1HE   LYS  33          2HE       LYS  33   3.840  -9.267 -10.565
  260   2HE   LYS  33          1HE       LYS  33   4.908  -8.878 -11.913
  261   1HZ   LYS  33          1HZ       LYS  33   5.888 -10.312  -9.520
  262   2HZ   LYS  33          2HZ       LYS  33   6.591 -10.227 -11.056
  263   3HZ   LYS  33          3HZ       LYS  33   5.184 -11.135 -10.820
  264    H    ASN  34           H        ASN  34   4.922 -11.892  -6.109
  265    HA   ASN  34           HA       ASN  34   7.470 -12.788  -7.017
  266   1HB   ASN  34          2HB       ASN  34   8.128 -11.128  -5.251
  267   2HB   ASN  34          1HB       ASN  34   7.285 -12.128  -4.071
  268   1HD2  ASN  34          1HD2      ASN  34  10.192 -11.531  -5.592
  269   2HD2  ASN  34          2HD2      ASN  34  11.031 -12.969  -5.134
  270    H    LYS  35           H        LYS  35   5.888 -14.432  -7.609
  271    HA   LYS  35           HA       LYS  35   4.940 -16.486  -7.377
  272   1HB   LYS  35          2HB       LYS  35   6.498 -16.650  -4.794
  273   2HB   LYS  35          1HB       LYS  35   5.865 -17.995  -5.732
  274   1HG   LYS  35          2HG       LYS  35   7.461 -17.741  -7.406
  275   2HG   LYS  35          1HG       LYS  35   7.847 -16.090  -6.916
  276   1HD   LYS  35          2HD       LYS  35   8.719 -17.065  -4.756
  277   2HD   LYS  35          1HD       LYS  35   8.558 -18.655  -5.505
  278   1HE   LYS  35          2HE       LYS  35  10.802 -18.022  -5.841
  279   2HE   LYS  35          1HE       LYS  35   9.997 -17.758  -7.388
  280   1HZ   LYS  35          1HZ       LYS  35  11.260 -15.852  -7.057
  281   2HZ   LYS  35          2HZ       LYS  35  10.884 -15.751  -5.411
  282   3HZ   LYS  35          3HZ       LYS  35   9.711 -15.375  -6.570
  283    HA   PRO  36           HA       PRO  36   1.775 -14.760  -4.463
  284   1HB   PRO  36          2HB       PRO  36  -0.321 -15.063  -6.159
  285   2HB   PRO  36          1HB       PRO  36   0.729 -13.640  -6.177
  286   1HG   PRO  36          2HG       PRO  36   0.777 -16.050  -7.952
  287   2HG   PRO  36          1HG       PRO  36   0.953 -14.339  -8.384
  288   1HD   PRO  36          2HD       PRO  36   3.072 -16.009  -8.146
  289   2HD   PRO  36          1HD       PRO  36   3.170 -14.279  -7.756
  Start of MODEL   17
    1   1H    GLY   1          1HT       GLY   1 -19.207   6.892  -9.471
    2   2H    GLY   1          2HT       GLY   1 -17.636   7.477  -9.254
    3   3H    GLY   1          3HT       GLY   1 -17.890   6.026 -10.085
    4   1HA   GLY   1          1HA       GLY   1 -18.919   8.645 -11.017
    5   2HA   GLY   1          2HA       GLY   1 -17.377   7.979 -11.531
    6    H    SER   2           H        SER   2 -18.195   8.031 -13.698
    7    HA   SER   2           HA       SER   2 -20.310   6.098 -14.301
    8   1HB   SER   2          2HB       SER   2 -20.113   8.549 -15.261
    9   2HB   SER   2          1HB       SER   2 -19.011   7.784 -16.405
   10    HG   SER   2           HG       SER   2 -21.053   7.682 -17.270
   11    H    ALA   3           H        ALA   3 -17.676   5.232 -13.455
   12    HA   ALA   3           HA       ALA   3 -17.224   3.205 -15.361
   13   1HB   ALA   3          1HB       ALA   3 -16.132   4.642 -16.804
   14   2HB   ALA   3          2HB       ALA   3 -14.796   3.991 -15.855
   15   3HB   ALA   3          3HB       ALA   3 -15.434   5.595 -15.495
   16    H    ALA   4           H        ALA   4 -17.611   3.439 -12.552
   17    HA   ALA   4           HA       ALA   4 -16.854   2.554 -10.598
   18   1HB   ALA   4          1HB       ALA   4 -14.706   1.218 -12.228
   19   2HB   ALA   4          2HB       ALA   4 -16.371   0.642 -12.161
   20   3HB   ALA   4          3HB       ALA   4 -15.394   0.686 -10.694
   21    H    GLU   5           H        GLU   5 -14.982   2.498  -9.077
   22    HA   GLU   5           HA       GLU   5 -12.512   3.582  -9.368
   23   1HB   GLU   5          2HB       GLU   5 -14.568   5.658  -9.578
   24   2HB   GLU   5          1HB       GLU   5 -13.372   5.999  -8.336
   25   1HG   GLU   5          2HG       GLU   5 -12.396   5.133 -10.999
   26   2HG   GLU   5          1HG       GLU   5 -13.052   6.762 -10.841
   27    H    VAL   6           H        VAL   6 -13.007   1.774  -7.730
   28    HA   VAL   6           HA       VAL   6 -13.358   2.984  -5.063
   29    HB   VAL   6           HB       VAL   6 -13.914   0.108  -5.797
   30   1HG1  VAL   6          1HG1      VAL   6 -15.079   1.324  -3.383
   31   2HG1  VAL   6          2HG1      VAL   6 -13.328   1.107  -3.357
   32   3HG1  VAL   6          3HG1      VAL   6 -14.385  -0.279  -3.628
   33   1HG2  VAL   6          1HG2      VAL   6 -16.057   0.589  -6.272
   34   2HG2  VAL   6          2HG2      VAL   6 -15.443   2.212  -6.588
   35   3HG2  VAL   6          3HG2      VAL   6 -16.160   1.831  -5.023
   36    H    MET   7           H        MET   7 -11.084   3.444  -5.025
   37    HA   MET   7           HA       MET   7  -9.555   1.499  -3.701
   38   1HB   MET   7          2HB       MET   7  -7.802   1.094  -5.389
   39   2HB   MET   7          1HB       MET   7  -9.359   0.436  -5.878
   40   1HG   MET   7          2HG       MET   7  -9.549   1.825  -7.636
   41   2HG   MET   7          1HG       MET   7  -8.783   3.171  -6.796
   42   1HE   MET   7          1HE       MET   7  -5.480   3.386  -8.378
   43   2HE   MET   7          2HE       MET   7  -6.325   3.764  -6.877
   44   3HE   MET   7          3HE       MET   7  -7.085   4.115  -8.429
   45    H    LYS   8           H        LYS   8  -7.754   2.384  -2.747
   46    HA   LYS   8           HA       LYS   8  -6.745   4.948  -3.655
   47   1HB   LYS   8          2HB       LYS   8  -8.748   5.302  -2.066
   48   2HB   LYS   8          1HB       LYS   8  -7.669   4.735  -0.800
   49   1HG   LYS   8          2HG       LYS   8  -6.159   6.554  -1.181
   50   2HG   LYS   8          1HG       LYS   8  -7.066   7.066  -2.605
   51   1HD   LYS   8          2HD       LYS   8  -8.226   6.971   0.175
   52   2HD   LYS   8          1HD       LYS   8  -7.495   8.414  -0.531
   53   1HE   LYS   8          2HE       LYS   8  -9.129   8.343  -2.354
   54   2HE   LYS   8          1HE       LYS   8  -9.859   6.904  -1.643
   55   1HZ   LYS   8          1HZ       LYS   8 -10.043   9.688  -0.802
   56   2HZ   LYS   8          2HZ       LYS   8  -9.987   8.528   0.428
   57   3HZ   LYS   8          3HZ       LYS   8 -11.205   8.459  -0.742
   58    H    LYS   9           H        LYS   9  -6.667   2.945  -0.701
   59    HA   LYS   9           HA       LYS   9  -4.005   2.061  -1.139
   60   1HB   LYS   9          2HB       LYS   9  -3.354   3.340   1.153
   61   2HB   LYS   9          1HB       LYS   9  -2.960   3.941  -0.449
   62   1HG   LYS   9          2HG       LYS   9  -3.906   5.672   1.011
   63   2HG   LYS   9          1HG       LYS   9  -4.893   5.385  -0.421
   64   1HD   LYS   9          2HD       LYS   9  -6.556   4.295   0.793
   65   2HD   LYS   9          1HD       LYS   9  -5.479   3.963   2.150
   66   1HE   LYS   9          2HE       LYS   9  -5.455   6.319   2.737
   67   2HE   LYS   9          1HE       LYS   9  -6.463   6.697   1.340
   68   1HZ   LYS   9          1HZ       LYS   9  -7.538   6.421   3.660
   69   2HZ   LYS   9          2HZ       LYS   9  -7.418   4.764   3.341
   70   3HZ   LYS   9          3HZ       LYS   9  -8.309   5.761   2.305
   71    H    TYR  10           H        TYR  10  -5.742   0.336  -0.719
   72    HA   TYR  10           HA       TYR  10  -5.308  -0.650   1.960
   73   1HB   TYR  10          2HB       TYR  10  -7.348   0.719   2.226
   74   2HB   TYR  10          1HB       TYR  10  -8.128  -0.209   0.951
   75    HD1  TYR  10           1HD      TYR  10  -7.638   0.076   4.433
   76    HD2  TYR  10           2HD      TYR  10  -8.248  -2.796   1.355
   77    HE1  TYR  10           1HE      TYR  10  -8.429  -1.541   6.108
   78    HE2  TYR  10           2HE      TYR  10  -9.041  -4.422   3.021
   79    HH   TYR  10           HH       TYR  10  -9.929  -3.593   6.121
   80    H    CYS  11           H        CYS  11  -4.899  -2.770   1.820
   81    HA   CYS  11           HA       CYS  11  -5.442  -4.131  -0.678
   82   1HB   CYS  11          2HB       CYS  11  -3.263  -4.330   0.619
   83   2HB   CYS  11          1HB       CYS  11  -4.143  -5.339   1.761
   84    H    SER  12           H        SER  12  -7.083  -5.420  -1.068
   85    HA   SER  12           HA       SER  12  -8.977  -6.038   1.036
   86   1HB   SER  12          2HB       SER  12 -10.496  -6.627  -0.694
   87   2HB   SER  12          1HB       SER  12  -9.619  -5.216  -1.287
   88    HG   SER  12           HG       SER  12  -9.757  -6.868  -2.865
   89    H    THR  13           H        THR  13  -6.263  -7.409   0.709
   90    HA   THR  13           HA       THR  13  -7.298 -10.134   0.937
   91    HB   THR  13           HB       THR  13  -4.769  -9.350  -0.518
   92    HG1  THR  13           1HG      THR  13  -7.299 -10.230  -1.422
   93   1HG2  THR  13          1HG2      THR  13  -4.919 -11.780  -1.283
   94   2HG2  THR  13          2HG2      THR  13  -5.965 -12.018   0.117
   95   3HG2  THR  13          3HG2      THR  13  -4.306 -11.461   0.340
   96    H    CYS  14           H        CYS  14  -4.813  -7.784   1.744
   97    HA   CYS  14           HA       CYS  14  -3.803  -9.570   3.844
   98   1HB   CYS  14          2HB       CYS  14  -2.669  -6.947   2.857
   99   2HB   CYS  14          1HB       CYS  14  -1.913  -8.030   4.019
  100    H    ASP  15           H        ASP  15  -6.139  -7.284   3.534
  101    HA   ASP  15           HA       ASP  15  -7.264  -5.912   4.945
  102   1HB   ASP  15          2HB       ASP  15  -6.013  -7.759   6.984
  103   2HB   ASP  15          1HB       ASP  15  -7.322  -6.632   7.319
  104    H    ILE  16           H        ILE  16  -4.794  -4.946   4.085
  105    HA   ILE  16           HA       ILE  16  -3.841  -3.458   6.445
  106    HB   ILE  16           HB       ILE  16  -2.259  -3.752   3.906
  107   1HG1  ILE  16          2HG1      ILE  16  -2.766  -6.018   4.734
  108   2HG1  ILE  16          1HG1      ILE  16  -1.061  -5.627   4.915
  109   1HG2  ILE  16          1HG2      ILE  16  -1.409  -2.036   5.256
  110   2HG2  ILE  16          2HG2      ILE  16  -0.384  -3.428   5.605
  111   3HG2  ILE  16          3HG2      ILE  16  -1.652  -2.962   6.737
  112   1HD1  ILE  16          1HD1      ILE  16  -1.878  -6.790   6.865
  113   2HD1  ILE  16          2HD1      ILE  16  -3.137  -5.576   7.090
  114   3HD1  ILE  16          3HD1      ILE  16  -1.441  -5.135   7.284
  115    H    SER  17           H        SER  17  -3.093  -1.243   5.996
  116    HA   SER  17           HA       SER  17  -4.477   0.001   3.721
  117   1HB   SER  17          2HB       SER  17  -4.710   1.957   5.572
  118   2HB   SER  17          1HB       SER  17  -5.962   0.749   5.283
  119    HG   SER  17           HG       SER  17  -5.090  -0.466   7.001
  120    H    PHE  18           H        PHE  18  -3.624   2.134   3.148
  121    HA   PHE  18           HA       PHE  18  -0.893   2.611   4.086
  122   1HB   PHE  18          2HB       PHE  18  -1.810   2.436   1.213
  123   2HB   PHE  18          1HB       PHE  18  -0.263   3.104   1.705
  124    HD1  PHE  18           1HD      PHE  18   1.443   1.636   2.732
  125    HD2  PHE  18           2HD      PHE  18  -2.196   0.103   1.146
  126    HE1  PHE  18           1HE      PHE  18   2.411  -0.627   2.704
  127    HE2  PHE  18           2HE      PHE  18  -1.236  -2.161   1.114
  128    HZ   PHE  18           HZ       PHE  18   1.071  -2.529   1.895
  129    H    ASN  19           H        ASN  19  -0.393   4.696   4.397
  130    HA   ASN  19           HA       ASN  19  -2.464   6.646   4.333
  131   1HB   ASN  19          2HB       ASN  19  -0.818   8.124   5.307
  132   2HB   ASN  19          1HB       ASN  19  -0.699   6.548   6.071
  133   1HD2  ASN  19          1HD2      ASN  19   0.927   8.978   4.364
  134   2HD2  ASN  19          2HD2      ASN  19   2.442   8.168   4.176
  135    H    TYR  20           H        TYR  20  -0.356   5.538   1.969
  136    HA   TYR  20           HA       TYR  20  -0.920   7.877   0.311
  137   1HB   TYR  20          2HB       TYR  20   1.766   6.899   1.106
  138   2HB   TYR  20          1HB       TYR  20   1.562   7.367  -0.579
  139    HD1  TYR  20           1HD      TYR  20  -0.273   9.647  -0.373
  140    HD2  TYR  20           2HD      TYR  20   3.042   8.585   2.074
  141    HE1  TYR  20           1HE      TYR  20   0.018  12.008   0.246
  142    HE2  TYR  20           2HE      TYR  20   3.343  10.944   2.700
  143    HH   TYR  20           HH       TYR  20   1.730  13.495   1.086
  144    H    VAL  21           H        VAL  21  -1.503   7.377  -1.715
  145    HA   VAL  21           HA       VAL  21  -2.161   4.784  -2.464
  146    HB   VAL  21           HB       VAL  21  -1.528   7.017  -4.395
  147   1HG1  VAL  21          1HG1      VAL  21  -2.136   4.458  -4.969
  148   2HG1  VAL  21          2HG1      VAL  21  -2.590   5.824  -5.989
  149   3HG1  VAL  21          3HG1      VAL  21  -3.757   5.143  -4.855
  150   1HG2  VAL  21          1HG2      VAL  21  -4.192   7.171  -4.104
  151   2HG2  VAL  21          2HG2      VAL  21  -3.059   8.147  -3.168
  152   3HG2  VAL  21          3HG2      VAL  21  -3.743   6.679  -2.471
  153    H    LYS  22           H        LYS  22   0.825   6.547  -2.830
  154    HA   LYS  22           HA       LYS  22   2.036   4.900  -4.782
  155   1HB   LYS  22          2HB       LYS  22   3.211   6.679  -2.642
  156   2HB   LYS  22          1HB       LYS  22   4.186   5.850  -3.848
  157   1HG   LYS  22          2HG       LYS  22   3.949   7.746  -5.010
  158   2HG   LYS  22          1HG       LYS  22   2.365   7.089  -5.426
  159   1HD   LYS  22          2HD       LYS  22   1.818   8.267  -3.049
  160   2HD   LYS  22          1HD       LYS  22   3.085   9.332  -3.660
  161   1HE   LYS  22          2HE       LYS  22   1.851   9.843  -5.607
  162   2HE   LYS  22          1HE       LYS  22   0.715   8.524  -5.324
  163   1HZ   LYS  22          1HZ       LYS  22   0.796  11.187  -4.159
  164   2HZ   LYS  22          2HZ       LYS  22   0.367   9.934  -3.107
  165   3HZ   LYS  22          3HZ       LYS  22  -0.532  10.199  -4.515
  166    H    THR  23           H        THR  23   1.761   4.686  -1.290
  167    HA   THR  23           HA       THR  23   3.660   2.576  -1.006
  168    HB   THR  23           HB       THR  23   1.490   2.792   0.990
  169    HG1  THR  23           1HG      THR  23   1.854   4.813   1.544
  170   1HG2  THR  23          1HG2      THR  23   3.546   1.515   1.421
  171   2HG2  THR  23          2HG2      THR  23   3.292   2.822   2.578
  172   3HG2  THR  23          3HG2      THR  23   4.474   3.008   1.283
  173    H    TYR  24           H        TYR  24   0.165   2.749  -1.402
  174    HA   TYR  24           HA       TYR  24  -0.398   0.020  -1.029
  175   1HB   TYR  24          2HB       TYR  24  -2.122   1.789  -1.079
  176   2HB   TYR  24          1HB       TYR  24  -1.833   2.008  -2.799
  177    HD1  TYR  24           1HD      TYR  24  -3.743   1.297  -3.906
  178    HD2  TYR  24           2HD      TYR  24  -2.179  -1.099  -0.758
  179    HE1  TYR  24           1HE      TYR  24  -5.407  -0.442  -4.411
  180    HE2  TYR  24           2HE      TYR  24  -3.837  -2.845  -1.255
  181    HH   TYR  24           HH       TYR  24  -5.404  -3.180  -3.952
  182    H    LEU  25           H        LEU  25   0.818   1.851  -3.724
  183    HA   LEU  25           HA       LEU  25   0.468  -0.234  -5.668
  184   1HB   LEU  25          2HB       LEU  25   1.838   2.418  -5.594
  185   2HB   LEU  25          1HB       LEU  25   2.295   1.280  -6.846
  186    HG   LEU  25           HG       LEU  25  -0.576   2.058  -6.408
  187   1HD1  LEU  25          1HD1      LEU  25   0.663   4.119  -6.755
  188   2HD1  LEU  25          2HD1      LEU  25  -0.300   3.725  -8.180
  189   3HD1  LEU  25          3HD1      LEU  25   1.440   3.430  -8.181
  190   1HD2  LEU  25          1HD2      LEU  25  -0.311   1.577  -9.026
  191   2HD2  LEU  25          2HD2      LEU  25  -0.671   0.313  -7.850
  192   3HD2  LEU  25          3HD2      LEU  25   0.984   0.546  -8.414
  193    H    ALA  26           H        ALA  26   3.103   1.002  -3.680
  194    HA   ALA  26           HA       ALA  26   5.136  -0.658  -4.661
  195   1HB   ALA  26          1HB       ALA  26   5.146   1.408  -3.000
  196   2HB   ALA  26          2HB       ALA  26   6.444   0.213  -3.011
  197   3HB   ALA  26          3HB       ALA  26   5.168   0.120  -1.797
  198    H    HIS  27           H        HIS  27   2.566  -1.208  -2.350
  199    HA   HIS  27           HA       HIS  27   3.683  -3.590  -1.232
  200   1HB   HIS  27          2HB       HIS  27   2.090  -2.456   0.112
  201   2HB   HIS  27          1HB       HIS  27   0.914  -2.394  -1.197
  202    HD1  HIS  27           1HD      HIS  27   2.450  -4.877   1.228
  203    HD2  HIS  27           2HD      HIS  27  -0.783  -4.513  -1.353
  204    HE1  HIS  27           1HE      HIS  27   0.987  -6.901   1.629
  205    H    LYS  28           H        LYS  28   1.431  -2.891  -3.858
  206    HA   LYS  28           HA       LYS  28   0.777  -5.627  -4.354
  207   1HB   LYS  28          2HB       LYS  28  -0.506  -3.450  -5.015
  208   2HB   LYS  28          1HB       LYS  28   0.536  -3.479  -6.430
  209   1HG   LYS  28          2HG       LYS  28  -0.844  -6.002  -5.783
  210   2HG   LYS  28          1HG       LYS  28  -1.860  -4.666  -6.329
  211   1HD   LYS  28          2HD       LYS  28   0.631  -5.317  -7.837
  212   2HD   LYS  28          1HD       LYS  28  -0.798  -6.328  -8.056
  213   1HE   LYS  28          2HE       LYS  28  -1.893  -3.865  -8.262
  214   2HE   LYS  28          1HE       LYS  28  -0.283  -3.558  -8.912
  215   1HZ   LYS  28          1HZ       LYS  28  -2.390  -5.335  -9.938
  216   2HZ   LYS  28          2HZ       LYS  28  -0.771  -5.679 -10.287
  217   3HZ   LYS  28          3HZ       LYS  28  -1.444  -4.204 -10.768
  218    H    GLN  29           H        GLN  29   3.179  -3.379  -5.571
  219    HA   GLN  29           HA       GLN  29   4.079  -5.210  -7.625
  220   1HB   GLN  29          2HB       GLN  29   4.118  -2.532  -7.501
  221   2HB   GLN  29          1HB       GLN  29   5.725  -2.860  -6.867
  222   1HG   GLN  29          2HG       GLN  29   5.679  -4.477  -9.043
  223   2HG   GLN  29          1HG       GLN  29   4.673  -3.135  -9.586
  224   1HE2  GLN  29          1HE2      GLN  29   5.892  -1.049  -8.231
  225   2HE2  GLN  29          2HE2      GLN  29   7.478  -0.812  -8.874
  226    H    PHE  30           H        PHE  30   4.778  -4.600  -4.318
  227    HA   PHE  30           HA       PHE  30   7.353  -6.001  -4.537
  228   1HB   PHE  30          2HB       PHE  30   7.311  -3.780  -3.387
  229   2HB   PHE  30          1HB       PHE  30   6.257  -4.482  -2.163
  230    HD1  PHE  30           1HD      PHE  30   9.620  -3.936  -3.189
  231    HD2  PHE  30           2HD      PHE  30   7.139  -6.493  -0.860
  232    HE1  PHE  30           1HE      PHE  30  11.594  -4.706  -1.936
  233    HE2  PHE  30           2HE      PHE  30   9.108  -7.266   0.396
  234    HZ   PHE  30           HZ       PHE  30  11.338  -6.372  -0.141
  235    H    TYR  31           H        TYR  31   4.423  -5.932  -2.501
  236    HA   TYR  31           HA       TYR  31   5.059  -8.416  -1.231
  237   1HB   TYR  31          2HB       TYR  31   3.493  -6.385  -0.493
  238   2HB   TYR  31          1HB       TYR  31   2.263  -7.396  -1.243
  239    HD1  TYR  31           1HD      TYR  31   4.930  -7.422   1.346
  240    HD2  TYR  31           2HD      TYR  31   1.340  -9.208  -0.077
  241    HE1  TYR  31           1HE      TYR  31   4.788  -8.762   3.403
  242    HE2  TYR  31           2HE      TYR  31   1.187 -10.552   1.977
  243    HH   TYR  31           HH       TYR  31   2.741  -9.911   4.715
  244    H    HIS  32           H        HIS  32   2.638  -7.442  -3.654
  245    HA   HIS  32           HA       HIS  32   2.057 -10.258  -4.182
  246   1HB   HIS  32          2HB       HIS  32   0.724  -7.743  -5.205
  247   2HB   HIS  32          1HB       HIS  32   0.200  -9.383  -5.567
  248    HD1  HIS  32           1HD      HIS  32  -1.282 -10.530  -3.836
  249    HD2  HIS  32           2HD      HIS  32   0.362  -6.960  -2.490
  250    HE1  HIS  32           1HE      HIS  32  -2.431  -9.998  -1.644
  251    H    LYS  33           H        LYS  33   4.603  -9.478  -4.945
  252    HA   LYS  33           HA       LYS  33   4.642 -10.277  -7.657
  253   1HB   LYS  33          2HB       LYS  33   4.768  -7.373  -7.074
  254   2HB   LYS  33          1HB       LYS  33   5.942  -7.986  -8.231
  255   1HG   LYS  33          2HG       LYS  33   3.716  -9.138  -9.191
  256   2HG   LYS  33          1HG       LYS  33   3.021  -7.684  -8.469
  257   1HD   LYS  33          2HD       LYS  33   5.432  -7.074  -9.946
  258   2HD   LYS  33          1HD       LYS  33   4.253  -7.905 -10.963
  259   1HE   LYS  33          2HE       LYS  33   3.116  -5.805  -9.264
  260   2HE   LYS  33          1HE       LYS  33   4.281  -5.223 -10.453
  261   1HZ   LYS  33          1HZ       LYS  33   1.941  -5.280 -11.241
  262   2HZ   LYS  33          2HZ       LYS  33   1.978  -6.968 -11.128
  263   3HZ   LYS  33          3HZ       LYS  33   3.009  -6.170 -12.206
  264    H    ASN  34           H        ASN  34   5.834 -11.259  -5.392
  265    HA   ASN  34           HA       ASN  34   8.552 -11.415  -6.193
  266   1HB   ASN  34          2HB       ASN  34   8.556  -9.203  -5.015
  267   2HB   ASN  34          1HB       ASN  34   8.070 -10.038  -3.542
  268   1HD2  ASN  34          1HD2      ASN  34   9.631 -10.654  -2.238
  269   2HD2  ASN  34          2HD2      ASN  34  11.289 -10.874  -2.668
  270    H    LYS  35           H        LYS  35   6.730 -13.371  -5.923
  271    HA   LYS  35           HA       LYS  35   6.405 -15.435  -5.028
  272   1HB   LYS  35          2HB       LYS  35   8.860 -15.558  -5.101
  273   2HB   LYS  35          1HB       LYS  35   8.945 -14.815  -3.510
  274   1HG   LYS  35          2HG       LYS  35   7.376 -16.876  -2.903
  275   2HG   LYS  35          1HG       LYS  35   8.226 -17.577  -4.282
  276   1HD   LYS  35          2HD       LYS  35   9.761 -18.139  -2.729
  277   2HD   LYS  35          1HD       LYS  35  10.292 -16.468  -2.933
  278   1HE   LYS  35          2HE       LYS  35  10.026 -17.101  -0.564
  279   2HE   LYS  35          1HE       LYS  35   8.965 -15.774  -1.037
  280   1HZ   LYS  35          1HZ       LYS  35   7.850 -18.447  -1.279
  281   2HZ   LYS  35          2HZ       LYS  35   7.129 -17.017  -0.732
  282   3HZ   LYS  35          3HZ       LYS  35   8.130 -17.907   0.301
  283    HA   PRO  36           HA       PRO  36   4.453 -13.537  -1.284
  284   1HB   PRO  36          2HB       PRO  36   1.962 -14.479  -1.799
  285   2HB   PRO  36          1HB       PRO  36   2.578 -12.974  -2.490
  286   1HG   PRO  36          2HG       PRO  36   2.403 -15.695  -3.727
  287   2HG   PRO  36          1HG       PRO  36   2.014 -14.116  -4.436
  288   1HD   PRO  36          2HD       PRO  36   4.344 -15.402  -4.933
  289   2HD   PRO  36          1HD       PRO  36   4.222 -13.632  -4.883
  Start of MODEL   18
    1   1H    GLY   1          1HT       GLY   1 -10.044  -7.460  -8.699
    2   2H    GLY   1          2HT       GLY   1 -11.410  -6.493  -8.453
    3   3H    GLY   1          3HT       GLY   1 -10.595  -6.443  -9.934
    4   1HA   GLY   1          1HA       GLY   1 -11.641  -9.023  -9.034
    5   2HA   GLY   1          2HA       GLY   1 -12.789  -7.834  -9.628
    6    H    SER   2           H        SER   2 -13.356  -8.799 -11.521
    7    HA   SER   2           HA       SER   2 -11.215  -9.496 -13.404
    8   1HB   SER   2          2HB       SER   2 -12.802 -11.286 -13.035
    9   2HB   SER   2          1HB       SER   2 -14.156 -10.211 -13.386
   10    HG   SER   2           HG       SER   2 -13.748 -11.350 -15.235
   11    H    ALA   3           H        ALA   3 -11.933  -6.749 -12.857
   12    HA   ALA   3           HA       ALA   3 -12.198  -5.832 -15.546
   13   1HB   ALA   3          1HB       ALA   3 -14.292  -4.859 -15.556
   14   2HB   ALA   3          2HB       ALA   3 -14.415  -4.858 -13.796
   15   3HB   ALA   3          3HB       ALA   3 -14.595  -6.367 -14.692
   16    H    ALA   4           H        ALA   4 -10.361  -5.567 -13.336
   17    HA   ALA   4           HA       ALA   4  -9.046  -3.991 -12.353
   18   1HB   ALA   4          1HB       ALA   4  -8.574  -2.173 -13.611
   19   2HB   ALA   4          2HB       ALA   4 -10.270  -1.727 -13.799
   20   3HB   ALA   4          3HB       ALA   4  -9.580  -3.011 -14.793
   21    H    GLU   5           H        GLU   5  -9.041  -2.270 -10.794
   22    HA   GLU   5           HA       GLU   5 -11.052  -0.663  -9.936
   23   1HB   GLU   5          2HB       GLU   5 -11.646  -3.462  -9.311
   24   2HB   GLU   5          1HB       GLU   5 -11.682  -2.419  -7.897
   25   1HG   GLU   5          2HG       GLU   5 -13.106  -1.506 -10.333
   26   2HG   GLU   5          1HG       GLU   5 -13.813  -2.823  -9.396
   27    H    VAL   6           H        VAL   6  -8.651  -0.032  -9.756
   28    HA   VAL   6           HA       VAL   6  -7.212  -0.929  -7.454
   29    HB   VAL   6           HB       VAL   6  -6.739   1.609  -9.017
   30   1HG1  VAL   6          1HG1      VAL   6  -5.171   0.023  -7.037
   31   2HG1  VAL   6          2HG1      VAL   6  -5.379   1.770  -7.170
   32   3HG1  VAL   6          3HG1      VAL   6  -4.321   0.919  -8.296
   33   1HG2  VAL   6          1HG2      VAL   6  -6.150  -1.232  -9.665
   34   2HG2  VAL   6          2HG2      VAL   6  -4.945  -0.014 -10.082
   35   3HG2  VAL   6          3HG2      VAL   6  -6.580   0.106 -10.731
   36    H    MET   7           H        MET   7  -7.748  -0.444  -5.438
   37    HA   MET   7           HA       MET   7  -9.483   1.740  -4.791
   38   1HB   MET   7          2HB       MET   7  -7.883   0.008  -2.901
   39   2HB   MET   7          1HB       MET   7  -9.293   0.980  -2.504
   40   1HG   MET   7          2HG       MET   7 -10.743  -0.538  -3.317
   41   2HG   MET   7          1HG       MET   7  -9.665  -1.033  -4.622
   42   1HE   MET   7          1HE       MET   7  -9.123  -3.987  -4.276
   43   2HE   MET   7          2HE       MET   7  -7.577  -3.723  -3.469
   44   3HE   MET   7          3HE       MET   7  -8.135  -2.589  -4.698
   45    H    LYS   8           H        LYS   8  -8.833   3.173  -2.849
   46    HA   LYS   8           HA       LYS   8  -6.845   4.942  -3.675
   47   1HB   LYS   8          2HB       LYS   8  -8.746   5.455  -2.118
   48   2HB   LYS   8          1HB       LYS   8  -7.862   4.621  -0.847
   49   1HG   LYS   8          2HG       LYS   8  -6.360   6.304  -0.595
   50   2HG   LYS   8          1HG       LYS   8  -6.443   6.784  -2.290
   51   1HD   LYS   8          2HD       LYS   8  -8.898   7.170  -0.691
   52   2HD   LYS   8          1HD       LYS   8  -7.528   8.208  -0.287
   53   1HE   LYS   8          2HE       LYS   8  -8.981   9.257  -1.948
   54   2HE   LYS   8          1HE       LYS   8  -7.379   8.933  -2.609
   55   1HZ   LYS   8          1HZ       LYS   8  -9.188   8.349  -4.142
   56   2HZ   LYS   8          2HZ       LYS   8  -9.760   7.209  -3.031
   57   3HZ   LYS   8          3HZ       LYS   8  -8.236   7.009  -3.737
   58    H    LYS   9           H        LYS   9  -6.712   2.951  -0.713
   59    HA   LYS   9           HA       LYS   9  -4.094   1.984  -1.247
   60   1HB   LYS   9          2HB       LYS   9  -3.380   3.277   1.050
   61   2HB   LYS   9          1HB       LYS   9  -2.932   3.785  -0.569
   62   1HG   LYS   9          2HG       LYS   9  -3.784   5.630   0.793
   63   2HG   LYS   9          1HG       LYS   9  -4.784   5.336  -0.628
   64   1HD   LYS   9          2HD       LYS   9  -6.531   4.479   0.615
   65   2HD   LYS   9          1HD       LYS   9  -5.483   4.010   1.955
   66   1HE   LYS   9          2HE       LYS   9  -5.560   6.064   2.912
   67   2HE   LYS   9          1HE       LYS   9  -5.651   6.900   1.361
   68   1HZ   LYS   9          1HZ       LYS   9  -7.908   6.719   1.292
   69   2HZ   LYS   9          2HZ       LYS   9  -7.697   6.801   2.968
   70   3HZ   LYS   9          3HZ       LYS   9  -7.955   5.306   2.220
   71    H    TYR  10           H        TYR  10  -5.787   0.273  -0.770
   72    HA   TYR  10           HA       TYR  10  -5.335  -0.680   1.920
   73   1HB   TYR  10          2HB       TYR  10  -7.437   0.756   2.004
   74   2HB   TYR  10          1HB       TYR  10  -8.190  -0.447   0.965
   75    HD1  TYR  10           1HD      TYR  10  -7.748   0.551   4.277
   76    HD2  TYR  10           2HD      TYR  10  -7.920  -2.949   1.864
   77    HE1  TYR  10           1HE      TYR  10  -8.335  -0.781   6.260
   78    HE2  TYR  10           2HE      TYR  10  -8.509  -4.290   3.840
   79    HH   TYR  10           HH       TYR  10  -8.167  -3.178   6.985
   80    H    CYS  11           H        CYS  11  -4.907  -2.794   1.795
   81    HA   CYS  11           HA       CYS  11  -5.474  -4.190  -0.678
   82   1HB   CYS  11          2HB       CYS  11  -3.276  -4.356   0.592
   83   2HB   CYS  11          1HB       CYS  11  -4.133  -5.357   1.758
   84    H    SER  12           H        SER  12  -7.115  -5.484  -1.029
   85    HA   SER  12           HA       SER  12  -8.968  -6.104   1.111
   86   1HB   SER  12          2HB       SER  12  -9.218  -6.884  -1.795
   87   2HB   SER  12          1HB       SER  12 -10.506  -6.741  -0.598
   88    HG   SER  12           HG       SER  12  -9.938  -4.460  -0.510
   89    H    THR  13           H        THR  13  -6.254  -7.455   0.749
   90    HA   THR  13           HA       THR  13  -7.261 -10.189   0.997
   91    HB   THR  13           HB       THR  13  -4.754  -9.390  -0.488
   92    HG1  THR  13           1HG      THR  13  -7.207 -10.449  -1.440
   93   1HG2  THR  13          1HG2      THR  13  -5.996 -12.119  -0.367
   94   2HG2  THR  13          2HG2      THR  13  -4.677 -11.610   0.688
   95   3HG2  THR  13          3HG2      THR  13  -4.443 -11.652  -1.059
   96    H    CYS  14           H        CYS  14  -4.786  -7.814   1.767
   97    HA   CYS  14           HA       CYS  14  -3.738  -9.589   3.858
   98   1HB   CYS  14          2HB       CYS  14  -2.630  -6.962   2.850
   99   2HB   CYS  14          1HB       CYS  14  -1.853  -8.039   4.004
  100    H    ASP  15           H        ASP  15  -6.098  -7.331   3.577
  101    HA   ASP  15           HA       ASP  15  -7.212  -5.961   5.000
  102   1HB   ASP  15          2HB       ASP  15  -5.910  -7.790   7.023
  103   2HB   ASP  15          1HB       ASP  15  -7.218  -6.670   7.380
  104    H    ILE  16           H        ILE  16  -4.782  -4.956   4.090
  105    HA   ILE  16           HA       ILE  16  -3.800  -3.457   6.431
  106    HB   ILE  16           HB       ILE  16  -2.258  -3.742   3.868
  107   1HG1  ILE  16          2HG1      ILE  16  -2.724  -6.011   4.712
  108   2HG1  ILE  16          1HG1      ILE  16  -1.020  -5.599   4.864
  109   1HG2  ILE  16          1HG2      ILE  16  -0.370  -3.431   5.603
  110   2HG2  ILE  16          2HG2      ILE  16  -1.659  -2.869   6.667
  111   3HG2  ILE  16          3HG2      ILE  16  -1.344  -2.035   5.144
  112   1HD1  ILE  16          1HD1      ILE  16  -1.659  -6.717   6.847
  113   2HD1  ILE  16          2HD1      ILE  16  -3.087  -5.700   7.040
  114   3HD1  ILE  16          3HD1      ILE  16  -1.478  -5.011   7.256
  115    H    SER  17           H        SER  17  -3.082  -1.235   5.961
  116    HA   SER  17           HA       SER  17  -4.496  -0.016   3.694
  117   1HB   SER  17          2HB       SER  17  -4.777   1.930   5.556
  118   2HB   SER  17          1HB       SER  17  -6.007   0.706   5.241
  119    HG   SER  17           HG       SER  17  -5.512  -0.289   7.067
  120    H    PHE  18           H        PHE  18  -3.676   2.113   3.104
  121    HA   PHE  18           HA       PHE  18  -0.977   2.678   4.081
  122   1HB   PHE  18          2HB       PHE  18  -1.829   2.453   1.190
  123   2HB   PHE  18          1HB       PHE  18  -0.299   3.131   1.716
  124    HD1  PHE  18           1HD      PHE  18   1.234   1.608   3.114
  125    HD2  PHE  18           2HD      PHE  18  -2.049   0.185   0.809
  126    HE1  PHE  18           1HE      PHE  18   2.212  -0.650   3.120
  127    HE2  PHE  18           2HE      PHE  18  -1.078  -2.075   0.813
  128    HZ   PHE  18           HZ       PHE  18   1.053  -2.496   1.969
  129    H    ASN  19           H        ASN  19  -0.559   4.787   4.384
  130    HA   ASN  19           HA       ASN  19  -2.696   6.668   4.190
  131   1HB   ASN  19          2HB       ASN  19  -0.950   8.265   5.046
  132   2HB   ASN  19          1HB       ASN  19  -1.207   6.848   6.053
  133   1HD2  ASN  19          1HD2      ASN  19   0.996   8.598   4.094
  134   2HD2  ASN  19          2HD2      ASN  19   2.377   7.594   4.362
  135    H    TYR  20           H        TYR  20  -0.131   5.717   2.124
  136    HA   TYR  20           HA       TYR  20  -0.694   8.011   0.368
  137   1HB   TYR  20          2HB       TYR  20   1.915   6.790   1.157
  138   2HB   TYR  20          1HB       TYR  20   1.750   7.448  -0.468
  139    HD1  TYR  20           1HD      TYR  20   0.172   9.833  -0.133
  140    HD2  TYR  20           2HD      TYR  20   3.192   8.250   2.413
  141    HE1  TYR  20           1HE      TYR  20   0.618  12.091   0.734
  142    HE2  TYR  20           2HE      TYR  20   3.645  10.504   3.286
  143    HH   TYR  20           HH       TYR  20   1.583  13.113   2.804
  144    H    VAL  21           H        VAL  21  -1.351   7.523  -1.629
  145    HA   VAL  21           HA       VAL  21  -2.083   4.965  -2.406
  146    HB   VAL  21           HB       VAL  21  -1.363   7.184  -4.323
  147   1HG1  VAL  21          1HG1      VAL  21  -3.003   4.691  -4.492
  148   2HG1  VAL  21          2HG1      VAL  21  -1.806   5.326  -5.622
  149   3HG1  VAL  21          3HG1      VAL  21  -3.398   6.078  -5.508
  150   1HG2  VAL  21          1HG2      VAL  21  -2.843   8.362  -3.073
  151   2HG2  VAL  21          2HG2      VAL  21  -3.605   6.915  -2.413
  152   3HG2  VAL  21          3HG2      VAL  21  -4.010   7.460  -4.040
  153    H    LYS  22           H        LYS  22   0.969   6.614  -2.740
  154    HA   LYS  22           HA       LYS  22   2.125   4.949  -4.707
  155   1HB   LYS  22          2HB       LYS  22   3.052   7.146  -4.098
  156   2HB   LYS  22          1HB       LYS  22   3.472   6.527  -2.507
  157   1HG   LYS  22          2HG       LYS  22   5.430   6.578  -3.903
  158   2HG   LYS  22          1HG       LYS  22   4.989   4.902  -3.565
  159   1HD   LYS  22          2HD       LYS  22   4.291   4.510  -5.726
  160   2HD   LYS  22          1HD       LYS  22   3.946   6.212  -6.035
  161   1HE   LYS  22          2HE       LYS  22   6.084   6.678  -6.623
  162   2HE   LYS  22          1HE       LYS  22   6.764   5.522  -5.478
  163   1HZ   LYS  22          1HZ       LYS  22   5.797   5.073  -8.216
  164   2HZ   LYS  22          2HZ       LYS  22   5.737   3.800  -7.105
  165   3HZ   LYS  22          3HZ       LYS  22   7.218   4.529  -7.478
  166    H    THR  23           H        THR  23   1.817   4.688  -1.223
  167    HA   THR  23           HA       THR  23   3.647   2.528  -0.939
  168    HB   THR  23           HB       THR  23   1.425   2.749   0.999
  169    HG1  THR  23           1HG      THR  23   2.002   4.721   1.738
  170   1HG2  THR  23          1HG2      THR  23   3.233   2.776   2.632
  171   2HG2  THR  23          2HG2      THR  23   4.413   2.812   1.321
  172   3HG2  THR  23          3HG2      THR  23   3.370   1.405   1.530
  173    H    TYR  24           H        TYR  24   0.160   2.763  -1.401
  174    HA   TYR  24           HA       TYR  24  -0.448   0.034  -1.108
  175   1HB   TYR  24          2HB       TYR  24  -2.167   1.784  -1.150
  176   2HB   TYR  24          1HB       TYR  24  -1.802   2.113  -2.837
  177    HD1  TYR  24           1HD      TYR  24  -3.577   1.437  -4.154
  178    HD2  TYR  24           2HD      TYR  24  -2.346  -1.061  -0.938
  179    HE1  TYR  24           1HE      TYR  24  -5.227  -0.252  -4.842
  180    HE2  TYR  24           2HE      TYR  24  -3.991  -2.758  -1.617
  181    HH   TYR  24           HH       TYR  24  -5.194  -3.240  -4.164
  182    H    LEU  25           H        LEU  25   0.850   1.910  -3.731
  183    HA   LEU  25           HA       LEU  25   0.528  -0.127  -5.729
  184   1HB   LEU  25          2HB       LEU  25   1.878   2.524  -5.559
  185   2HB   LEU  25          1HB       LEU  25   2.421   1.412  -6.802
  186    HG   LEU  25           HG       LEU  25  -0.447   2.289  -6.478
  187   1HD1  LEU  25          1HD1      LEU  25   0.852   4.229  -7.030
  188   2HD1  LEU  25          2HD1      LEU  25   0.000   3.691  -8.477
  189   3HD1  LEU  25          3HD1      LEU  25   1.719   3.345  -8.286
  190   1HD2  LEU  25          1HD2      LEU  25  -0.329   1.508  -8.979
  191   2HD2  LEU  25          2HD2      LEU  25  -0.565   0.339  -7.680
  192   3HD2  LEU  25          3HD2      LEU  25   1.033   0.553  -8.395
  193    H    ALA  26           H        ALA  26   3.127   1.031  -3.649
  194    HA   ALA  26           HA       ALA  26   5.155  -0.643  -4.634
  195   1HB   ALA  26          1HB       ALA  26   6.396  -0.050  -2.677
  196   2HB   ALA  26          2HB       ALA  26   4.926   0.435  -1.832
  197   3HB   ALA  26          3HB       ALA  26   5.500   1.373  -3.210
  198    H    HIS  27           H        HIS  27   2.551  -1.170  -2.359
  199    HA   HIS  27           HA       HIS  27   3.629  -3.551  -1.211
  200   1HB   HIS  27          2HB       HIS  27   1.987  -2.389   0.069
  201   2HB   HIS  27          1HB       HIS  27   0.844  -2.384  -1.271
  202    HD1  HIS  27           1HD      HIS  27   2.392  -4.796   1.224
  203    HD2  HIS  27           2HD      HIS  27  -0.817  -4.526  -1.398
  204    HE1  HIS  27           1HE      HIS  27   0.963  -6.841   1.635
  205    H    LYS  28           H        LYS  28   1.399  -2.875  -3.871
  206    HA   LYS  28           HA       LYS  28   0.830  -5.632  -4.384
  207   1HB   LYS  28          2HB       LYS  28  -0.402  -3.335  -5.076
  208   2HB   LYS  28          1HB       LYS  28   0.486  -3.651  -6.560
  209   1HG   LYS  28          2HG       LYS  28  -1.111  -5.846  -5.333
  210   2HG   LYS  28          1HG       LYS  28  -1.937  -4.568  -6.226
  211   1HD   LYS  28          2HD       LYS  28  -0.674  -5.046  -8.206
  212   2HD   LYS  28          1HD       LYS  28   0.361  -6.176  -7.330
  213   1HE   LYS  28          2HE       LYS  28  -1.396  -7.737  -7.075
  214   2HE   LYS  28          1HE       LYS  28  -2.611  -6.561  -7.575
  215   1HZ   LYS  28          1HZ       LYS  28  -1.902  -8.300  -9.261
  216   2HZ   LYS  28          2HZ       LYS  28  -0.457  -7.434  -9.402
  217   3HZ   LYS  28          3HZ       LYS  28  -1.928  -6.692  -9.787
  218    H    GLN  29           H        GLN  29   3.180  -3.309  -5.523
  219    HA   GLN  29           HA       GLN  29   4.118  -5.039  -7.645
  220   1HB   GLN  29          2HB       GLN  29   4.134  -2.348  -7.342
  221   2HB   GLN  29          1HB       GLN  29   5.769  -2.731  -6.824
  222   1HG   GLN  29          2HG       GLN  29   5.073  -4.131  -9.252
  223   2HG   GLN  29          1HG       GLN  29   4.872  -2.388  -9.425
  224   1HE2  GLN  29          1HE2      GLN  29   7.184  -4.634  -7.925
  225   2HE2  GLN  29          2HE2      GLN  29   8.599  -3.848  -8.529
  226    H    PHE  30           H        PHE  30   4.706  -4.713  -4.311
  227    HA   PHE  30           HA       PHE  30   7.305  -6.073  -4.592
  228   1HB   PHE  30          2HB       PHE  30   7.101  -3.769  -3.389
  229   2HB   PHE  30          1HB       PHE  30   6.437  -4.715  -2.061
  230    HD1  PHE  30           1HD      PHE  30   9.387  -4.534  -4.321
  231    HD2  PHE  30           2HD      PHE  30   7.859  -5.685  -0.519
  232    HE1  PHE  30           1HE      PHE  30  11.668  -5.070  -3.571
  233    HE2  PHE  30           2HE      PHE  30  10.137  -6.223   0.238
  234    HZ   PHE  30           HZ       PHE  30  12.046  -5.916  -1.288
  235    H    TYR  31           H        TYR  31   4.404  -5.927  -2.524
  236    HA   TYR  31           HA       TYR  31   5.015  -8.393  -1.210
  237   1HB   TYR  31          2HB       TYR  31   3.489  -6.337  -0.491
  238   2HB   TYR  31          1HB       TYR  31   2.235  -7.319  -1.239
  239    HD1  TYR  31           1HD      TYR  31   4.795  -7.275   1.432
  240    HD2  TYR  31           2HD      TYR  31   1.356  -9.225  -0.139
  241    HE1  TYR  31           1HE      TYR  31   4.609  -8.596   3.497
  242    HE2  TYR  31           2HE      TYR  31   1.159 -10.551   1.922
  243    HH   TYR  31           HH       TYR  31   2.497  -9.823   4.712
  244    H    HIS  32           H        HIS  32   2.710  -7.435  -3.736
  245    HA   HIS  32           HA       HIS  32   2.061 -10.259  -4.173
  246   1HB   HIS  32          2HB       HIS  32   0.736  -7.748  -5.214
  247   2HB   HIS  32          1HB       HIS  32   0.209  -9.387  -5.578
  248    HD1  HIS  32           1HD      HIS  32  -1.286 -10.527  -3.855
  249    HD2  HIS  32           2HD      HIS  32   0.377  -6.970  -2.494
  250    HE1  HIS  32           1HE      HIS  32  -2.437  -9.994  -1.663
  251    H    LYS  33           H        LYS  33   4.596  -9.601  -4.955
  252    HA   LYS  33           HA       LYS  33   4.413 -10.019  -7.828
  253   1HB   LYS  33          2HB       LYS  33   5.503  -7.590  -6.567
  254   2HB   LYS  33          1HB       LYS  33   6.547  -8.322  -7.777
  255   1HG   LYS  33          2HG       LYS  33   4.245  -8.361  -9.128
  256   2HG   LYS  33          1HG       LYS  33   3.941  -6.971  -8.084
  257   1HD   LYS  33          2HD       LYS  33   5.943  -5.883  -8.867
  258   2HD   LYS  33          1HD       LYS  33   6.399  -7.312  -9.799
  259   1HE   LYS  33          2HE       LYS  33   4.017  -5.523 -10.266
  260   2HE   LYS  33          1HE       LYS  33   5.454  -5.660 -11.278
  261   1HZ   LYS  33          1HZ       LYS  33   4.798  -8.090 -11.508
  262   2HZ   LYS  33          2HZ       LYS  33   3.853  -6.958 -12.336
  263   3HZ   LYS  33          3HZ       LYS  33   3.289  -7.634 -10.892
  264    H    ASN  34           H        ASN  34   4.947 -12.115  -6.607
  265    HA   ASN  34           HA       ASN  34   7.866 -12.429  -6.652
  266   1HB   ASN  34          2HB       ASN  34   5.984 -13.135  -4.449
  267   2HB   ASN  34          1HB       ASN  34   7.331 -14.223  -4.766
  268   1HD2  ASN  34          1HD2      ASN  34   9.392 -12.693  -5.337
  269   2HD2  ASN  34          2HD2      ASN  34   9.760 -11.598  -4.052
  270    H    LYS  35           H        LYS  35   5.870 -12.997  -8.657
  271    HA   LYS  35           HA       LYS  35   5.325 -14.618 -10.153
  272   1HB   LYS  35          2HB       LYS  35   7.896 -15.075  -9.576
  273   2HB   LYS  35          1HB       LYS  35   7.218 -16.577  -8.963
  274   1HG   LYS  35          2HG       LYS  35   6.858 -15.518 -11.758
  275   2HG   LYS  35          1HG       LYS  35   7.994 -16.779 -11.275
  276   1HD   LYS  35          2HD       LYS  35   6.330 -18.188 -11.813
  277   2HD   LYS  35          1HD       LYS  35   5.657 -17.729 -10.249
  278   1HE   LYS  35          2HE       LYS  35   4.443 -15.875 -11.430
  279   2HE   LYS  35          1HE       LYS  35   4.977 -16.586 -12.953
  280   1HZ   LYS  35          1HZ       LYS  35   3.539 -18.228 -10.973
  281   2HZ   LYS  35          2HZ       LYS  35   3.660 -18.439 -12.646
  282   3HZ   LYS  35          3HZ       LYS  35   2.679 -17.212 -12.019
  283    HA   PRO  36           HA       PRO  36   2.746 -16.768  -6.941
  284   1HB   PRO  36          2HB       PRO  36   0.355 -16.112  -8.039
  285   2HB   PRO  36          1HB       PRO  36   1.216 -15.052  -6.916
  286   1HG   PRO  36          2HG       PRO  36   1.095 -14.947  -9.906
  287   2HG   PRO  36          1HG       PRO  36   0.984 -13.620  -8.735
  288   1HD   PRO  36          2HD       PRO  36   3.263 -14.189 -10.086
  289   2HD   PRO  36          1HD       PRO  36   3.268 -13.520  -8.441
  Start of MODEL   19
    1   1H    GLY   1          1HT       GLY   1 -20.421   5.905 -15.263
    2   2H    GLY   1          2HT       GLY   1 -20.352   4.876 -16.603
    3   3H    GLY   1          3HT       GLY   1 -18.942   5.236 -15.741
    4   1HA   GLY   1          1HA       GLY   1 -21.197   3.969 -14.346
    5   2HA   GLY   1          2HA       GLY   1 -20.152   2.984 -15.359
    6    H    SER   2           H        SER   2 -17.882   2.889 -14.840
    7    HA   SER   2           HA       SER   2 -16.150   2.574 -13.401
    8   1HB   SER   2          2HB       SER   2 -16.115   5.005 -13.256
    9   2HB   SER   2          1HB       SER   2 -17.378   4.976 -12.025
   10    HG   SER   2           HG       SER   2 -15.943   4.462 -10.564
   11    H    ALA   3           H        ALA   3 -15.580   1.895 -11.184
   12    HA   ALA   3           HA       ALA   3 -17.835   0.476  -9.976
   13   1HB   ALA   3          1HB       ALA   3 -15.461  -0.497 -10.686
   14   2HB   ALA   3          2HB       ALA   3 -16.380  -1.143  -9.327
   15   3HB   ALA   3          3HB       ALA   3 -15.065  -0.003  -9.040
   16    H    ALA   4           H        ALA   4 -17.743   3.228  -9.481
   17    HA   ALA   4           HA       ALA   4 -17.977   4.706  -7.767
   18   1HB   ALA   4          1HB       ALA   4 -19.251   3.470  -6.376
   19   2HB   ALA   4          2HB       ALA   4 -17.791   3.456  -5.388
   20   3HB   ALA   4          3HB       ALA   4 -18.161   2.085  -6.433
   21    H    GLU   5           H        GLU   5 -15.825   2.449  -6.081
   22    HA   GLU   5           HA       GLU   5 -13.351   3.442  -6.587
   23   1HB   GLU   5          2HB       GLU   5 -14.916   5.353  -5.012
   24   2HB   GLU   5          1HB       GLU   5 -13.390   4.922  -4.252
   25   1HG   GLU   5          2HG       GLU   5 -12.156   5.978  -5.808
   26   2HG   GLU   5          1HG       GLU   5 -13.256   5.565  -7.121
   27    H    VAL   6           H        VAL   6 -13.758   1.047  -6.040
   28    HA   VAL   6           HA       VAL   6 -13.543   0.494  -3.182
   29    HB   VAL   6           HB       VAL   6 -15.098  -0.856  -4.553
   30   1HG1  VAL   6          1HG1      VAL   6 -14.305  -2.450  -6.159
   31   2HG1  VAL   6          2HG1      VAL   6 -12.628  -2.013  -5.832
   32   3HG1  VAL   6          3HG1      VAL   6 -13.703  -0.854  -6.612
   33   1HG2  VAL   6          1HG2      VAL   6 -13.063  -2.834  -3.734
   34   2HG2  VAL   6          2HG2      VAL   6 -14.765  -2.706  -3.292
   35   3HG2  VAL   6          3HG2      VAL   6 -13.570  -1.672  -2.509
   36    H    MET   7           H        MET   7 -11.339   1.827  -4.305
   37    HA   MET   7           HA       MET   7  -9.214   0.233  -3.402
   38   1HB   MET   7          2HB       MET   7  -8.000  -0.010  -5.594
   39   2HB   MET   7          1HB       MET   7  -9.403  -1.053  -5.401
   40   1HG   MET   7          2HG       MET   7  -9.923   1.537  -6.687
   41   2HG   MET   7          1HG       MET   7  -8.895   0.427  -7.593
   42   1HE   MET   7          1HE       MET   7 -10.821  -2.113  -8.999
   43   2HE   MET   7          2HE       MET   7 -10.500  -2.710  -7.369
   44   3HE   MET   7          3HE       MET   7  -9.303  -1.713  -8.195
   45    H    LYS   8           H        LYS   8  -7.849   1.673  -2.600
   46    HA   LYS   8           HA       LYS   8  -7.045   3.980  -4.163
   47   1HB   LYS   8          2HB       LYS   8  -9.021   4.819  -2.996
   48   2HB   LYS   8          1HB       LYS   8  -8.360   4.285  -1.457
   49   1HG   LYS   8          2HG       LYS   8  -6.510   5.869  -1.704
   50   2HG   LYS   8          1HG       LYS   8  -7.186   6.409  -3.242
   51   1HD   LYS   8          2HD       LYS   8  -9.037   6.452  -0.949
   52   2HD   LYS   8          1HD       LYS   8  -7.694   7.592  -0.865
   53   1HE   LYS   8          2HE       LYS   8  -9.733   8.528  -1.930
   54   2HE   LYS   8          1HE       LYS   8  -8.309   8.563  -2.970
   55   1HZ   LYS   8          1HZ       LYS   8  -9.112   6.728  -4.201
   56   2HZ   LYS   8          2HZ       LYS   8 -10.410   7.803  -4.057
   57   3HZ   LYS   8          3HZ       LYS   8 -10.351   6.417  -3.090
   58    H    LYS   9           H        LYS   9  -6.853   2.356  -1.008
   59    HA   LYS   9           HA       LYS   9  -4.041   2.056  -1.156
   60   1HB   LYS   9          2HB       LYS   9  -3.605   3.525   0.901
   61   2HB   LYS   9          1HB       LYS   9  -3.772   4.326  -0.653
   62   1HG   LYS   9          2HG       LYS   9  -4.963   5.572   1.015
   63   2HG   LYS   9          1HG       LYS   9  -6.123   4.837  -0.092
   64   1HD   LYS   9          2HD       LYS   9  -6.683   3.147   1.487
   65   2HD   LYS   9          1HD       LYS   9  -5.343   3.602   2.541
   66   1HE   LYS   9          2HE       LYS   9  -7.273   5.741   1.918
   67   2HE   LYS   9          1HE       LYS   9  -7.890   4.415   2.903
   68   1HZ   LYS   9          1HZ       LYS   9  -6.693   6.487   3.963
   69   2HZ   LYS   9          2HZ       LYS   9  -5.308   5.570   3.643
   70   3HZ   LYS   9          3HZ       LYS   9  -6.530   4.939   4.626
   71    H    TYR  10           H        TYR  10  -6.095   0.293  -0.691
   72    HA   TYR  10           HA       TYR  10  -5.373  -0.696   1.952
   73   1HB   TYR  10          2HB       TYR  10  -7.507   0.675   2.152
   74   2HB   TYR  10          1HB       TYR  10  -8.280  -0.544   1.145
   75    HD1  TYR  10           1HD      TYR  10  -7.716   0.454   4.433
   76    HD2  TYR  10           2HD      TYR  10  -7.879  -3.045   2.019
   77    HE1  TYR  10           1HE      TYR  10  -8.165  -0.901   6.437
   78    HE2  TYR  10           2HE      TYR  10  -8.331  -4.409   4.015
   79    HH   TYR  10           HH       TYR  10  -9.144  -3.032   7.037
   80    H    CYS  11           H        CYS  11  -4.936  -2.812   1.837
   81    HA   CYS  11           HA       CYS  11  -5.549  -4.218  -0.620
   82   1HB   CYS  11          2HB       CYS  11  -3.314  -4.354   0.590
   83   2HB   CYS  11          1HB       CYS  11  -4.124  -5.369   1.776
   84    H    SER  12           H        SER  12  -7.195  -5.516  -0.925
   85    HA   SER  12           HA       SER  12  -8.968  -6.173   1.271
   86   1HB   SER  12          2HB       SER  12 -10.188  -7.313  -0.815
   87   2HB   SER  12          1HB       SER  12 -10.294  -5.581  -0.501
   88    HG   SER  12           HG       SER  12  -9.231  -5.225  -2.273
   89    H    THR  13           H        THR  13  -6.256  -7.491   0.815
   90    HA   THR  13           HA       THR  13  -7.224 -10.238   1.061
   91    HB   THR  13           HB       THR  13  -4.769  -9.395  -0.484
   92    HG1  THR  13           1HG      THR  13  -6.668  -8.992  -1.640
   93   1HG2  THR  13          1HG2      THR  13  -5.255 -11.931  -1.246
   94   2HG2  THR  13          2HG2      THR  13  -5.715 -12.007   0.455
   95   3HG2  THR  13          3HG2      THR  13  -4.096 -11.473   0.002
   96    H    CYS  14           H        CYS  14  -4.758  -7.840   1.790
   97    HA   CYS  14           HA       CYS  14  -3.637  -9.627   3.835
   98   1HB   CYS  14          2HB       CYS  14  -2.568  -6.990   2.814
   99   2HB   CYS  14          1HB       CYS  14  -1.755  -8.074   3.934
  100    H    ASP  15           H        ASP  15  -6.021  -7.392   3.643
  101    HA   ASP  15           HA       ASP  15  -7.106  -6.041   5.106
  102   1HB   ASP  15          2HB       ASP  15  -5.721  -7.864   7.080
  103   2HB   ASP  15          1HB       ASP  15  -7.039  -6.768   7.477
  104    H    ILE  16           H        ILE  16  -4.745  -4.964   4.132
  105    HA   ILE  16           HA       ILE  16  -3.716  -3.480   6.464
  106    HB   ILE  16           HB       ILE  16  -2.225  -3.724   3.867
  107   1HG1  ILE  16          2HG1      ILE  16  -2.648  -6.006   4.718
  108   2HG1  ILE  16          1HG1      ILE  16  -0.946  -5.574   4.810
  109   1HG2  ILE  16          1HG2      ILE  16  -1.538  -2.919   6.673
  110   2HG2  ILE  16          2HG2      ILE  16  -1.364  -1.992   5.183
  111   3HG2  ILE  16          3HG2      ILE  16  -0.296  -3.360   5.502
  112   1HD1  ILE  16          1HD1      ILE  16  -2.877  -5.469   7.113
  113   2HD1  ILE  16          2HD1      ILE  16  -1.140  -5.165   7.177
  114   3HD1  ILE  16          3HD1      ILE  16  -1.741  -6.779   6.794
  115    H    SER  17           H        SER  17  -3.042  -1.240   5.985
  116    HA   SER  17           HA       SER  17  -4.565  -0.041   3.775
  117   1HB   SER  17          2HB       SER  17  -4.768   1.913   5.630
  118   2HB   SER  17          1HB       SER  17  -5.993   0.666   5.407
  119    HG   SER  17           HG       SER  17  -3.827   0.481   7.231
  120    H    PHE  18           H        PHE  18  -3.829   2.146   3.205
  121    HA   PHE  18           HA       PHE  18  -1.082   2.743   4.000
  122   1HB   PHE  18          2HB       PHE  18  -2.087   2.449   1.165
  123   2HB   PHE  18          1HB       PHE  18  -0.549   3.185   1.587
  124    HD1  PHE  18           1HD      PHE  18   1.030   1.703   3.064
  125    HD2  PHE  18           2HD      PHE  18  -2.175   0.204   0.700
  126    HE1  PHE  18           1HE      PHE  18   2.079  -0.523   3.060
  127    HE2  PHE  18           2HE      PHE  18  -1.133  -2.024   0.691
  128    HZ   PHE  18           HZ       PHE  18   0.996  -2.391   1.873
  129    H    ASN  19           H        ASN  19  -0.659   4.874   4.194
  130    HA   ASN  19           HA       ASN  19  -2.892   6.708   3.834
  131   1HB   ASN  19          2HB       ASN  19  -0.377   6.709   5.420
  132   2HB   ASN  19          1HB       ASN  19  -1.005   8.275   4.917
  133   1HD2  ASN  19          1HD2      ASN  19  -2.664   5.300   5.877
  134   2HD2  ASN  19          2HD2      ASN  19  -3.533   6.004   7.193
  135    H    TYR  20           H        TYR  20  -0.856   5.600   1.708
  136    HA   TYR  20           HA       TYR  20  -0.818   8.040   0.170
  137   1HB   TYR  20          2HB       TYR  20   1.692   6.731   1.171
  138   2HB   TYR  20          1HB       TYR  20   1.688   7.593  -0.364
  139    HD1  TYR  20           1HD      TYR  20   0.512  10.014  -0.184
  140    HD2  TYR  20           2HD      TYR  20   2.366   7.919   3.022
  141    HE1  TYR  20           1HE      TYR  20   0.844  12.141   1.005
  142    HE2  TYR  20           2HE      TYR  20   2.702  10.041   4.221
  143    HH   TYR  20           HH       TYR  20   2.844  12.406   3.772
  144    H    VAL  21           H        VAL  21  -1.373   7.538  -1.842
  145    HA   VAL  21           HA       VAL  21  -1.943   5.011  -2.762
  146    HB   VAL  21           HB       VAL  21  -1.031   7.269  -4.545
  147   1HG1  VAL  21          1HG1      VAL  21  -1.285   5.306  -5.824
  148   2HG1  VAL  21          2HG1      VAL  21  -2.775   6.221  -6.063
  149   3HG1  VAL  21          3HG1      VAL  21  -2.754   4.841  -4.965
  150   1HG2  VAL  21          1HG2      VAL  21  -3.161   7.278  -2.690
  151   2HG2  VAL  21          2HG2      VAL  21  -3.873   7.122  -4.295
  152   3HG2  VAL  21          3HG2      VAL  21  -2.795   8.472  -3.936
  153    H    LYS  22           H        LYS  22   1.120   6.676  -2.747
  154    HA   LYS  22           HA       LYS  22   2.484   5.039  -4.602
  155   1HB   LYS  22          2HB       LYS  22   3.110   7.329  -3.334
  156   2HB   LYS  22          1HB       LYS  22   4.010   6.194  -2.337
  157   1HG   LYS  22          2HG       LYS  22   4.270   6.520  -5.319
  158   2HG   LYS  22          1HG       LYS  22   5.403   7.111  -4.102
  159   1HD   LYS  22          2HD       LYS  22   5.564   4.666  -3.345
  160   2HD   LYS  22          1HD       LYS  22   4.794   4.276  -4.883
  161   1HE   LYS  22          2HE       LYS  22   6.744   5.951  -5.717
  162   2HE   LYS  22          1HE       LYS  22   7.525   5.222  -4.313
  163   1HZ   LYS  22          1HZ       LYS  22   6.800   3.022  -5.324
  164   2HZ   LYS  22          2HZ       LYS  22   8.071   3.837  -6.087
  165   3HZ   LYS  22          3HZ       LYS  22   6.516   3.888  -6.749
  166    H    THR  23           H        THR  23   1.838   4.748  -1.167
  167    HA   THR  23           HA       THR  23   3.641   2.578  -0.746
  168    HB   THR  23           HB       THR  23   1.310   2.857   1.055
  169    HG1  THR  23           1HG      THR  23   3.230   4.920   0.752
  170   1HG2  THR  23          1HG2      THR  23   4.280   2.808   1.515
  171   2HG2  THR  23          2HG2      THR  23   3.147   1.479   1.755
  172   3HG2  THR  23          3HG2      THR  23   3.060   2.908   2.783
  173    H    TYR  24           H        TYR  24   0.213   2.855  -1.496
  174    HA   TYR  24           HA       TYR  24  -0.415   0.116  -1.176
  175   1HB   TYR  24          2HB       TYR  24  -2.094   1.966  -1.316
  176   2HB   TYR  24          1HB       TYR  24  -1.739   2.104  -3.034
  177    HD1  TYR  24           1HD      TYR  24  -3.698   1.435  -4.104
  178    HD2  TYR  24           2HD      TYR  24  -2.143  -0.955  -0.946
  179    HE1  TYR  24           1HE      TYR  24  -5.377  -0.293  -4.593
  180    HE2  TYR  24           2HE      TYR  24  -3.818  -2.690  -1.427
  181    HH   TYR  24           HH       TYR  24  -5.398  -3.026  -4.119
  182    H    LEU  25           H        LEU  25   1.023   1.983  -3.723
  183    HA   LEU  25           HA       LEU  25   0.772  -0.042  -5.747
  184   1HB   LEU  25          2HB       LEU  25   2.284   2.541  -5.504
  185   2HB   LEU  25          1HB       LEU  25   2.625   1.439  -6.824
  186    HG   LEU  25           HG       LEU  25   0.828   3.454  -6.952
  187   1HD1  LEU  25          1HD1      LEU  25  -0.243   1.925  -8.798
  188   2HD1  LEU  25          2HD1      LEU  25   1.118   0.876  -8.404
  189   3HD1  LEU  25          3HD1      LEU  25   1.408   2.525  -8.956
  190   1HD2  LEU  25          1HD2      LEU  25  -0.616   2.323  -5.260
  191   2HD2  LEU  25          2HD2      LEU  25  -0.845   1.007  -6.411
  192   3HD2  LEU  25          3HD2      LEU  25  -1.411   2.631  -6.803
  193    H    ALA  26           H        ALA  26   3.277   1.085  -3.538
  194    HA   ALA  26           HA       ALA  26   5.343  -0.584  -4.426
  195   1HB   ALA  26          1HB       ALA  26   4.858   0.625  -1.709
  196   2HB   ALA  26          2HB       ALA  26   5.811   1.316  -3.022
  197   3HB   ALA  26          3HB       ALA  26   6.361  -0.151  -2.211
  198    H    HIS  27           H        HIS  27   2.637  -1.129  -2.262
  199    HA   HIS  27           HA       HIS  27   3.638  -3.558  -1.151
  200   1HB   HIS  27          2HB       HIS  27   1.965  -2.384   0.091
  201   2HB   HIS  27          1HB       HIS  27   0.861  -2.375  -1.280
  202    HD1  HIS  27           1HD      HIS  27   2.402  -4.844   1.174
  203    HD2  HIS  27           2HD      HIS  27  -0.834  -4.479  -1.405
  204    HE1  HIS  27           1HE      HIS  27   0.957  -6.886   1.548
  205    H    LYS  28           H        LYS  28   1.389  -2.810  -3.792
  206    HA   LYS  28           HA       LYS  28   0.842  -5.533  -4.415
  207   1HB   LYS  28          2HB       LYS  28  -0.446  -3.323  -5.038
  208   2HB   LYS  28          1HB       LYS  28   0.595  -3.359  -6.455
  209   1HG   LYS  28          2HG       LYS  28  -0.279  -5.872  -6.537
  210   2HG   LYS  28          1HG       LYS  28  -1.645  -5.135  -5.695
  211   1HD   LYS  28          2HD       LYS  28  -2.278  -3.922  -7.506
  212   2HD   LYS  28          1HD       LYS  28  -0.621  -3.699  -8.070
  213   1HE   LYS  28          2HE       LYS  28  -0.777  -6.282  -8.526
  214   2HE   LYS  28          1HE       LYS  28  -2.509  -5.955  -8.549
  215   1HZ   LYS  28          1HZ       LYS  28  -2.340  -4.688 -10.424
  216   2HZ   LYS  28          2HZ       LYS  28  -1.094  -5.794 -10.717
  217   3HZ   LYS  28          3HZ       LYS  28  -0.731  -4.246 -10.138
  218    H    GLN  29           H        GLN  29   3.345  -3.296  -5.306
  219    HA   GLN  29           HA       GLN  29   4.254  -4.891  -7.542
  220   1HB   GLN  29          2HB       GLN  29   4.440  -2.256  -7.018
  221   2HB   GLN  29          1HB       GLN  29   6.007  -2.785  -6.420
  222   1HG   GLN  29          2HG       GLN  29   4.920  -3.244  -9.190
  223   2HG   GLN  29          1HG       GLN  29   6.144  -2.060  -8.732
  224   1HE2  GLN  29          1HE2      GLN  29   7.920  -3.246  -7.286
  225   2HE2  GLN  29          2HE2      GLN  29   8.604  -4.636  -8.051
  226    H    PHE  30           H        PHE  30   4.816  -4.809  -4.151
  227    HA   PHE  30           HA       PHE  30   7.251  -6.430  -4.510
  228   1HB   PHE  30          2HB       PHE  30   6.478  -4.403  -2.474
  229   2HB   PHE  30          1HB       PHE  30   7.452  -5.767  -1.939
  230    HD1  PHE  30           1HD      PHE  30   7.451  -3.667  -5.025
  231    HD2  PHE  30           2HD      PHE  30   9.641  -5.140  -1.687
  232    HE1  PHE  30           1HE      PHE  30   9.474  -2.543  -5.860
  233    HE2  PHE  30           2HE      PHE  30  11.668  -4.018  -2.516
  234    HZ   PHE  30           HZ       PHE  30  11.585  -2.717  -4.605
  235    H    TYR  31           H        TYR  31   4.343  -6.086  -2.484
  236    HA   TYR  31           HA       TYR  31   4.708  -8.629  -1.225
  237   1HB   TYR  31          2HB       TYR  31   3.291  -6.435  -0.560
  238   2HB   TYR  31          1HB       TYR  31   2.007  -7.409  -1.269
  239    HD1  TYR  31           1HD      TYR  31   4.445  -7.177   1.468
  240    HD2  TYR  31           2HD      TYR  31   1.229  -9.420  -0.184
  241    HE1  TYR  31           1HE      TYR  31   4.241  -8.426   3.576
  242    HE2  TYR  31           2HE      TYR  31   1.015 -10.674   1.920
  243    HH   TYR  31           HH       TYR  31   3.373 -10.559   4.377
  244    H    HIS  32           H        HIS  32   2.749  -7.430  -3.907
  245    HA   HIS  32           HA       HIS  32   1.901 -10.199  -4.443
  246   1HB   HIS  32          2HB       HIS  32   0.610  -7.603  -5.310
  247   2HB   HIS  32          1HB       HIS  32   0.035  -9.213  -5.728
  248    HD1  HIS  32           1HD      HIS  32  -1.394 -10.426  -3.982
  249    HD2  HIS  32           2HD      HIS  32   0.295  -6.896  -2.581
  250    HE1  HIS  32           1HE      HIS  32  -2.490  -9.946  -1.750
  251    H    LYS  33           H        LYS  33   4.403  -9.709  -5.231
  252    HA   LYS  33           HA       LYS  33   4.235 -10.005  -8.077
  253   1HB   LYS  33          2HB       LYS  33   5.068  -7.442  -6.894
  254   2HB   LYS  33          1HB       LYS  33   6.181  -8.084  -8.093
  255   1HG   LYS  33          2HG       LYS  33   3.366  -8.170  -8.891
  256   2HG   LYS  33          1HG       LYS  33   4.014  -6.548  -8.644
  257   1HD   LYS  33          2HD       LYS  33   4.388  -7.075 -10.922
  258   2HD   LYS  33          1HD       LYS  33   5.950  -7.233 -10.116
  259   1HE   LYS  33          2HE       LYS  33   4.314  -9.678 -10.205
  260   2HE   LYS  33          1HE       LYS  33   4.887  -9.097 -11.767
  261   1HZ   LYS  33          1HZ       LYS  33   6.384 -10.215  -9.543
  262   2HZ   LYS  33          2HZ       LYS  33   7.114  -8.910 -10.333
  263   3HZ   LYS  33          3HZ       LYS  33   6.691 -10.295 -11.205
  264    H    ASN  34           H        ASN  34   5.043 -11.748  -6.111
  265    HA   ASN  34           HA       ASN  34   7.625 -12.489  -7.037
  266   1HB   ASN  34          2HB       ASN  34   7.400 -11.061  -4.439
  267   2HB   ASN  34          1HB       ASN  34   8.459 -12.467  -4.490
  268   1HD2  ASN  34          1HD2      ASN  34   9.863 -12.468  -6.572
  269   2HD2  ASN  34          2HD2      ASN  34  10.675 -10.978  -6.897
  270    H    LYS  35           H        LYS  35   4.991 -13.622  -6.795
  271    HA   LYS  35           HA       LYS  35   5.667 -15.986  -5.182
  272   1HB   LYS  35          2HB       LYS  35   3.988 -14.664  -3.971
  273   2HB   LYS  35          1HB       LYS  35   2.937 -14.702  -5.380
  274   1HG   LYS  35          2HG       LYS  35   2.018 -16.391  -4.173
  275   2HG   LYS  35          1HG       LYS  35   3.219 -17.309  -5.085
  276   1HD   LYS  35          2HD       LYS  35   3.436 -18.031  -2.851
  277   2HD   LYS  35          1HD       LYS  35   4.784 -16.924  -3.122
  278   1HE   LYS  35          2HE       LYS  35   3.149 -15.131  -2.188
  279   2HE   LYS  35          1HE       LYS  35   2.288 -16.518  -1.524
  280   1HZ   LYS  35          1HZ       LYS  35   3.924 -16.941  -0.046
  281   2HZ   LYS  35          2HZ       LYS  35   4.235 -15.290  -0.233
  282   3HZ   LYS  35          3HZ       LYS  35   5.165 -16.424  -1.074
  283    HA   PRO  36           HA       PRO  36   4.792 -17.313  -9.500
  284   1HB   PRO  36          2HB       PRO  36   6.539 -19.389  -9.466
  285   2HB   PRO  36          1HB       PRO  36   7.028 -17.729  -9.829
  286   1HG   PRO  36          2HG       PRO  36   7.252 -19.251  -7.260
  287   2HG   PRO  36          1HG       PRO  36   8.440 -18.188  -8.038
  288   1HD   PRO  36          2HD       PRO  36   6.887 -17.373  -5.977
  289   2HD   PRO  36          1HD       PRO  36   7.418 -16.272  -7.264
  Start of MODEL   20
    1   1H    GLY   1          1HT       GLY   1 -22.859  10.173  -9.873
    2   2H    GLY   1          2HT       GLY   1 -24.348  10.972  -9.831
    3   3H    GLY   1          3HT       GLY   1 -24.099   9.598  -8.877
    4   1HA   GLY   1          1HA       GLY   1 -23.330  12.350  -8.407
    5   2HA   GLY   1          2HA       GLY   1 -23.711  11.080  -7.253
    6    H    SER   2           H        SER   2 -21.584  12.876  -6.928
    7    HA   SER   2           HA       SER   2 -19.183  11.340  -7.582
    8   1HB   SER   2          2HB       SER   2 -19.290  13.833  -7.980
    9   2HB   SER   2          1HB       SER   2 -19.334  14.040  -6.228
   10    HG   SER   2           HG       SER   2 -17.291  12.634  -7.603
   11    H    ALA   3           H        ALA   3 -19.565   9.610  -6.117
   12    HA   ALA   3           HA       ALA   3 -18.414  10.038  -3.537
   13   1HB   ALA   3          1HB       ALA   3 -21.348   9.363  -3.686
   14   2HB   ALA   3          2HB       ALA   3 -20.616  10.789  -2.952
   15   3HB   ALA   3          3HB       ALA   3 -20.360   9.198  -2.235
   16    H    ALA   4           H        ALA   4 -17.856   8.430  -5.825
   17    HA   ALA   4           HA       ALA   4 -18.146   5.744  -4.646
   18   1HB   ALA   4          1HB       ALA   4 -19.391   5.373  -6.499
   19   2HB   ALA   4          2HB       ALA   4 -17.805   5.127  -7.229
   20   3HB   ALA   4          3HB       ALA   4 -18.627   6.677  -7.409
   21    H    GLU   5           H        GLU   5 -16.216   5.334  -3.765
   22    HA   GLU   5           HA       GLU   5 -13.989   4.586  -5.122
   23   1HB   GLU   5          2HB       GLU   5 -14.156   7.507  -4.967
   24   2HB   GLU   5          1HB       GLU   5 -12.649   6.869  -4.326
   25   1HG   GLU   5          2HG       GLU   5 -13.457   5.704  -6.884
   26   2HG   GLU   5          1HG       GLU   5 -13.127   7.435  -6.938
   27    H    VAL   6           H        VAL   6 -14.811   3.378  -3.104
   28    HA   VAL   6           HA       VAL   6 -13.614   4.381  -0.635
   29    HB   VAL   6           HB       VAL   6 -15.917   3.474  -0.573
   30   1HG1  VAL   6          1HG1      VAL   6 -14.628   0.809  -1.139
   31   2HG1  VAL   6          2HG1      VAL   6 -15.593   1.728  -2.293
   32   3HG1  VAL   6          3HG1      VAL   6 -16.335   1.113  -0.817
   33   1HG2  VAL   6          1HG2      VAL   6 -14.292   1.573   1.039
   34   2HG2  VAL   6          2HG2      VAL   6 -15.674   2.561   1.512
   35   3HG2  VAL   6          3HG2      VAL   6 -14.086   3.303   1.312
   36    H    MET   7           H        MET   7 -11.811   3.628  -2.680
   37    HA   MET   7           HA       MET   7 -10.157   1.814  -1.229
   38   1HB   MET   7          2HB       MET   7  -9.985   0.059  -2.911
   39   2HB   MET   7          1HB       MET   7 -11.639   0.191  -2.329
   40   1HG   MET   7          2HG       MET   7 -12.258   1.435  -4.325
   41   2HG   MET   7          1HG       MET   7 -10.595   1.345  -4.906
   42   1HE   MET   7          1HE       MET   7 -12.789  -0.892  -7.237
   43   2HE   MET   7          2HE       MET   7 -12.658   0.778  -6.687
   44   3HE   MET   7          3HE       MET   7 -13.883  -0.285  -5.994
   45    H    LYS   8           H        LYS   8  -8.054   2.156  -1.693
   46    HA   LYS   8           HA       LYS   8  -7.016   2.907  -4.186
   47   1HB   LYS   8          2HB       LYS   8  -6.625   5.226  -4.003
   48   2HB   LYS   8          1HB       LYS   8  -8.310   5.009  -3.556
   49   1HG   LYS   8          2HG       LYS   8  -6.100   5.213  -1.528
   50   2HG   LYS   8          1HG       LYS   8  -6.975   6.613  -2.146
   51   1HD   LYS   8          2HD       LYS   8  -8.296   4.240  -0.836
   52   2HD   LYS   8          1HD       LYS   8  -7.850   5.719   0.017
   53   1HE   LYS   8          2HE       LYS   8  -9.232   6.910  -1.813
   54   2HE   LYS   8          1HE       LYS   8  -9.920   5.314  -2.113
   55   1HZ   LYS   8          1HZ       LYS   8 -11.150   6.791  -0.501
   56   2HZ   LYS   8          2HZ       LYS   8  -9.879   6.533   0.585
   57   3HZ   LYS   8          3HZ       LYS   8 -10.805   5.226   0.042
   58    H    LYS   9           H        LYS   9  -6.683   3.105  -0.686
   59    HA   LYS   9           HA       LYS   9  -3.895   2.237  -0.974
   60   1HB   LYS   9          2HB       LYS   9  -3.379   3.680   1.052
   61   2HB   LYS   9          1HB       LYS   9  -3.645   4.532  -0.459
   62   1HG   LYS   9          2HG       LYS   9  -6.077   4.771   0.365
   63   2HG   LYS   9          1HG       LYS   9  -5.410   4.365   1.947
   64   1HD   LYS   9          2HD       LYS   9  -5.453   6.747   1.769
   65   2HD   LYS   9          1HD       LYS   9  -3.770   6.233   1.641
   66   1HE   LYS   9          2HE       LYS   9  -3.727   7.560  -0.166
   67   2HE   LYS   9          1HE       LYS   9  -4.534   6.213  -0.966
   68   1HZ   LYS   9          1HZ       LYS   9  -6.673   7.310  -0.209
   69   2HZ   LYS   9          2HZ       LYS   9  -5.823   8.081  -1.452
   70   3HZ   LYS   9          3HZ       LYS   9  -5.740   8.681   0.127
   71    H    TYR  10           H        TYR  10  -5.780   0.413  -0.609
   72    HA   TYR  10           HA       TYR  10  -5.181  -0.631   2.021
   73   1HB   TYR  10          2HB       TYR  10  -7.286   0.782   2.264
   74   2HB   TYR  10          1HB       TYR  10  -8.082  -0.385   1.213
   75    HD1  TYR  10           1HD      TYR  10  -7.527   0.491   4.533
   76    HD2  TYR  10           2HD      TYR  10  -7.718  -2.926   2.006
   77    HE1  TYR  10           1HE      TYR  10  -8.015  -0.919   6.487
   78    HE2  TYR  10           2HE      TYR  10  -8.208  -4.346   3.953
   79    HH   TYR  10           HH       TYR  10  -7.861  -3.242   7.167
   80    H    CYS  11           H        CYS  11  -4.813  -2.756   1.847
   81    HA   CYS  11           HA       CYS  11  -5.422  -4.057  -0.667
   82   1HB   CYS  11          2HB       CYS  11  -3.214  -4.293   0.581
   83   2HB   CYS  11          1HB       CYS  11  -4.075  -5.333   1.709
   84    H    SER  12           H        SER  12  -7.081  -5.321  -1.049
   85    HA   SER  12           HA       SER  12  -8.927  -5.982   1.085
   86   1HB   SER  12          2HB       SER  12 -10.091  -7.063  -1.081
   87   2HB   SER  12          1HB       SER  12 -10.212  -5.347  -0.691
   88    HG   SER  12           HG       SER  12  -8.991  -4.882  -2.351
   89    H    THR  13           H        THR  13  -6.231  -7.360   0.652
   90    HA   THR  13           HA       THR  13  -7.276 -10.084   0.841
   91    HB   THR  13           HB       THR  13  -4.780  -9.282  -0.660
   92    HG1  THR  13           1HG      THR  13  -7.344 -10.100  -1.517
   93   1HG2  THR  13          1HG2      THR  13  -5.022 -11.627   0.541
   94   2HG2  THR  13          2HG2      THR  13  -4.289 -11.456  -1.054
   95   3HG2  THR  13          3HG2      THR  13  -5.966 -11.982  -0.906
   96    H    CYS  14           H        CYS  14  -4.757  -7.768   1.638
   97    HA   CYS  14           HA       CYS  14  -3.678  -9.613   3.646
   98   1HB   CYS  14          2HB       CYS  14  -2.620  -6.942   2.706
   99   2HB   CYS  14          1HB       CYS  14  -1.821  -8.018   3.846
  100    H    ASP  15           H        ASP  15  -6.007  -7.261   3.462
  101    HA   ASP  15           HA       ASP  15  -7.132  -6.005   4.984
  102   1HB   ASP  15          2HB       ASP  15  -6.419  -8.414   6.255
  103   2HB   ASP  15          1HB       ASP  15  -6.109  -7.142   7.429
  104    H    ILE  16           H        ILE  16  -4.683  -5.001   4.082
  105    HA   ILE  16           HA       ILE  16  -3.681  -3.572   6.457
  106    HB   ILE  16           HB       ILE  16  -2.178  -3.784   3.862
  107   1HG1  ILE  16          2HG1      ILE  16  -2.622  -6.072   4.674
  108   2HG1  ILE  16          1HG1      ILE  16  -0.916  -5.656   4.798
  109   1HG2  ILE  16          1HG2      ILE  16  -1.250  -2.098   5.154
  110   2HG2  ILE  16          2HG2      ILE  16  -0.262  -3.498   5.570
  111   3HG2  ILE  16          3HG2      ILE  16  -1.535  -2.961   6.665
  112   1HD1  ILE  16          1HD1      ILE  16  -2.866  -5.533   7.083
  113   2HD1  ILE  16          2HD1      ILE  16  -1.119  -5.305   7.160
  114   3HD1  ILE  16          3HD1      ILE  16  -1.786  -6.886   6.751
  115    H    SER  17           H        SER  17  -2.966  -1.330   6.042
  116    HA   SER  17           HA       SER  17  -4.504  -0.052   3.884
  117   1HB   SER  17          2HB       SER  17  -4.605   1.876   5.758
  118   2HB   SER  17          1HB       SER  17  -5.853   0.641   5.595
  119    HG   SER  17           HG       SER  17  -4.941  -0.489   7.270
  120    H    PHE  18           H        PHE  18  -3.753   2.181   3.413
  121    HA   PHE  18           HA       PHE  18  -0.971   2.695   4.096
  122   1HB   PHE  18          2HB       PHE  18  -2.058   2.421   1.290
  123   2HB   PHE  18          1HB       PHE  18  -0.512   3.165   1.664
  124    HD1  PHE  18           1HD      PHE  18   1.297   1.781   2.684
  125    HD2  PHE  18           2HD      PHE  18  -2.323   0.087   1.225
  126    HE1  PHE  18           1HE      PHE  18   2.357  -0.439   2.643
  127    HE2  PHE  18           2HE      PHE  18  -1.271  -2.136   1.182
  128    HZ   PHE  18           HZ       PHE  18   1.070  -2.402   1.891
  129    H    ASN  19           H        ASN  19  -0.444   4.849   4.114
  130    HA   ASN  19           HA       ASN  19  -2.652   6.690   4.191
  131   1HB   ASN  19          2HB       ASN  19  -0.868   8.309   4.895
  132   2HB   ASN  19          1HB       ASN  19  -1.009   6.887   5.918
  133   1HD2  ASN  19          1HD2      ASN  19   1.066   8.826   4.162
  134   2HD2  ASN  19          2HD2      ASN  19   2.450   7.791   4.154
  135    H    TYR  20           H        TYR  20  -0.272   5.759   1.905
  136    HA   TYR  20           HA       TYR  20  -1.101   7.975   0.166
  137   1HB   TYR  20          2HB       TYR  20   1.650   7.173   0.944
  138   2HB   TYR  20          1HB       TYR  20   1.395   7.619  -0.739
  139    HD1  TYR  20           1HD      TYR  20  -0.369   9.827  -0.753
  140    HD2  TYR  20           2HD      TYR  20   2.623   8.893   2.125
  141    HE1  TYR  20           1HE      TYR  20  -0.217  12.205  -0.148
  142    HE2  TYR  20           2HE      TYR  20   2.782  11.268   2.739
  143    HH   TYR  20           HH       TYR  20   1.784  13.701   0.954
  144    H    VAL  21           H        VAL  21  -1.671   7.401  -1.844
  145    HA   VAL  21           HA       VAL  21  -2.201   4.782  -2.558
  146    HB   VAL  21           HB       VAL  21  -1.591   6.983  -4.534
  147   1HG1  VAL  21          1HG1      VAL  21  -3.186   4.440  -4.658
  148   2HG1  VAL  21          2HG1      VAL  21  -1.848   4.950  -5.687
  149   3HG1  VAL  21          3HG1      VAL  21  -3.413   5.752  -5.814
  150   1HG2  VAL  21          1HG2      VAL  21  -4.111   7.355  -4.396
  151   2HG2  VAL  21          2HG2      VAL  21  -3.133   7.971  -3.065
  152   3HG2  VAL  21          3HG2      VAL  21  -4.040   6.471  -2.871
  153    H    LYS  22           H        LYS  22   0.744   6.605  -2.850
  154    HA   LYS  22           HA       LYS  22   2.061   4.984  -4.754
  155   1HB   LYS  22          2HB       LYS  22   3.246   6.670  -2.539
  156   2HB   LYS  22          1HB       LYS  22   4.126   6.030  -3.921
  157   1HG   LYS  22          2HG       LYS  22   2.869   7.404  -5.433
  158   2HG   LYS  22          1HG       LYS  22   1.815   7.948  -4.126
  159   1HD   LYS  22          2HD       LYS  22   3.452   9.288  -3.188
  160   2HD   LYS  22          1HD       LYS  22   4.767   8.373  -3.927
  161   1HE   LYS  22          2HE       LYS  22   4.847  10.118  -5.347
  162   2HE   LYS  22          1HE       LYS  22   3.507   9.285  -6.133
  163   1HZ   LYS  22          1HZ       LYS  22   3.004  11.615  -5.778
  164   2HZ   LYS  22          2HZ       LYS  22   3.256  11.450  -4.114
  165   3HZ   LYS  22          3HZ       LYS  22   1.966  10.647  -4.857
  166    H    THR  23           H        THR  23   1.692   4.801  -1.268
  167    HA   THR  23           HA       THR  23   3.608   2.725  -0.897
  168    HB   THR  23           HB       THR  23   1.353   2.935   1.012
  169    HG1  THR  23           1HG      THR  23   1.433   5.058   0.741
  170   1HG2  THR  23          1HG2      THR  23   3.241   3.185   2.629
  171   2HG2  THR  23          2HG2      THR  23   4.345   2.949   1.274
  172   3HG2  THR  23          3HG2      THR  23   3.221   1.668   1.728
  173    H    TYR  24           H        TYR  24   0.142   2.832  -1.462
  174    HA   TYR  24           HA       TYR  24  -0.370   0.084  -1.074
  175   1HB   TYR  24          2HB       TYR  24  -2.110   1.867  -1.167
  176   2HB   TYR  24          1HB       TYR  24  -1.833   2.002  -2.898
  177    HD1  TYR  24           1HD      TYR  24  -3.604   1.113  -4.077
  178    HD2  TYR  24           2HD      TYR  24  -2.263  -0.903  -0.579
  179    HE1  TYR  24           1HE      TYR  24  -5.247  -0.671  -4.483
  180    HE2  TYR  24           2HE      TYR  24  -3.901  -2.693  -0.976
  181    HH   TYR  24           HH       TYR  24  -6.460  -2.500  -2.689
  182    H    LEU  25           H        LEU  25   0.891   1.943  -3.726
  183    HA   LEU  25           HA       LEU  25   0.604  -0.132  -5.693
  184   1HB   LEU  25          2HB       LEU  25   1.904   2.545  -5.566
  185   2HB   LEU  25          1HB       LEU  25   2.479   1.421  -6.783
  186    HG   LEU  25           HG       LEU  25  -0.392   2.309  -6.490
  187   1HD1  LEU  25          1HD1      LEU  25   0.316   3.349  -8.813
  188   2HD1  LEU  25          2HD1      LEU  25   1.902   3.379  -8.042
  189   3HD1  LEU  25          3HD1      LEU  25   0.544   4.223  -7.297
  190   1HD2  LEU  25          1HD2      LEU  25  -0.421   0.201  -7.508
  191   2HD2  LEU  25          2HD2      LEU  25   1.044   0.527  -8.432
  192   3HD2  LEU  25          3HD2      LEU  25  -0.463   1.340  -8.854
  193    H    ALA  26           H        ALA  26   3.201   1.119  -3.657
  194    HA   ALA  26           HA       ALA  26   5.249  -0.541  -4.599
  195   1HB   ALA  26          1HB       ALA  26   5.244   1.523  -2.942
  196   2HB   ALA  26          2HB       ALA  26   6.528   0.316  -2.912
  197   3HB   ALA  26          3HB       ALA  26   5.220   0.240  -1.733
  198    H    HIS  27           H        HIS  27   2.674  -1.068  -2.275
  199    HA   HIS  27           HA       HIS  27   3.738  -3.443  -1.140
  200   1HB   HIS  27          2HB       HIS  27   2.039  -2.339   0.104
  201   2HB   HIS  27          1HB       HIS  27   0.945  -2.306  -1.276
  202    HD1  HIS  27           1HD      HIS  27   2.467  -4.824   1.142
  203    HD2  HIS  27           2HD      HIS  27  -0.765  -4.393  -1.429
  204    HE1  HIS  27           1HE      HIS  27   1.012  -6.864   1.480
  205    H    LYS  28           H        LYS  28   1.207  -2.929  -3.598
  206    HA   LYS  28           HA       LYS  28   0.835  -5.637  -4.225
  207   1HB   LYS  28          2HB       LYS  28  -0.540  -3.508  -4.883
  208   2HB   LYS  28          1HB       LYS  28   0.507  -3.496  -6.295
  209   1HG   LYS  28          2HG       LYS  28  -0.253  -5.666  -6.958
  210   2HG   LYS  28          1HG       LYS  28  -1.163  -5.855  -5.457
  211   1HD   LYS  28          2HD       LYS  28  -2.871  -4.562  -6.178
  212   2HD   LYS  28          1HD       LYS  28  -1.804  -3.457  -7.046
  213   1HE   LYS  28          2HE       LYS  28  -1.483  -5.414  -8.693
  214   2HE   LYS  28          1HE       LYS  28  -2.928  -6.088  -7.941
  215   1HZ   LYS  28          1HZ       LYS  28  -3.430  -4.780  -9.930
  216   2HZ   LYS  28          2HZ       LYS  28  -2.763  -3.405  -9.204
  217   3HZ   LYS  28          3HZ       LYS  28  -4.150  -4.117  -8.550
  218    H    GLN  29           H        GLN  29   3.241  -3.331  -5.239
  219    HA   GLN  29           HA       GLN  29   4.187  -4.987  -7.415
  220   1HB   GLN  29          2HB       GLN  29   4.285  -2.317  -6.970
  221   2HB   GLN  29          1HB       GLN  29   5.893  -2.784  -6.437
  222   1HG   GLN  29          2HG       GLN  29   6.564  -3.395  -8.524
  223   2HG   GLN  29          1HG       GLN  29   4.936  -3.831  -9.042
  224   1HE2  GLN  29          1HE2      GLN  29   5.361  -2.650 -10.972
  225   2HE2  GLN  29          2HE2      GLN  29   5.228  -0.928 -10.994
  226    H    PHE  30           H        PHE  30   4.695  -4.863  -4.053
  227    HA   PHE  30           HA       PHE  30   7.280  -6.246  -4.337
  228   1HB   PHE  30          2HB       PHE  30   6.191  -4.400  -2.273
  229   2HB   PHE  30          1HB       PHE  30   7.264  -5.684  -1.729
  230    HD1  PHE  30           1HD      PHE  30   7.347  -2.415  -2.260
  231    HD2  PHE  30           2HD      PHE  30   9.249  -5.905  -3.782
  232    HE1  PHE  30           1HE      PHE  30   9.293  -1.062  -2.919
  233    HE2  PHE  30           2HE      PHE  30  11.200  -4.558  -4.443
  234    HZ   PHE  30           HZ       PHE  30  11.223  -2.134  -4.012
  235    H    TYR  31           H        TYR  31   4.354  -6.247  -2.291
  236    HA   TYR  31           HA       TYR  31   4.886  -8.862  -1.268
  237   1HB   TYR  31          2HB       TYR  31   3.453  -6.868  -0.287
  238   2HB   TYR  31          1HB       TYR  31   2.153  -7.666  -1.164
  239    HD1  TYR  31           1HD      TYR  31   4.744  -8.207   1.438
  240    HD2  TYR  31           2HD      TYR  31   1.096  -9.569  -0.274
  241    HE1  TYR  31           1HE      TYR  31   4.463  -9.782   3.305
  242    HE2  TYR  31           2HE      TYR  31   0.803 -11.147   1.588
  243    HH   TYR  31           HH       TYR  31   1.724 -11.155   4.157
  244    H    HIS  32           H        HIS  32   2.798  -7.552  -3.794
  245    HA   HIS  32           HA       HIS  32   1.961 -10.286  -4.474
  246   1HB   HIS  32          2HB       HIS  32   0.784  -7.642  -5.355
  247   2HB   HIS  32          1HB       HIS  32   0.161  -9.234  -5.776
  248    HD1  HIS  32           1HD      HIS  32  -1.339 -10.391  -4.051
  249    HD2  HIS  32           2HD      HIS  32   0.420  -6.898  -2.645
  250    HE1  HIS  32           1HE      HIS  32  -2.468  -9.862  -1.848
  251    H    LYS  33           H        LYS  33   4.520  -9.781  -5.145
  252    HA   LYS  33           HA       LYS  33   4.387  -9.791  -8.059
  253   1HB   LYS  33          2HB       LYS  33   5.811  -7.773  -6.413
  254   2HB   LYS  33          1HB       LYS  33   6.674  -8.402  -7.810
  255   1HG   LYS  33          2HG       LYS  33   3.921  -7.190  -7.916
  256   2HG   LYS  33          1HG       LYS  33   5.417  -6.318  -8.259
  257   1HD   LYS  33          2HD       LYS  33   5.694  -7.316 -10.273
  258   2HD   LYS  33          1HD       LYS  33   5.029  -8.855  -9.719
  259   1HE   LYS  33          2HE       LYS  33   3.468  -8.056 -11.274
  260   2HE   LYS  33          1HE       LYS  33   2.767  -7.679  -9.701
  261   1HZ   LYS  33          1HZ       LYS  33   4.026  -5.844 -11.643
  262   2HZ   LYS  33          2HZ       LYS  33   3.879  -5.419 -10.013
  263   3HZ   LYS  33          3HZ       LYS  33   2.495  -5.744 -10.930
  264    H    ASN  34           H        ASN  34   4.611 -12.090  -7.098
  265    HA   ASN  34           HA       ASN  34   5.859 -13.987  -6.977
  266   1HB   ASN  34          2HB       ASN  34   8.193 -12.329  -7.943
  267   2HB   ASN  34          1HB       ASN  34   7.973 -14.069  -8.104
  268   1HD2  ASN  34          1HD2      ASN  34   8.447 -12.056 -10.149
  269   2HD2  ASN  34          2HD2      ASN  34   7.122 -12.168 -11.252
  270    H    LYS  35           H        LYS  35   5.499 -12.763  -4.615
  271    HA   LYS  35           HA       LYS  35   7.640 -13.744  -3.052
  272   1HB   LYS  35          2HB       LYS  35   8.314 -11.336  -4.015
  273   2HB   LYS  35          1HB       LYS  35   7.399 -10.817  -2.607
  274   1HG   LYS  35          2HG       LYS  35   9.672 -12.782  -2.485
  275   2HG   LYS  35          1HG       LYS  35   9.858 -11.044  -2.247
  276   1HD   LYS  35          2HD       LYS  35   7.982 -12.757  -0.626
  277   2HD   LYS  35          1HD       LYS  35   9.639 -12.396  -0.139
  278   1HE   LYS  35          2HE       LYS  35   7.460 -10.374  -0.651
  279   2HE   LYS  35          1HE       LYS  35   8.040 -10.887   0.933
  280   1HZ   LYS  35          1HZ       LYS  35  10.280 -10.067   0.205
  281   2HZ   LYS  35          2HZ       LYS  35   9.113  -8.864   0.433
  282   3HZ   LYS  35          3HZ       LYS  35   9.520  -9.360  -1.132
  283    HA   PRO  36           HA       PRO  36   3.402 -12.941  -1.104
  284   1HB   PRO  36          2HB       PRO  36   2.591 -15.522  -0.928
  285   2HB   PRO  36          1HB       PRO  36   2.271 -14.515  -2.344
  286   1HG   PRO  36          2HG       PRO  36   4.410 -16.567  -1.923
  287   2HG   PRO  36          1HG       PRO  36   3.393 -16.287  -3.349
  288   1HD   PRO  36          2HD       PRO  36   5.947 -15.397  -3.177
  289   2HD   PRO  36          1HD       PRO  36   4.692 -14.533  -4.086