*HEADER    TRANSCRIPTION                           18-SEP-00   1FV5              
*TITLE     SOLUTION STRUCTURE OF THE FIRST ZINC FINGER FROM THE                  
*TITLE    2 DROSOPHILA U-SHAPED TRANSCRIPTION FACTOR                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: FIRST ZINC FINGER OF U-SHAPED;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: FIRST ZINC FINGER DOMAIN (RESIDUES 202-235);               
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER;                        
*SOURCE   3 ORGANISM_COMMON: FRUIT FLY;                                          
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_PLASMID: PGEX-2T                                   
*KEYWDS    ZINC FINGER, CCHC, PROTEIN INTERACTION                                
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    C.K.LIEW, K.KOWALSKI, A.H.FOX, A.NEWTON, B.K.SHARPE,                  
*AUTHOR   2 M.CROSSLEY, J.P.MACKAY                                               
*REVDAT   1   04-OCT-00 1FV5    0                                                
remark input file: caliba3.upl                                       
remark output file: /nmr1a/chu/cns/input/3101noe.tbl                  
set echo=false end
set wrnlev=0 end
! range |i-j| =     0
assign (resid   4 and name HN    )(resid   4 and name HA    )  0.00  0.00  2.90
assign (resid   5 and name HN    )(resid   5 and name HG*   )  0.00  0.00  6.38
assign (resid   8 and name HN    )(resid   8 and name HD*   )  0.00  0.00  6.38
assign (resid   8 and name HA    )(resid   8 and name HD*   )  0.00  0.00  6.38
assign (resid   9 and name HA    )(resid   9 and name HE*   )  0.00  0.00  5.95
assign (resid  10 and name HN    )(resid  10 and name HG*   )  0.00  0.00  5.04
assign (resid  11 and name HN    )(resid  11 and name HB2   )  0.00  0.00  3.40
assign (resid  11 and name HN    )(resid  11 and name HB1   )  0.00  0.00  3.40
assign (resid  12 and name HN    )(resid  12 and name HB2   )  0.00  0.00  3.24
assign (resid  12 and name HN    )(resid  12 and name HB1   )  0.00  0.00  3.77
assign (resid  12 and name HN    )(resid  12 and name HG    )  0.00  0.00  3.21
assign (resid  12 and name HN    )(resid  12 and name HD1*  )  0.00  0.00  5.75
assign (resid  12 and name HN    )(resid  12 and name HD2*  )  0.00  0.00  5.19
assign (resid  12 and name HA    )(resid  12 and name HG    )  0.00  0.00  3.86
assign (resid  12 and name HA    )(resid  12 and name HD1*  )  0.00  0.00  5.88
assign (resid  12 and name HA    )(resid  12 and name HD2*  )  0.00  0.00  4.17
assign (resid  14 and name HN    )(resid  14 and name HB2   )  0.00  0.00  3.55
assign (resid  14 and name HN    )(resid  14 and name HB1   )  0.00  0.00  3.55
assign (resid  15 and name HN    )(resid  15 and name HA2   )  0.00  0.00  2.77
assign (resid  15 and name HN    )(resid  15 and name HA1   )  0.00  0.00  2.77
assign (resid  15 and name HN    )(resid  15 and name HA*   )  0.00  0.00  2.50
assign (resid  16 and name HN    )(resid  16 and name HD*   )  0.00  0.00  6.53
assign (resid  18 and name HN    )(resid  18 and name HB2   )  0.00  0.00  3.77
assign (resid  18 and name HN    )(resid  18 and name HB1   )  0.00  0.00  3.33
assign (resid  18 and name HN    )(resid  18 and name HE*   )  0.00  0.00  7.62
assign (resid  20 and name HN    )(resid  20 and name HA    )  0.00  0.00  2.80
assign (resid  20 and name HN    )(resid  20 and name HB2   )  0.00  0.00  4.05
assign (resid  20 and name HN    )(resid  20 and name HB1   )  0.00  0.00  4.05
assign (resid  20 and name HN    )(resid  20 and name HB*   )  0.00  0.00  3.86
assign (resid  23 and name HA    )(resid  23 and name HG2*  )  0.00  0.00  3.68
assign (resid  24 and name HN    )(resid  24 and name HB2   )  0.00  0.00  3.18
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 HG    )  0.00  0.00  3.02
assign (resid  24 and name HN    )(resid  24 and name HD1*  )  0.00  0.00  5.50
assign (resid  24 and name HN    )(resid  24 and name HD2*  )  0.00  0.00  5.78
assign (resid  24 and name HA    )(resid  24 and name HD1*  )  0.00  0.00  4.95
assign (resid  24 and name HA    )(resid  24 and name HD2*  )  0.00  0.00  3.89
assign (resid  25 and name HN    )(resid  25 and name HG2   )  0.00  0.00  4.79
assign (resid  25 and name HN    )(resid  25 and name HG1   )  0.00  0.00  4.79
assign (resid  25 and name HN    )(resid  25 and name HG*   )  0.00  0.00  4.23
assign (resid  26 and name HN    )(resid  26 and name HA    )  0.00  0.00  2.62
assign (resid  27 and name HN    )(resid  27 and name HB2   )  0.00  0.00  3.21
assign (resid  27 and name HN    )(resid  27 and name HB1   )  0.00  0.00  3.21
assign (resid  27 and name HN    )(resid  27 and name HB*   )  0.00  0.00  3.03
assign (resid  28 and name HN    )(resid  28 and name HB2   )  0.00  0.00  3.46
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 HG2   )  0.00  0.00  4.04
assign (resid  28 and name HN    )(resid  28 and name HG1   )  0.00  0.00  4.04
assign (resid  28 and name HN    )(resid  28 and name HG*   )  0.00  0.00  3.60
assign (resid  28 and name HA    )(resid  28 and name HB1   )  0.00  0.00  3.05
assign (resid  28 and name HA    )(resid  28 and name HG2   )  0.00  0.00  3.98
assign (resid  28 and name HA    )(resid  28 and name HG1   )  0.00  0.00  3.98
assign (resid  28 and name HA    )(resid  28 and name HG*   )  0.00  0.00  3.49
assign (resid  30 and name HN    )(resid  30 and name HB2   )  0.00  0.00  3.55
assign (resid  30 and name HN    )(resid  30 and name HB1   )  0.00  0.00  3.67
assign (resid  31 and name HN    )(resid  31 and name HB2   )  0.00  0.00  3.67
assign (resid  31 and name HN    )(resid  31 and name HB1   )  0.00  0.00  3.95
assign (resid  32 and name HN    )(resid  32 and name HB*   )  0.00  0.00  3.73
assign (resid  34 and name HN    )(resid  34 and name HB2   )  0.00  0.00  3.95
assign (resid  34 and name HN    )(resid  34 and name HB1   )  0.00  0.00  3.95
assign (resid  34 and name HN    )(resid  34 and name HB*   )  0.00  0.00  3.71
assign (resid  35 and name HN    )(resid  35 and name HB2   )  0.00  0.00  3.92
assign (resid  35 and name HN    )(resid  35 and name HB1   )  0.00  0.00  3.92
assign (resid  35 and name HN    )(resid  35 and name HB*   )  0.00  0.00  3.76
assign (resid  35 and name HN    )(resid  35 and name HG2   )  0.00  0.00  4.63
assign (resid  35 and name HN    )(resid  35 and name HG1   )  0.00  0.00  4.63
assign (resid  35 and name HN    )(resid  35 and name HG*   )  0.00  0.00  4.26
assign (resid  35 and name HN    )(resid  35 and name HD*   )  0.00  0.00  6.38
assign (resid  35 and name HA    )(resid  35 and name HG2   )  0.00  0.00  3.92
assign (resid  35 and name HA    )(resid  35 and name HG1   )  0.00  0.00  3.92
assign (resid  35 and name HA    )(resid  35 and name HG*   )  0.00  0.00  3.75
assign (resid  35 and name HA    )(resid  35 and name HD*   )  0.00  0.00  6.38
assign (resid  36 and name HN    )(resid  36 and name HG12  )  0.00  0.00  4.94
assign (resid  36 and name HN    )(resid  36 and name HG11  )  0.00  0.00  4.94
assign (resid  36 and name HN    )(resid  36 and name HG1*  )  0.00  0.00  4.79
! total in this range:     75
! range |i-j| =     1
assign (resid   3 and name HA    )(resid   4 and name HN    )  0.00  0.00  3.36
assign (resid   5 and name HA    )(resid   6 and name HD2   )  0.00  0.00  3.02
assign (resid   5 and name HA    )(resid   6 and name HD1   )  0.00  0.00  3.02
assign (resid   5 and name HA    )(resid   6 and name HD*   )  0.00  0.00  2.76
assign (resid   6 and name HA    )(resid   7 and name HN    )  0.00  0.00  2.68
assign (resid   8 and name HA    )(resid   9 and name HN    )  0.00  0.00  2.55
assign (resid   8 and name HA    )(resid   9 and name HD*   )  0.00  0.00  7.62
assign (resid   8 and name HD*   )(resid   9 and name HD*   )  0.00  0.00  8.50
assign (resid  10 and name HN    )(resid  11 and name HN    )  0.00  0.00  3.98
assign (resid  10 and name HA    )(resid  11 and name HN    )  0.00  0.00  2.46
assign (resid  10 and name HA    )(resid  11 and name HB*   )  0.00  0.00  5.39
assign (resid  10 and name HG*   )(resid  11 and name HN    )  0.00  0.00  5.73
assign (resid  11 and name HN    )(resid  12 and name HN    )  0.00  0.00  4.01
assign (resid  11 and name HA    )(resid  12 and name HN    )  0.00  0.00  2.49
assign (resid  11 and name HB2   )(resid  12 and name HN    )  0.00  0.00  5.22
assign (resid  11 and name HB1   )(resid  12 and name HN    )  0.00  0.00  5.22
assign (resid  11 and name HB*   )(resid  12 and name HN    )  0.00  0.00  4.80
assign (resid  12 and name HN    )(resid  13 and name HD2   )  0.00  0.00  3.17
assign (resid  12 and name HN    )(resid  13 and name HD1   )  0.00  0.00  3.17
assign (resid  12 and name HN    )(resid  13 and name HD*   )  0.00  0.00  2.92
assign (resid  12 and name HB1   )(resid  13 and name HD*   )  0.00  0.00  5.73
assign (resid  12 and name HG    )(resid  13 and name HD*   )  0.00  0.00  5.23
assign (resid  13 and name HG*   )(resid  14 and name HN    )  0.00  0.00  5.45
assign (resid  13 and name HD*   )(resid  14 and name HN    )  0.00  0.00  5.46
assign (resid  14 and name HN    )(resid  15 and name HN    )  0.00  0.00  2.74
assign (resid  14 and name HN    )(resid  15 and name HA2   )  0.00  0.00  4.45
assign (resid  14 and name HN    )(resid  15 and name HA1   )  0.00  0.00  4.45
assign (resid  14 and name HN    )(resid  15 and name HA*   )  0.00  0.00  3.93
assign (resid  14 and name HA    )(resid  15 and name HN    )  0.00  0.00  3.52
assign (resid  14 and name HB2   )(resid  15 and name HN    )  0.00  0.00  4.20
assign (resid  14 and name HB1   )(resid  15 and name HN    )  0.00  0.00  4.20
assign (resid  14 and name HB*   )(resid  15 and name HN    )  0.00  0.00  4.02
assign (resid  16 and name HA    )(resid  17 and name HN    )  0.00  0.00  2.40
assign (resid  16 and name HA    )(resid  17 and name HB*   )  0.00  0.00  5.76
assign (resid  16 and name HG2*  )(resid  17 and name HN    )  0.00  0.00  4.23
assign (resid  16 and name HD*   )(resid  17 and name HN    )  0.00  0.00  6.03
assign (resid  17 and name HA    )(resid  18 and name HN    )  0.00  0.00  2.46
assign (resid  17 and name HA    )(resid  18 and name HD*   )  0.00  0.00  6.91
assign (resid  17 and name HB*   )(resid  18 and name HA    )  0.00  0.00  7.03
assign (resid  17 and name HB*   )(resid  18 and name HD*   )  0.00  0.00  9.15
assign (resid  20 and name HA    )(resid  21 and name HG*   )  0.00  0.00  5.71
assign (resid  20 and name HA    )(resid  21 and name HD2   )  0.00  0.00  3.33
assign (resid  20 and name HA    )(resid  21 and name HD1   )  0.00  0.00  3.33
assign (resid  20 and name HA    )(resid  21 and name HD*   )  0.00  0.00  2.83
assign (resid  20 and name HB2   )(resid  21 and name HD2   )  0.00  0.00  5.70
assign (resid  20 and name HB2   )(resid  21 and name HD1   )  0.00  0.00  5.70
assign (resid  20 and name HB1   )(resid  21 and name HD2   )  0.00  0.00  5.70
assign (resid  20 and name HB1   )(resid  21 and name HD1   )  0.00  0.00  5.70
assign (resid  20 and name HB*   )(resid  21 and name HD*   )  0.00  0.00  4.75
assign (resid  23 and name HB    )(resid  24 and name HN    )  0.00  0.00  4.17
assign (resid  24 and name HN    )(resid  25 and name HN    )  0.00  0.00  2.86
assign (resid  24 and name HA    )(resid  25 and name HN    )  0.00  0.00  3.58
assign (resid  24 and name HB2   )(resid  25 and name HN    )  0.00  0.00  3.40
assign (resid  24 and name HB1   )(resid  25 and name HN    )  0.00  0.00  3.80
assign (resid  24 and name HG    )(resid  25 and name HN    )  0.00  0.00  3.55
assign (resid  24 and name HD1*  )(resid  25 and name HN    )  0.00  0.00  5.54
assign (resid  24 and name HD2*  )(resid  25 and name HN    )  0.00  0.00  6.53
assign (resid  25 and name HN    )(resid  26 and name HN    )  0.00  0.00  2.80
assign (resid  25 and name HA    )(resid  26 and name HN    )  0.00  0.00  3.42
assign (resid  25 and name HG*   )(resid  26 and name HN    )  0.00  0.00  6.38
assign (resid  26 and name HN    )(resid  27 and name HB*   )  0.00  0.00  5.55
assign (resid  26 and name HB*   )(resid  27 and name HB*   )  0.00  0.00  7.91
assign (resid  27 and name HN    )(resid  28 and name HN    )  0.00  0.00  3.08
assign (resid  27 and name HB2   )(resid  28 and name HN    )  0.00  0.00  3.74
assign (resid  27 and name HB1   )(resid  28 and name HN    )  0.00  0.00  3.74
assign (resid  27 and name HB*   )(resid  28 and name HN    )  0.00  0.00  3.52
assign (resid  27 and name HD2   )(resid  28 and name HN    )  0.00  0.00  4.63
assign (resid  27 and name HD2   )(resid  28 and name HA    )  0.00  0.00  4.04
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 HG*   )  0.00  0.00  4.55
assign (resid  28 and name HN    )(resid  29 and name HN    )  0.00  0.00  3.14
assign (resid  28 and name HB2   )(resid  29 and name HN    )  0.00  0.00  3.71
assign (resid  28 and name HG*   )(resid  29 and name HN    )  0.00  0.00  6.38
assign (resid  29 and name HN    )(resid  30 and name HN    )  0.00  0.00  2.90
assign (resid  29 and name HA    )(resid  30 and name HN    )  0.00  0.00  3.58
assign (resid  29 and name HB*   )(resid  30 and name HD*   )  0.00  0.00  9.17
assign (resid  29 and name HB*   )(resid  30 and name HE*   )  0.00  0.00  8.54
assign (resid  30 and name HA    )(resid  31 and name HN    )  0.00  0.00  3.64
assign (resid  30 and name HB2   )(resid  31 and name HD*   )  0.00  0.00  7.95
assign (resid  30 and name HB2   )(resid  31 and name HE*   )  0.00  0.00  6.95
assign (resid  30 and name HB1   )(resid  31 and name HN    )  0.00  0.00  4.36
assign (resid  30 and name HB1   )(resid  31 and name HD*   )  0.00  0.00  8.14
assign (resid  30 and name HB1   )(resid  31 and name HE*   )  0.00  0.00  8.13
assign (resid  31 and name HA    )(resid  32 and name HN    )  0.00  0.00  3.55
assign (resid  31 and name HB2   )(resid  32 and name HN    )  0.00  0.00  4.08
assign (resid  31 and name HB1   )(resid  32 and name HN    )  0.00  0.00  4.54
assign (resid  33 and name HA    )(resid  34 and name HN    )  0.00  0.00  3.52
assign (resid  34 and name HN    )(resid  35 and name HN    )  0.00  0.00  3.95
assign (resid  34 and name HA    )(resid  35 and name HN    )  0.00  0.00  3.52
assign (resid  34 and name HB2   )(resid  35 and name HN    )  0.00  0.00  4.64
assign (resid  34 and name HB1   )(resid  35 and name HN    )  0.00  0.00  4.64
assign (resid  34 and name HB*   )(resid  35 and name HN    )  0.00  0.00  4.43
assign (resid  35 and name HA    )(resid  36 and name HN    )  0.00  0.00  2.59
assign (resid  35 and name HG*   )(resid  36 and name HN    )  0.00  0.00  6.16
! total in this range:     94
! range |i-j| =     2
assign (resid  10 and name HB*   )(resid  12 and name HN    )  0.00  0.00  6.66
assign (resid  10 and name HG*   )(resid  12 and name HA    )  0.00  0.00  6.38
assign (resid  12 and name HA    )(resid  14 and name HN    )  0.00  0.00  4.32
assign (resid  14 and name HB2   )(resid  16 and name HG2*  )  0.00  0.00  7.03
assign (resid  14 and name HB2   )(resid  16 and name HD*   )  0.00  0.00  5.48
assign (resid  14 and name HB1   )(resid  16 and name HG2*  )  0.00  0.00  7.03
assign (resid  14 and name HB1   )(resid  16 and name HD*   )  0.00  0.00  5.48
assign (resid  14 and name HB*   )(resid  16 and name HB    )  0.00  0.00  5.98
assign (resid  14 and name HB*   )(resid  16 and name HG2*  )  0.00  0.00  6.70
assign (resid  14 and name HB*   )(resid  16 and name HG1*  )  0.00  0.00  7.41
assign (resid  14 and name HB*   )(resid  16 and name HD*   )  0.00  0.00  4.99
assign (resid  16 and name HB    )(resid  18 and name HE*   )  0.00  0.00  7.01
assign (resid  16 and name HB    )(resid  18 and name HZ    )  0.00  0.00  5.26
assign (resid  16 and name HG2*  )(resid  18 and name HD*   )  0.00  0.00  8.65
assign (resid  16 and name HG2*  )(resid  18 and name HE*   )  0.00  0.00  7.29
assign (resid  16 and name HG2*  )(resid  18 and name HZ    )  0.00  0.00  4.64
assign (resid  16 and name HG1*  )(resid  18 and name HE*   )  0.00  0.00  7.54
assign (resid  16 and name HG1*  )(resid  18 and name HZ    )  0.00  0.00  6.38
assign (resid  16 and name HD*   )(resid  18 and name HE*   )  0.00  0.00  7.32
assign (resid  16 and name HD*   )(resid  18 and name HZ    )  0.00  0.00  4.51
assign (resid  18 and name HB2   )(resid  20 and name HN    )  0.00  0.00  3.61
assign (resid  18 and name HB1   )(resid  20 and name HN    )  0.00  0.00  3.92
assign (resid  22 and name HB*   )(resid  24 and name HN    )  0.00  0.00  5.26
assign (resid  23 and name HA    )(resid  25 and name HN    )  0.00  0.00  4.26
assign (resid  24 and name HA    )(resid  26 and name HN    )  0.00  0.00  3.98
assign (resid  25 and name HA    )(resid  27 and name HN    )  0.00  0.00  4.20
assign (resid  26 and name HN    )(resid  28 and name HN    )  0.00  0.00  4.66
assign (resid  27 and name HN    )(resid  29 and name HN    )  0.00  0.00  4.32
assign (resid  29 and name HN    )(resid  31 and name HN    )  0.00  0.00  4.32
! total in this range:     29
! range |i-j| =     3
assign (resid  20 and name HN    )(resid  23 and name HB    )  0.00  0.00  4.61
assign (resid  20 and name HB*   )(resid  23 and name HN    )  0.00  0.00  5.45
assign (resid  21 and name HA    )(resid  24 and name HB2   )  0.00  0.00  3.71
assign (resid  21 and name HA    )(resid  24 and name HB1   )  0.00  0.00  4.88
assign (resid  21 and name HA    )(resid  24 and name HG    )  0.00  0.00  5.50
assign (resid  21 and name HA    )(resid  24 and name HD1*  )  0.00  0.00  5.54
assign (resid  22 and name HA    )(resid  25 and name HN    )  0.00  0.00  3.39
assign (resid  22 and name HA    )(resid  25 and name HB2   )  0.00  0.00  3.55
assign (resid  22 and name HA    )(resid  25 and name HB1   )  0.00  0.00  3.55
assign (resid  22 and name HA    )(resid  25 and name HG*   )  0.00  0.00  5.95
assign (resid  22 and name HB*   )(resid  25 and name HN    )  0.00  0.00  5.36
assign (resid  25 and name HA    )(resid  28 and name HN    )  0.00  0.00  3.73
assign (resid  25 and name HA    )(resid  28 and name HB2   )  0.00  0.00  3.49
assign (resid  25 and name HA    )(resid  28 and name HB1   )  0.00  0.00  3.52
assign (resid  25 and name HA    )(resid  28 and name HG2   )  0.00  0.00  5.50
assign (resid  25 and name HA    )(resid  28 and name HG1   )  0.00  0.00  5.50
assign (resid  26 and name HN    )(resid  29 and name HB*   )  0.00  0.00  7.03
assign (resid  26 and name HA    )(resid  29 and name HN    )  0.00  0.00  3.45
assign (resid  26 and name HA    )(resid  29 and name HB*   )  0.00  0.00  5.01
assign (resid  26 and name HB*   )(resid  29 and name HB*   )  0.00  0.00  8.06
assign (resid  27 and name HA    )(resid  30 and name HN    )  0.00  0.00  3.83
assign (resid  32 and name HB*   )(resid  35 and name HB*   )  0.00  0.00  6.70
assign (resid  32 and name HB*   )(resid  35 and name HD*   )  0.00  0.00  7.76
! total in this range:     23
! range |i-j| =     4
assign (resid  25 and name HA    )(resid  29 and name HN    )  0.00  0.00  4.07
assign (resid  26 and name HA    )(resid  30 and name HD*   )  0.00  0.00  6.37
assign (resid  26 and name HA    )(resid  30 and name HE*   )  0.00  0.00  7.26
assign (resid  26 and name HB*   )(resid  30 and name HD*   )  0.00  0.00  7.96
assign (resid  26 and name HB*   )(resid  30 and name HE*   )  0.00  0.00  8.79
assign (resid  27 and name HA    )(resid  31 and name HN    )  0.00  0.00  3.14
assign (resid  27 and name HA    )(resid  31 and name HB2   )  0.00  0.00  3.40
assign (resid  27 and name HA    )(resid  31 and name HB1   )  0.00  0.00  4.33
assign (resid  27 and name HA    )(resid  31 and name HD*   )  0.00  0.00  5.78
assign (resid  27 and name HA    )(resid  31 and name HE*   )  0.00  0.00  7.63
assign (resid  27 and name HE1   )(resid  31 and name HB2   )  0.00  0.00  6.00
assign (resid  28 and name HA    )(resid  32 and name HB*   )  0.00  0.00  4.77
! total in this range:     12
! range |i-j| =     5
assign (resid  11 and name HB*   )(resid  16 and name HG2*  )  0.00  0.00  7.91
assign (resid  12 and name HA    )(resid  17 and name HB*   )  0.00  0.00  6.81
assign (resid  18 and name HB2   )(resid  23 and name HG2*  )  0.00  0.00  6.72
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  6.48
assign (resid  18 and name HE*   )(resid  23 and name HB    )  0.00  0.00  8.12
assign (resid  26 and name HB*   )(resid  31 and name HD*   )  0.00  0.00  9.17
assign (resid  26 and name HB*   )(resid  31 and name HE*   )  0.00  0.00  8.63
assign (resid  27 and name HD2   )(resid  32 and name HN    )  0.00  0.00  5.50
assign (resid  27 and name HD2   )(resid  32 and name HB2   )  0.00  0.00  6.00
assign (resid  27 and name HD2   )(resid  32 and name HB1   )  0.00  0.00  6.00
assign (resid  27 and name HD2   )(resid  32 and name HB*   )  0.00  0.00  5.83
assign (resid  27 and name HE1   )(resid  32 and name HB*   )  0.00  0.00  6.88
! total in this range:     13
! range |i-j| =     6
assign (resid  11 and name HN    )(resid  17 and name HA    )  0.00  0.00  3.11
assign (resid  11 and name HN    )(resid  17 and name HB*   )  0.00  0.00  6.25
assign (resid  18 and name HN    )(resid  24 and name HD1*  )  0.00  0.00  6.53
assign (resid  18 and name HN    )(resid  24 and name HD2*  )  0.00  0.00  6.50
assign (resid  18 and name HB2   )(resid  24 and name HN    )  0.00  0.00  5.29
assign (resid  18 and name HB2   )(resid  24 and name HB1   )  0.00  0.00  5.91
assign (resid  18 and name HB1   )(resid  24 and name HN    )  0.00  0.00  4.85
assign (resid  18 and name HB1   )(resid  24 and name HD1*  )  0.00  0.00  6.56
assign (resid  18 and name HD*   )(resid  24 and name HA    )  0.00  0.00  6.29
assign (resid  18 and name HD*   )(resid  24 and name HB2   )  0.00  0.00  7.75
assign (resid  18 and name HD*   )(resid  24 and name HD1*  )  0.00  0.00  8.65
assign (resid  18 and name HD*   )(resid  24 and name HD2*  )  0.00  0.00  6.45
assign (resid  18 and name HE*   )(resid  24 and name HD2*  )  0.00  0.00  7.78
! total in this range:     13
! range |i-j| =     7
assign (resid  10 and name HA    )(resid  17 and name HB*   )  0.00  0.00  5.38
assign (resid  10 and name HB*   )(resid  17 and name HB*   )  0.00  0.00  6.54
assign (resid  10 and name HG*   )(resid  17 and name HB*   )  0.00  0.00  7.90
assign (resid  11 and name HN    )(resid  18 and name HN    )  0.00  0.00  3.89
assign (resid  11 and name HN    )(resid  18 and name HD*   )  0.00  0.00  7.16
assign (resid  11 and name HN    )(resid  18 and name HE*   )  0.00  0.00  6.97
assign (resid  11 and name HB*   )(resid  18 and name HD*   )  0.00  0.00  9.00
assign (resid  11 and name HB*   )(resid  18 and name HE*   )  0.00  0.00  8.16
! total in this range:      8
! range |i-j| =     8
assign (resid   9 and name HB*   )(resid  17 and name HB*   )  0.00  0.00  7.90
assign (resid  10 and name HA    )(resid  18 and name HN    )  0.00  0.00  3.24
assign (resid  10 and name HA    )(resid  18 and name HD*   )  0.00  0.00  7.09
! total in this range:      3
! range |i-j| =     9
assign (resid   8 and name HD*   )(resid  17 and name HB*   )  0.00  0.00  7.90
assign (resid   9 and name HB*   )(resid  18 and name HN    )  0.00  0.00  5.92
assign (resid   9 and name HB*   )(resid  18 and name HB2   )  0.00  0.00  6.16
assign (resid   9 and name HB*   )(resid  18 and name HB1   )  0.00  0.00  5.54
assign (resid   9 and name HB*   )(resid  18 and name HD*   )  0.00  0.00  9.00
assign (resid   9 and name HE*   )(resid  18 and name HN    )  0.00  0.00  7.62
assign (resid  18 and name HD*   )(resid  27 and name HE1   )  0.00  0.00  7.62
assign (resid  18 and name HE*   )(resid  27 and name HN    )  0.00  0.00  7.62
assign (resid  18 and name HZ    )(resid  27 and name HB2   )  0.00  0.00  5.01
assign (resid  18 and name HZ    )(resid  27 and name HB1   )  0.00  0.00  5.01
assign (resid  18 and name HZ    )(resid  27 and name HB*   )  0.00  0.00  4.55
assign (resid  18 and name HZ    )(resid  27 and name HE1   )  0.00  0.00  4.94
! total in this range:     12
! range |i-j| =    11
assign (resid   9 and name HB*   )(resid  20 and name HN    )  0.00  0.00  6.54
assign (resid   9 and name HE*   )(resid  20 and name HN    )  0.00  0.00  7.62
assign (resid  16 and name HG2*  )(resid  27 and name HE1   )  0.00  0.00  6.53
assign (resid  16 and name HD*   )(resid  27 and name HE1   )  0.00  0.00  4.64
! total in this range:      4
! range |i-j| =    12
assign (resid   9 and name HB*   )(resid  21 and name HA    )  0.00  0.00  6.69
assign (resid   9 and name HD*   )(resid  21 and name HA    )  0.00  0.00  7.13
assign (resid   9 and name HD*   )(resid  21 and name HB2   )  0.00  0.00  8.12
assign (resid   9 and name HD*   )(resid  21 and name HB1   )  0.00  0.00  8.12
assign (resid   9 and name HD*   )(resid  21 and name HB*   )  0.00  0.00  7.84
assign (resid   9 and name HD*   )(resid  21 and name HG2   )  0.00  0.00  7.00
assign (resid   9 and name HD*   )(resid  21 and name HG1   )  0.00  0.00  7.00
assign (resid   9 and name HD*   )(resid  21 and name HG*   )  0.00  0.00  6.46
assign (resid   9 and name HD*   )(resid  21 and name HD2   )  0.00  0.00  6.54
assign (resid   9 and name HD*   )(resid  21 and name HD1   )  0.00  0.00  6.54
assign (resid   9 and name HD*   )(resid  21 and name HD*   )  0.00  0.00  6.13
assign (resid   9 and name HE*   )(resid  21 and name HA    )  0.00  0.00  7.13
assign (resid   9 and name HE*   )(resid  21 and name HB*   )  0.00  0.00  9.00
assign (resid   9 and name HE*   )(resid  21 and name HG*   )  0.00  0.00  8.50
assign (resid   9 and name HE*   )(resid  21 and name HD2   )  0.00  0.00  7.62
assign (resid   9 and name HE*   )(resid  21 and name HD1   )  0.00  0.00  7.62
assign (resid   9 and name HE*   )(resid  21 and name HD*   )  0.00  0.00  7.40
! total in this range:     17
! range |i-j| =    13
assign (resid  11 and name HN    )(resid  24 and name HD1*  )  0.00  0.00  6.53
assign (resid  11 and name HN    )(resid  24 and name HD2*  )  0.00  0.00  5.16
assign (resid  11 and name HB*   )(resid  24 and name HD2*  )  0.00  0.00  7.41
assign (resid  14 and name HB*   )(resid  27 and name HE1   )  0.00  0.00  6.88
! total in this range:      4
! range |i-j| =    14
assign (resid  10 and name HN    )(resid  24 and name HD1*  )  0.00  0.00  4.79
! total in this range:      1
! range |i-j| =    15
assign (resid   9 and name HA    )(resid  24 and name HB2   )  0.00  0.00  6.00
assign (resid   9 and name HA    )(resid  24 and name HG    )  0.00  0.00  5.50
assign (resid   9 and name HA    )(resid  24 and name HD1*  )  0.00  0.00  4.51
assign (resid   9 and name HA    )(resid  24 and name HD2*  )  0.00  0.00  4.61
assign (resid   9 and name HB*   )(resid  24 and name HB2   )  0.00  0.00  5.79
assign (resid   9 and name HB*   )(resid  24 and name HB1   )  0.00  0.00  5.79
assign (resid   9 and name HB*   )(resid  24 and name HD1*  )  0.00  0.00  5.73
assign (resid   9 and name HB*   )(resid  24 and name HD2*  )  0.00  0.00  7.90
assign (resid   9 and name HD*   )(resid  24 and name HD1*  )  0.00  0.00  8.65
assign (resid   9 and name HE*   )(resid  24 and name HD1*  )  0.00  0.00  7.07
assign (resid   9 and name HE*   )(resid  24 and name HD2*  )  0.00  0.00  8.65
! total in this range:     11
! range |i-j| =    16
assign (resid  11 and name HA    )(resid  27 and name HD2   )  0.00  0.00  5.50
assign (resid  11 and name HB2   )(resid  27 and name HD2   )  0.00  0.00  4.88
assign (resid  11 and name HB1   )(resid  27 and name HD2   )  0.00  0.00  4.88
assign (resid  11 and name HB*   )(resid  27 and name HD2   )  0.00  0.00  4.35
! total in this range:      4
! range |i-j| =    18
assign (resid  14 and name HB*   )(resid  32 and name HB*   )  0.00  0.00  6.76
! total in this range:      1
! total constraints:      324
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 -11.128  12.567   0.344
    2   2H    GLY   1          2HT       GLY   1 -10.473  13.058   1.824
    3   3H    GLY   1          3HT       GLY   1 -10.991  11.462   1.618
    4   1HA   GLY   1          1HA       GLY   1  -8.850  11.018   1.216
    5   2HA   GLY   1          2HA       GLY   1  -9.233  11.648  -0.379
    6    H    SER   2           H        SER   2  -7.492  12.760  -1.001
    7    HA   SER   2           HA       SER   2  -5.917  14.396  -1.095
    8   1HB   SER   2          2HB       SER   2  -8.062  15.525   0.413
    9   2HB   SER   2          1HB       SER   2  -6.545  16.054   1.139
   10    HG   SER   2           HG       SER   2  -7.456  17.327  -0.691
   11    H    LEU   3           H        LEU   3  -6.464  14.514   2.410
   12    HA   LEU   3           HA       LEU   3  -3.888  13.186   2.840
   13   1HB   LEU   3          2HB       LEU   3  -3.346  14.912   4.580
   14   2HB   LEU   3          1HB       LEU   3  -3.261  15.468   2.920
   15    HG   LEU   3           HG       LEU   3  -5.836  15.910   4.314
   16   1HD1  LEU   3          1HD1      LEU   3  -3.258  16.997   5.267
   17   2HD1  LEU   3          2HD1      LEU   3  -4.767  16.720   6.136
   18   3HD1  LEU   3          3HD1      LEU   3  -4.591  18.140   5.105
   19   1HD2  LEU   3          1HD2      LEU   3  -4.816  16.660   1.931
   20   2HD2  LEU   3          2HD2      LEU   3  -4.395  18.062   2.915
   21   3HD2  LEU   3          3HD2      LEU   3  -6.077  17.548   2.787
   22    H    LEU   4           H        LEU   4  -3.615  12.306   4.960
   23    HA   LEU   4           HA       LEU   4  -4.308  11.138   6.783
   24   1HB   LEU   4          2HB       LEU   4  -5.651  13.698   6.909
   25   2HB   LEU   4          1HB       LEU   4  -6.628  12.446   7.650
   26    HG   LEU   4           HG       LEU   4  -5.245  13.540   9.317
   27   1HD1  LEU   4          1HD1      LEU   4  -4.872  10.687   8.646
   28   2HD1  LEU   4          2HD1      LEU   4  -5.531  11.438  10.100
   29   3HD1  LEU   4          3HD1      LEU   4  -3.785  11.369   9.856
   30   1HD2  LEU   4          1HD2      LEU   4  -3.129  13.036   7.316
   31   2HD2  LEU   4          2HD2      LEU   4  -2.678  12.851   9.011
   32   3HD2  LEU   4          3HD2      LEU   4  -3.337  14.382   8.436
   33    H    LYS   5           H        LYS   5  -5.378  10.496   4.137
   34    HA   LYS   5           HA       LYS   5  -7.317   8.574   4.936
   35   1HB   LYS   5          2HB       LYS   5  -8.241  11.126   3.805
   36   2HB   LYS   5          1HB       LYS   5  -8.887   9.702   3.002
   37   1HG   LYS   5          2HG       LYS   5  -8.993   9.509   5.903
   38   2HG   LYS   5          1HG       LYS   5  -9.896  10.884   5.265
   39   1HD   LYS   5          2HD       LYS   5 -11.507   9.260   5.152
   40   2HD   LYS   5          1HD       LYS   5 -10.774   9.076   3.557
   41   1HE   LYS   5          2HE       LYS   5  -9.885   7.061   4.053
   42   2HE   LYS   5          1HE       LYS   5  -9.529   7.512   5.719
   43   1HZ   LYS   5          1HZ       LYS   5 -11.372   5.768   5.169
   44   2HZ   LYS   5          2HZ       LYS   5 -12.330   7.143   4.935
   45   3HZ   LYS   5          3HZ       LYS   5 -11.587   6.875   6.430
   46    HA   PRO   6           HA       PRO   6  -4.927   7.182   1.324
   47   1HB   PRO   6          2HB       PRO   6  -5.357   4.530   1.756
   48   2HB   PRO   6          1HB       PRO   6  -4.106   5.456   2.594
   49   1HG   PRO   6          2HG       PRO   6  -6.837   4.675   3.539
   50   2HG   PRO   6          1HG       PRO   6  -5.297   4.640   4.417
   51   1HD   PRO   6          2HD       PRO   6  -7.103   6.620   4.751
   52   2HD   PRO   6          1HD       PRO   6  -5.354   6.904   4.862
   53    H    ALA   7           H        ALA   7  -5.616   6.779  -0.702
   54    HA   ALA   7           HA       ALA   7  -8.166   5.458  -1.161
   55   1HB   ALA   7          1HB       ALA   7  -8.560   7.492  -2.860
   56   2HB   ALA   7          2HB       ALA   7  -7.709   8.347  -1.573
   57   3HB   ALA   7          3HB       ALA   7  -9.197   7.471  -1.215
   58    H    ARG   8           H        ARG   8  -5.378   4.830  -1.692
   59    HA   ARG   8           HA       ARG   8  -5.611   4.411  -4.577
   60   1HB   ARG   8          2HB       ARG   8  -3.299   5.714  -3.167
   61   2HB   ARG   8          1HB       ARG   8  -3.064   4.848  -4.679
   62   1HG   ARG   8          2HG       ARG   8  -5.026   7.102  -4.344
   63   2HG   ARG   8          1HG       ARG   8  -3.365   7.320  -4.898
   64   1HD   ARG   8          2HD       ARG   8  -4.462   5.235  -6.441
   65   2HD   ARG   8          1HD       ARG   8  -5.680   6.508  -6.380
   66    HE   ARG   8           HE       ARG   8  -3.148   6.593  -7.734
   67   1HH1  ARG   8          1HH1      ARG   8  -5.677   8.510  -6.284
   68   2HH1  ARG   8          2HH1      ARG   8  -5.318   9.921  -7.221
   69   1HH2  ARG   8          1HH2      ARG   8  -2.673   8.448  -8.969
   70   2HH2  ARG   8          2HH2      ARG   8  -3.613   9.886  -8.746
   71    H    PHE   9           H        PHE   9  -5.361   2.335  -5.027
   72    HA   PHE   9           HA       PHE   9  -3.827   0.663  -3.148
   73   1HB   PHE   9          2HB       PHE   9  -5.254  -1.213  -4.249
   74   2HB   PHE   9          1HB       PHE   9  -5.999  -0.172  -3.041
   75    HD1  PHE   9           1HD      PHE   9  -7.649   1.489  -3.676
   76    HD2  PHE   9           2HD      PHE   9  -5.893  -1.091  -6.568
   77    HE1  PHE   9           1HE      PHE   9  -9.417   2.089  -5.279
   78    HE2  PHE   9           2HE      PHE   9  -7.657  -0.497  -8.176
   79    HZ   PHE   9           HZ       PHE   9  -9.422   1.096  -7.533
   80    H    MET  10           H        MET  10  -1.966   1.458  -4.484
   81    HA   MET  10           HA       MET  10  -1.216  -0.571  -6.347
   82   1HB   MET  10          2HB       MET  10  -2.568   0.849  -7.833
   83   2HB   MET  10          1HB       MET  10  -1.576   2.238  -7.409
   84   1HG   MET  10          2HG       MET  10   0.393   0.940  -8.317
   85   2HG   MET  10          1HG       MET  10  -0.784  -0.196  -8.974
   86   1HE   MET  10          1HE       MET  10  -0.264  -0.227 -11.029
   87   2HE   MET  10          2HE       MET  10   0.272   1.098 -12.062
   88   3HE   MET  10          3HE       MET  10  -1.427   0.627 -12.043
   89    H    CYS  11           H        CYS  11   0.862  -0.930  -5.967
   90    HA   CYS  11           HA       CYS  11   2.456   1.152  -4.690
   91   1HB   CYS  11          2HB       CYS  11   2.287  -1.355  -3.956
   92   2HB   CYS  11          1HB       CYS  11   3.469  -1.616  -5.234
   93    H    LEU  12           H        LEU  12   2.870   2.519  -6.436
   94    HA   LEU  12           HA       LEU  12   3.766   1.803  -8.961
   95   1HB   LEU  12          2HB       LEU  12   4.872   4.247  -7.646
   96   2HB   LEU  12          1HB       LEU  12   4.329   4.025  -9.296
   97    HG   LEU  12           HG       LEU  12   2.002   3.669  -7.895
   98   1HD1  LEU  12          1HD1      LEU  12   2.472   4.357  -5.792
   99   2HD1  LEU  12          2HD1      LEU  12   2.186   5.944  -6.507
  100   3HD1  LEU  12          3HD1      LEU  12   3.835   5.353  -6.303
  101   1HD2  LEU  12          1HD2      LEU  12   1.824   6.272  -8.481
  102   2HD2  LEU  12          2HD2      LEU  12   1.747   5.004  -9.705
  103   3HD2  LEU  12          3HD2      LEU  12   3.260   5.866  -9.422
  104    HA   PRO  13           HA       PRO  13   8.319   2.232  -7.117
  105   1HB   PRO  13          2HB       PRO  13   7.754   1.137  -4.418
  106   2HB   PRO  13          1HB       PRO  13   8.844   2.441  -4.899
  107   1HG   PRO  13          2HG       PRO  13   6.540   2.971  -3.669
  108   2HG   PRO  13          1HG       PRO  13   7.145   4.015  -4.969
  109   1HD   PRO  13          2HD       PRO  13   4.992   1.939  -5.049
  110   2HD   PRO  13          1HD       PRO  13   5.054   3.530  -5.835
  111    H    CYS  14           H        CYS  14   5.932  -0.218  -6.730
  112    HA   CYS  14           HA       CYS  14   7.976  -2.311  -6.991
  113   1HB   CYS  14          2HB       CYS  14   5.256  -2.289  -5.712
  114   2HB   CYS  14          1HB       CYS  14   5.992  -3.794  -6.236
  115    H    GLY  15           H        GLY  15   5.076  -0.885  -8.286
  116   1HA   GLY  15          2HA       GLY  15   4.318  -0.981 -10.464
  117   2HA   GLY  15          1HA       GLY  15   5.504  -2.231 -10.773
  118    H    ILE  16           H        ILE  16   3.233  -2.399  -8.133
  119    HA   ILE  16           HA       ILE  16   1.710  -4.459  -9.588
  120    HB   ILE  16           HB       ILE  16   2.352  -4.622  -6.646
  121   1HG1  ILE  16          2HG1      ILE  16   3.662  -6.227  -8.844
  122   2HG1  ILE  16          1HG1      ILE  16   4.391  -4.783  -8.150
  123   1HG2  ILE  16          1HG2      ILE  16   0.583  -6.010  -6.839
  124   2HG2  ILE  16          2HG2      ILE  16   1.808  -7.132  -7.432
  125   3HG2  ILE  16          3HG2      ILE  16   0.808  -6.234  -8.574
  126   1HD1  ILE  16          1HD1      ILE  16   5.151  -7.023  -7.241
  127   2HD1  ILE  16          2HD1      ILE  16   3.572  -7.119  -6.461
  128   3HD1  ILE  16          3HD1      ILE  16   4.674  -5.802  -6.061
  129    H    ALA  17           H        ALA  17  -0.265  -3.644  -9.877
  130    HA   ALA  17           HA       ALA  17  -1.404  -1.806  -7.933
  131   1HB   ALA  17          1HB       ALA  17  -1.527  -1.837 -10.624
  132   2HB   ALA  17          2HB       ALA  17  -2.725  -1.049  -9.598
  133   3HB   ALA  17          3HB       ALA  17  -3.035  -2.664 -10.234
  134    H    PHE  18           H        PHE  18  -2.595  -2.496  -6.292
  135    HA   PHE  18           HA       PHE  18  -3.635  -5.185  -6.239
  136   1HB   PHE  18          2HB       PHE  18  -3.266  -2.953  -4.291
  137   2HB   PHE  18          1HB       PHE  18  -4.426  -4.207  -3.914
  138    HD1  PHE  18           1HD      PHE  18  -3.546  -6.665  -4.149
  139    HD2  PHE  18           2HD      PHE  18  -1.069  -3.237  -3.681
  140    HE1  PHE  18           1HE      PHE  18  -1.721  -8.100  -3.332
  141    HE2  PHE  18           2HE      PHE  18   0.760  -4.664  -2.863
  142    HZ   PHE  18           HZ       PHE  18   0.436  -7.099  -2.689
  143    H    SER  19           H        SER  19  -5.913  -4.790  -4.634
  144    HA   SER  19           HA       SER  19  -7.724  -3.031  -6.040
  145   1HB   SER  19          2HB       SER  19  -7.433  -5.488  -7.158
  146   2HB   SER  19          1HB       SER  19  -8.725  -5.813  -6.003
  147    HG   SER  19           HG       SER  19  -9.918  -4.137  -6.945
  148    H    SER  20           H        SER  20  -6.723  -3.463  -3.304
  149    HA   SER  20           HA       SER  20  -9.206  -3.191  -1.947
  150   1HB   SER  20          2HB       SER  20  -8.304  -5.821  -2.185
  151   2HB   SER  20          1HB       SER  20  -7.829  -5.340  -0.557
  152    HG   SER  20           HG       SER  20 -10.376  -5.594  -1.674
  153    HA   PRO  21           HA       PRO  21  -6.525  -0.671   0.521
  154   1HB   PRO  21          2HB       PRO  21  -8.075  -0.516   2.783
  155   2HB   PRO  21          1HB       PRO  21  -8.341   0.454   1.331
  156   1HG   PRO  21          2HG       PRO  21  -9.710  -2.055   2.210
  157   2HG   PRO  21          1HG       PRO  21 -10.404  -0.597   1.478
  158   1HD   PRO  21          2HD       PRO  21  -9.966  -2.827   0.043
  159   2HD   PRO  21          1HD       PRO  21  -9.758  -1.209  -0.659
  160    H    SER  22           H        SER  22  -8.132  -3.258   2.395
  161    HA   SER  22           HA       SER  22  -6.145  -3.511   4.348
  162   1HB   SER  22          2HB       SER  22  -8.404  -5.184   3.388
  163   2HB   SER  22          1HB       SER  22  -7.147  -6.014   4.305
  164    HG   SER  22           HG       SER  22  -8.886  -3.965   5.112
  165    H    THR  23           H        THR  23  -6.385  -4.821   1.118
  166    HA   THR  23           HA       THR  23  -4.370  -6.788   1.366
  167    HB   THR  23           HB       THR  23  -5.272  -5.281  -1.098
  168    HG1  THR  23           1HG      THR  23  -6.179  -7.663   0.124
  169   1HG2  THR  23          1HG2      THR  23  -4.468  -7.142  -2.386
  170   2HG2  THR  23          2HG2      THR  23  -3.923  -7.963  -0.923
  171   3HG2  THR  23          3HG2      THR  23  -3.144  -6.467  -1.437
  172    H    LEU  24           H        LEU  24  -4.324  -3.371   0.542
  173    HA   LEU  24           HA       LEU  24  -1.676  -3.158  -0.312
  174   1HB   LEU  24          2HB       LEU  24  -2.913  -1.001   1.345
  175   2HB   LEU  24          1HB       LEU  24  -1.917  -0.867  -0.084
  176    HG   LEU  24           HG       LEU  24  -4.829  -1.604   0.035
  177   1HD1  LEU  24          1HD1      LEU  24  -3.359   0.720  -1.199
  178   2HD1  LEU  24          2HD1      LEU  24  -4.386   0.769   0.234
  179   3HD1  LEU  24          3HD1      LEU  24  -5.090   0.412  -1.343
  180   1HD2  LEU  24          1HD2      LEU  24  -4.785  -1.880  -2.350
  181   2HD2  LEU  24          2HD2      LEU  24  -3.589  -2.965  -1.639
  182   3HD2  LEU  24          3HD2      LEU  24  -3.072  -1.466  -2.411
  183    H    GLU  25           H        GLU  25  -3.125  -2.953   2.887
  184    HA   GLU  25           HA       GLU  25  -0.767  -2.375   4.313
  185   1HB   GLU  25          2HB       GLU  25  -3.362  -2.476   4.997
  186   2HB   GLU  25          1HB       GLU  25  -2.854  -4.037   5.624
  187   1HG   GLU  25          2HG       GLU  25  -1.298  -1.580   6.296
  188   2HG   GLU  25          1HG       GLU  25  -2.797  -1.942   7.149
  189    H    ALA  26           H        ALA  26  -2.092  -5.319   3.055
  190    HA   ALA  26           HA       ALA  26  -0.527  -7.098   4.562
  191   1HB   ALA  26          1HB       ALA  26  -2.161  -8.367   3.696
  192   2HB   ALA  26          2HB       ALA  26  -1.109  -8.485   2.285
  193   3HB   ALA  26          3HB       ALA  26  -2.396  -7.280   2.327
  194    H    HIS  27           H        HIS  27  -0.164  -5.452   1.507
  195    HA   HIS  27           HA       HIS  27   2.231  -6.780   0.707
  196   1HB   HIS  27          2HB       HIS  27   0.824  -5.714  -0.956
  197   2HB   HIS  27          1HB       HIS  27   0.974  -4.162  -0.147
  198    HD1  HIS  27           1HD      HIS  27   2.974  -6.565  -2.275
  199    HD2  HIS  27           2HD      HIS  27   3.175  -2.685  -0.802
  200    HE1  HIS  27           1HE      HIS  27   4.911  -5.452  -3.463
  201    H    GLN  28           H        GLN  28   1.501  -3.619   2.109
  202    HA   GLN  28           HA       GLN  28   4.193  -2.811   2.452
  203   1HB   GLN  28          2HB       GLN  28   1.555  -1.796   3.076
  204   2HB   GLN  28          1HB       GLN  28   2.654  -1.526   4.420
  205   1HG   GLN  28          2HG       GLN  28   4.034  -0.822   2.066
  206   2HG   GLN  28          1HG       GLN  28   2.429  -0.103   1.966
  207   1HE2  GLN  28          1HE2      GLN  28   5.428  -0.200   3.718
  208   2HE2  GLN  28          2HE2      GLN  28   5.169   1.235   4.645
  209    H    ALA  29           H        ALA  29   2.256  -5.081   4.089
  210    HA   ALA  29           HA       ALA  29   3.393  -4.847   6.686
  211   1HB   ALA  29          1HB       ALA  29   1.564  -6.710   5.311
  212   2HB   ALA  29          2HB       ALA  29   1.417  -5.922   6.882
  213   3HB   ALA  29          3HB       ALA  29   2.442  -7.346   6.701
  214    H    TYR  30           H        TYR  30   3.825  -7.382   4.178
  215    HA   TYR  30           HA       TYR  30   6.597  -7.658   5.077
  216   1HB   TYR  30          2HB       TYR  30   4.474  -9.751   5.182
  217   2HB   TYR  30          1HB       TYR  30   6.123 -10.234   4.814
  218    HD1  TYR  30           1HD      TYR  30   4.144  -8.312   7.316
  219    HD2  TYR  30           2HD      TYR  30   7.615 -10.649   6.554
  220    HE1  TYR  30           1HE      TYR  30   4.668  -8.304   9.718
  221    HE2  TYR  30           2HE      TYR  30   8.149 -10.649   8.954
  222    HH   TYR  30           HH       TYR  30   6.701  -8.574  11.160
  223    H    TYR  31           H        TYR  31   4.804  -6.963   2.533
  224    HA   TYR  31           HA       TYR  31   6.209  -8.740   0.670
  225   1HB   TYR  31          2HB       TYR  31   3.589  -8.006   0.719
  226   2HB   TYR  31          1HB       TYR  31   4.245  -6.843  -0.428
  227    HD1  TYR  31           1HD      TYR  31   3.735 -10.427   0.258
  228    HD2  TYR  31           2HD      TYR  31   4.948  -7.531  -2.612
  229    HE1  TYR  31           1HE      TYR  31   3.652 -12.144  -1.498
  230    HE2  TYR  31           2HE      TYR  31   4.867  -9.240  -4.379
  231    HH   TYR  31           HH       TYR  31   3.308 -11.844  -4.351
  232    H    CYS  32           H        CYS  32   5.572  -5.297   1.264
  233    HA   CYS  32           HA       CYS  32   7.332  -4.425  -0.819
  234   1HB   CYS  32          2HB       CYS  32   5.313  -3.202   0.417
  235   2HB   CYS  32          1HB       CYS  32   6.622  -2.610   1.434
  236    H    SER  33           H        SER  33   9.436  -4.881  -0.658
  237    HA   SER  33           HA       SER  33  11.526  -5.193   0.216
  238   1HB   SER  33          2HB       SER  33  10.936  -2.689   1.795
  239   2HB   SER  33          1HB       SER  33  12.485  -3.226   1.146
  240    HG   SER  33           HG       SER  33  11.986  -2.061  -0.521
  241    H    HIS  34           H        HIS  34  12.714  -4.581   2.622
  242    HA   HIS  34           HA       HIS  34  11.306  -6.416   4.435
  243   1HB   HIS  34          2HB       HIS  34  14.232  -5.648   4.364
  244   2HB   HIS  34          1HB       HIS  34  13.505  -6.816   5.462
  245    HD1  HIS  34           1HD      HIS  34  13.677  -6.357   1.680
  246    HD2  HIS  34           2HD      HIS  34  13.848  -9.336   4.571
  247    HE1  HIS  34           1HE      HIS  34  14.077  -8.495   0.418
  248    HE2  HIS  34           2HE      HIS  34  14.266 -10.271   2.196
  249    H    ARG  35           H        ARG  35   9.944  -4.629   5.148
  250    HA   ARG  35           HA       ARG  35  11.148  -2.439   6.576
  251   1HB   ARG  35          2HB       ARG  35   9.046  -2.069   5.436
  252   2HB   ARG  35          1HB       ARG  35   8.282  -3.370   6.337
  253   1HG   ARG  35          2HG       ARG  35   7.498  -1.571   7.490
  254   2HG   ARG  35          1HG       ARG  35   8.970  -1.895   8.407
  255   1HD   ARG  35          2HD       ARG  35   8.975   0.425   8.026
  256   2HD   ARG  35          1HD       ARG  35  10.119  -0.241   6.861
  257    HE   ARG  35           HE       ARG  35   7.813  -0.155   5.461
  258   1HH1  ARG  35          1HH1      ARG  35   9.525   2.223   7.358
  259   2HH1  ARG  35          2HH1      ARG  35   8.965   3.562   6.414
  260   1HH2  ARG  35          1HH2      ARG  35   7.074   1.606   4.219
  261   2HH2  ARG  35          2HH2      ARG  35   7.572   3.212   4.633
  262    H    ILE  36           H        ILE  36  11.652  -2.348   8.675
  263    HA   ILE  36           HA       ILE  36  10.774  -4.573  10.398
  264    HB   ILE  36           HB       ILE  36  13.192  -4.584  10.003
  265   1HG1  ILE  36          2HG1      ILE  36  12.640  -3.668  12.829
  266   2HG1  ILE  36          1HG1      ILE  36  12.169  -5.253  12.223
  267   1HG2  ILE  36          1HG2      ILE  36  14.274  -2.515  11.404
  268   2HG2  ILE  36          2HG2      ILE  36  12.900  -1.737  10.619
  269   3HG2  ILE  36          3HG2      ILE  36  14.112  -2.573   9.649
  270   1HD1  ILE  36          1HD1      ILE  36  14.167  -6.005  12.785
  271   2HD1  ILE  36          2HD1      ILE  36  14.687  -4.383  13.243
  272   3HD1  ILE  36          3HD1      ILE  36  14.881  -4.934  11.579
  Start of MODEL    2
    1   1H    GLY   1          1HT       GLY   1  -8.871  10.321   1.604
    2   2H    GLY   1          2HT       GLY   1 -10.318  10.990   2.168
    3   3H    GLY   1          3HT       GLY   1  -8.842  11.516   2.801
    4   1HA   GLY   1          1HA       GLY   1  -9.125  11.769  -0.074
    5   2HA   GLY   1          2HA       GLY   1 -10.173  12.804   0.883
    6    H    SER   2           H        SER   2  -7.595  13.104  -0.823
    7    HA   SER   2           HA       SER   2  -5.825  14.525  -0.878
    8   1HB   SER   2          2HB       SER   2  -7.245  15.675   1.531
    9   2HB   SER   2          1HB       SER   2  -5.810  16.405   0.812
   10    HG   SER   2           HG       SER   2  -7.023  17.204  -0.696
   11    H    LEU   3           H        LEU   3  -6.143  14.451   2.654
   12    HA   LEU   3           HA       LEU   3  -3.748  12.771   2.820
   13   1HB   LEU   3          2HB       LEU   3  -2.855  14.285   4.603
   14   2HB   LEU   3          1HB       LEU   3  -2.824  14.951   2.982
   15    HG   LEU   3           HG       LEU   3  -5.242  15.628   4.506
   16   1HD1  LEU   3          1HD1      LEU   3  -2.522  16.510   5.440
   17   2HD1  LEU   3          2HD1      LEU   3  -3.805  15.748   6.382
   18   3HD1  LEU   3          3HD1      LEU   3  -4.003  17.400   5.796
   19   1HD2  LEU   3          1HD2      LEU   3  -4.069  16.521   2.247
   20   2HD2  LEU   3          2HD2      LEU   3  -3.445  17.690   3.413
   21   3HD2  LEU   3          3HD2      LEU   3  -5.186  17.478   3.220
   22    H    LEU   4           H        LEU   4  -3.310  12.263   5.244
   23    HA   LEU   4           HA       LEU   4  -3.999  11.198   7.131
   24   1HB   LEU   4          2HB       LEU   4  -5.483  13.590   6.982
   25   2HB   LEU   4          1HB       LEU   4  -6.617  12.343   7.465
   26    HG   LEU   4           HG       LEU   4  -5.699  13.408   9.427
   27   1HD1  LEU   4          1HD1      LEU   4  -5.093  10.580   8.835
   28   2HD1  LEU   4          2HD1      LEU   4  -6.091  11.288  10.104
   29   3HD1  LEU   4          3HD1      LEU   4  -4.336  11.268  10.272
   30   1HD2  LEU   4          1HD2      LEU   4  -3.149  13.002   7.989
   31   2HD2  LEU   4          2HD2      LEU   4  -3.113  12.802   9.741
   32   3HD2  LEU   4          3HD2      LEU   4  -3.665  14.322   9.038
   33    H    LYS   5           H        LYS   5  -4.668  10.095   4.538
   34    HA   LYS   5           HA       LYS   5  -6.412   8.022   5.387
   35   1HB   LYS   5          2HB       LYS   5  -7.517  10.218   3.714
   36   2HB   LYS   5          1HB       LYS   5  -7.981   8.574   3.296
   37   1HG   LYS   5          2HG       LYS   5  -8.300   8.713   6.053
   38   2HG   LYS   5          1HG       LYS   5  -8.894  10.261   5.452
   39   1HD   LYS   5          2HD       LYS   5 -10.771   9.298   4.749
   40   2HD   LYS   5          1HD       LYS   5  -9.848   8.180   3.743
   41   1HE   LYS   5          2HE       LYS   5 -10.033   6.491   5.226
   42   2HE   LYS   5          1HE       LYS   5  -9.867   7.560   6.618
   43   1HZ   LYS   5          1HZ       LYS   5 -12.291   6.844   5.111
   44   2HZ   LYS   5          2HZ       LYS   5 -12.229   8.315   5.943
   45   3HZ   LYS   5          3HZ       LYS   5 -12.036   6.860   6.783
   46    HA   PRO   6           HA       PRO   6  -3.789   6.278   2.212
   47   1HB   PRO   6          2HB       PRO   6  -4.529   3.702   2.502
   48   2HB   PRO   6          1HB       PRO   6  -3.496   4.523   3.678
   49   1HG   PRO   6          2HG       PRO   6  -6.438   3.978   3.795
   50   2HG   PRO   6          1HG       PRO   6  -5.218   3.811   5.071
   51   1HD   PRO   6          2HD       PRO   6  -6.887   5.955   4.875
   52   2HD   PRO   6          1HD       PRO   6  -5.257   6.054   5.573
   53    H    ALA   7           H        ALA   7  -5.348   7.541   0.744
   54    HA   ALA   7           HA       ALA   7  -7.370   5.891  -0.542
   55   1HB   ALA   7          1HB       ALA   7  -7.822   7.937  -1.878
   56   2HB   ALA   7          2HB       ALA   7  -6.534   8.752  -0.991
   57   3HB   ALA   7          3HB       ALA   7  -7.967   8.181  -0.137
   58    H    ARG   8           H        ARG   8  -5.100   4.608  -0.953
   59    HA   ARG   8           HA       ARG   8  -4.700   4.875  -3.810
   60   1HB   ARG   8          2HB       ARG   8  -2.974   6.351  -2.728
   61   2HB   ARG   8          1HB       ARG   8  -2.306   4.912  -1.971
   62   1HG   ARG   8          2HG       ARG   8  -1.346   4.187  -3.877
   63   2HG   ARG   8          1HG       ARG   8  -2.652   4.793  -4.897
   64   1HD   ARG   8          2HD       ARG   8  -0.882   6.753  -3.521
   65   2HD   ARG   8          1HD       ARG   8  -0.258   5.897  -4.930
   66    HE   ARG   8           HE       ARG   8  -2.257   7.961  -4.898
   67   1HH1  ARG   8          1HH1      ARG   8  -1.002   5.226  -6.664
   68   2HH1  ARG   8          2HH1      ARG   8  -1.615   5.770  -8.189
   69   1HH2  ARG   8          1HH2      ARG   8  -3.063   8.680  -6.903
   70   2HH2  ARG   8          2HH2      ARG   8  -2.785   7.730  -8.325
   71    H    PHE   9           H        PHE   9  -4.758   2.913  -4.671
   72    HA   PHE   9           HA       PHE   9  -3.854   0.633  -3.039
   73   1HB   PHE   9          2HB       PHE   9  -5.631  -0.639  -4.495
   74   2HB   PHE   9          1HB       PHE   9  -6.132   0.244  -3.058
   75    HD1  PHE   9           1HD      PHE   9  -8.199   1.170  -3.377
   76    HD2  PHE   9           2HD      PHE   9  -5.387   1.281  -6.568
   77    HE1  PHE   9           1HE      PHE   9  -9.790   2.474  -4.728
   78    HE2  PHE   9           2HE      PHE   9  -6.971   2.584  -7.925
   79    HZ   PHE   9           HZ       PHE   9  -9.176   3.183  -7.005
   80    H    MET  10           H        MET  10  -1.948   1.666  -4.494
   81    HA   MET  10           HA       MET  10  -1.376  -0.362  -6.432
   82   1HB   MET  10          2HB       MET  10  -2.758   1.740  -7.471
   83   2HB   MET  10          1HB       MET  10  -1.102   2.291  -7.690
   84   1HG   MET  10          2HG       MET  10  -0.942  -0.267  -8.590
   85   2HG   MET  10          1HG       MET  10  -2.584   0.172  -9.055
   86   1HE   MET  10          1HE       MET  10  -2.934   0.573 -11.214
   87   2HE   MET  10          2HE       MET  10  -2.107   1.694 -12.297
   88   3HE   MET  10          3HE       MET  10  -3.064   2.312 -10.951
   89    H    CYS  11           H        CYS  11   0.644  -0.855  -5.890
   90    HA   CYS  11           HA       CYS  11   2.406   1.156  -4.769
   91   1HB   CYS  11          2HB       CYS  11   2.145  -1.389  -4.100
   92   2HB   CYS  11          1HB       CYS  11   3.336  -1.618  -5.376
   93    H    LEU  12           H        LEU  12   2.734   2.509  -6.568
   94    HA   LEU  12           HA       LEU  12   3.528   1.757  -9.114
   95   1HB   LEU  12          2HB       LEU  12   4.720   4.197  -7.869
   96   2HB   LEU  12          1HB       LEU  12   4.109   3.965  -9.494
   97    HG   LEU  12           HG       LEU  12   1.825   3.669  -8.039
   98   1HD1  LEU  12          1HD1      LEU  12   2.172   5.947  -6.622
   99   2HD1  LEU  12          2HD1      LEU  12   3.747   5.181  -6.411
  100   3HD1  LEU  12          3HD1      LEU  12   2.279   4.324  -5.939
  101   1HD2  LEU  12          1HD2      LEU  12   3.110   5.869  -9.538
  102   2HD2  LEU  12          2HD2      LEU  12   1.709   6.292  -8.555
  103   3HD2  LEU  12          3HD2      LEU  12   1.567   5.058  -9.808
  104    HA   PRO  13           HA       PRO  13   8.158   2.149  -7.457
  105   1HB   PRO  13          2HB       PRO  13   7.678   1.085  -4.728
  106   2HB   PRO  13          1HB       PRO  13   8.776   2.362  -5.262
  107   1HG   PRO  13          2HG       PRO  13   6.532   2.954  -3.953
  108   2HG   PRO  13          1HG       PRO  13   7.105   3.969  -5.290
  109   1HD   PRO  13          2HD       PRO  13   4.911   1.935  -5.256
  110   2HD   PRO  13          1HD       PRO  13   4.974   3.513  -6.067
  111    H    CYS  14           H        CYS  14   5.758  -0.268  -6.946
  112    HA   CYS  14           HA       CYS  14   7.763  -2.389  -7.275
  113   1HB   CYS  14          2HB       CYS  14   5.096  -2.326  -5.889
  114   2HB   CYS  14          1HB       CYS  14   5.808  -3.842  -6.414
  115    H    GLY  15           H        GLY  15   4.834  -0.934  -8.464
  116   1HA   GLY  15          2HA       GLY  15   3.941  -1.059 -10.583
  117   2HA   GLY  15          1HA       GLY  15   5.136  -2.281 -10.961
  118    H    ILE  16           H        ILE  16   3.071  -2.560  -8.181
  119    HA   ILE  16           HA       ILE  16   1.501  -4.636  -9.566
  120    HB   ILE  16           HB       ILE  16   2.313  -4.770  -6.664
  121   1HG1  ILE  16          2HG1      ILE  16   3.502  -6.402  -8.907
  122   2HG1  ILE  16          1HG1      ILE  16   4.242  -4.913  -8.331
  123   1HG2  ILE  16          1HG2      ILE  16   0.246  -5.988  -7.789
  124   2HG2  ILE  16          2HG2      ILE  16   1.238  -6.774  -6.560
  125   3HG2  ILE  16          3HG2      ILE  16   1.502  -7.131  -8.268
  126   1HD1  ILE  16          1HD1      ILE  16   5.162  -5.951  -6.605
  127   2HD1  ILE  16          2HD1      ILE  16   4.664  -7.466  -7.358
  128   3HD1  ILE  16          3HD1      ILE  16   3.633  -6.700  -6.150
  129    H    ALA  17           H        ALA  17  -0.468  -3.767  -9.797
  130    HA   ALA  17           HA       ALA  17  -1.561  -1.976  -7.803
  131   1HB   ALA  17          1HB       ALA  17  -1.873  -1.561 -10.218
  132   2HB   ALA  17          2HB       ALA  17  -3.398  -1.670  -9.339
  133   3HB   ALA  17          3HB       ALA  17  -2.846  -3.028 -10.320
  134    H    PHE  18           H        PHE  18  -2.608  -2.686  -6.071
  135    HA   PHE  18           HA       PHE  18  -3.617  -5.386  -5.949
  136   1HB   PHE  18          2HB       PHE  18  -3.086  -3.175  -4.029
  137   2HB   PHE  18          1HB       PHE  18  -4.275  -4.381  -3.578
  138    HD1  PHE  18           1HD      PHE  18  -3.596  -6.769  -3.385
  139    HD2  PHE  18           2HD      PHE  18  -0.777  -3.643  -4.008
  140    HE1  PHE  18           1HE      PHE  18  -1.783  -8.266  -2.661
  141    HE2  PHE  18           2HE      PHE  18   1.042  -5.134  -3.285
  142    HZ   PHE  18           HZ       PHE  18   0.542  -7.448  -2.612
  143    H    SER  19           H        SER  19  -4.902  -2.091  -5.622
  144    HA   SER  19           HA       SER  19  -6.996  -1.230  -5.824
  145   1HB   SER  19          2HB       SER  19  -7.517  -3.682  -7.520
  146   2HB   SER  19          1HB       SER  19  -8.431  -2.174  -7.545
  147    HG   SER  19           HG       SER  19  -6.893  -2.277  -9.237
  148    H    SER  20           H        SER  20  -6.551  -2.741  -3.507
  149    HA   SER  20           HA       SER  20  -9.236  -3.237  -2.713
  150   1HB   SER  20          2HB       SER  20  -7.428  -5.543  -3.284
  151   2HB   SER  20          1HB       SER  20  -8.516  -5.654  -1.900
  152    HG   SER  20           HG       SER  20 -10.193  -4.988  -3.491
  153    HA   PRO  21           HA       PRO  21  -7.029  -1.470   0.823
  154   1HB   PRO  21          2HB       PRO  21  -9.661  -2.201   2.036
  155   2HB   PRO  21          1HB       PRO  21  -8.738  -0.699   2.174
  156   1HG   PRO  21          2HG       PRO  21 -10.871  -0.833   0.590
  157   2HG   PRO  21          1HG       PRO  21  -9.427   0.070   0.096
  158   1HD   PRO  21          2HD       PRO  21 -10.419  -2.578  -0.841
  159   2HD   PRO  21          1HD       PRO  21  -9.542  -1.319  -1.732
  160    H    SER  22           H        SER  22  -6.648  -2.232   3.099
  161    HA   SER  22           HA       SER  22  -6.022  -3.818   4.615
  162   1HB   SER  22          2HB       SER  22  -8.429  -4.636   4.185
  163   2HB   SER  22          1HB       SER  22  -7.693  -5.854   3.143
  164    HG   SER  22           HG       SER  22  -8.050  -6.125   5.644
  165    H    THR  23           H        THR  23  -6.417  -5.596   1.535
  166    HA   THR  23           HA       THR  23  -4.156  -7.193   1.796
  167    HB   THR  23           HB       THR  23  -4.928  -6.200  -0.915
  168    HG1  THR  23           1HG      THR  23  -6.944  -6.494  -0.375
  169   1HG2  THR  23          1HG2      THR  23  -5.077  -9.025  -0.570
  170   2HG2  THR  23          2HG2      THR  23  -3.547  -8.433   0.077
  171   3HG2  THR  23          3HG2      THR  23  -3.994  -8.080  -1.592
  172    H    LEU  24           H        LEU  24  -4.500  -3.882   0.810
  173    HA   LEU  24           HA       LEU  24  -1.989  -3.502  -0.396
  174   1HB   LEU  24          2HB       LEU  24  -3.320  -1.354   1.208
  175   2HB   LEU  24          1HB       LEU  24  -2.454  -1.226  -0.306
  176    HG   LEU  24           HG       LEU  24  -5.208  -2.394   0.044
  177   1HD1  LEU  24          1HD1      LEU  24  -4.296   0.211  -1.165
  178   2HD1  LEU  24          2HD1      LEU  24  -5.197   0.011   0.338
  179   3HD1  LEU  24          3HD1      LEU  24  -5.945  -0.415  -1.202
  180   1HD2  LEU  24          1HD2      LEU  24  -4.963  -1.965  -2.591
  181   2HD2  LEU  24          2HD2      LEU  24  -4.573  -3.504  -1.823
  182   3HD2  LEU  24          3HD2      LEU  24  -3.288  -2.357  -2.201
  183    H    GLU  25           H        GLU  25  -3.166  -3.161   2.899
  184    HA   GLU  25           HA       GLU  25  -0.723  -2.284   4.029
  185   1HB   GLU  25          2HB       GLU  25  -3.238  -2.413   4.957
  186   2HB   GLU  25          1HB       GLU  25  -2.607  -3.878   5.692
  187   1HG   GLU  25          2HG       GLU  25  -1.146  -2.734   7.043
  188   2HG   GLU  25          1HG       GLU  25  -1.069  -1.342   5.964
  189    H    ALA  26           H        ALA  26  -1.970  -5.388   3.153
  190    HA   ALA  26           HA       ALA  26  -0.283  -6.982   4.713
  191   1HB   ALA  26          1HB       ALA  26  -2.162  -7.385   2.522
  192   2HB   ALA  26          2HB       ALA  26  -1.830  -8.398   3.926
  193   3HB   ALA  26          3HB       ALA  26  -0.803  -8.509   2.497
  194    H    HIS  27           H        HIS  27  -0.038  -5.586   1.510
  195    HA   HIS  27           HA       HIS  27   2.429  -6.807   0.801
  196   1HB   HIS  27          2HB       HIS  27   0.972  -5.935  -0.927
  197   2HB   HIS  27          1HB       HIS  27   1.021  -4.328  -0.219
  198    HD1  HIS  27           1HD      HIS  27   3.173  -6.730  -2.191
  199    HD2  HIS  27           2HD      HIS  27   3.131  -2.761  -0.962
  200    HE1  HIS  27           1HE      HIS  27   5.044  -5.579  -3.443
  201    H    GLN  28           H        GLN  28   1.542  -3.594   1.972
  202    HA   GLN  28           HA       GLN  28   4.198  -2.645   2.251
  203   1HB   GLN  28          2HB       GLN  28   1.501  -1.704   2.819
  204   2HB   GLN  28          1HB       GLN  28   2.641  -1.215   4.064
  205   1HG   GLN  28          2HG       GLN  28   4.103  -0.465   2.057
  206   2HG   GLN  28          1HG       GLN  28   2.582  -0.510   1.167
  207   1HE2  GLN  28          1HE2      GLN  28   1.588   1.359   1.070
  208   2HE2  GLN  28          2HE2      GLN  28   1.642   2.613   2.257
  209    H    ALA  29           H        ALA  29   2.392  -4.885   4.036
  210    HA   ALA  29           HA       ALA  29   3.483  -4.352   6.621
  211   1HB   ALA  29          1HB       ALA  29   1.714  -6.386   5.421
  212   2HB   ALA  29          2HB       ALA  29   1.543  -5.467   6.916
  213   3HB   ALA  29          3HB       ALA  29   2.610  -6.869   6.861
  214    H    TYR  30           H        TYR  30   4.018  -7.054   4.316
  215    HA   TYR  30           HA       TYR  30   6.784  -7.183   5.272
  216   1HB   TYR  30          2HB       TYR  30   4.715  -9.309   5.529
  217   2HB   TYR  30          1HB       TYR  30   6.363  -9.797   5.160
  218    HD1  TYR  30           1HD      TYR  30   4.169  -8.275   7.670
  219    HD2  TYR  30           2HD      TYR  30   8.134  -9.545   6.796
  220    HE1  TYR  30           1HE      TYR  30   4.740  -8.110  10.055
  221    HE2  TYR  30           2HE      TYR  30   8.717  -9.383   9.180
  222    HH   TYR  30           HH       TYR  30   6.507  -9.216  11.607
  223    H    TYR  31           H        TYR  31   4.989  -6.755   2.653
  224    HA   TYR  31           HA       TYR  31   6.505  -8.600   0.951
  225   1HB   TYR  31          2HB       TYR  31   3.845  -7.896   0.906
  226   2HB   TYR  31          1HB       TYR  31   4.525  -6.909  -0.385
  227    HD1  TYR  31           1HD      TYR  31   3.340 -10.137   0.540
  228    HD2  TYR  31           2HD      TYR  31   5.935  -8.124  -2.164
  229    HE1  TYR  31           1HE      TYR  31   3.294 -12.092  -0.948
  230    HE2  TYR  31           2HE      TYR  31   5.895 -10.073  -3.663
  231    HH   TYR  31           HH       TYR  31   4.564 -13.100  -2.710
  232    H    CYS  32           H        CYS  32   5.699  -5.154   1.255
  233    HA   CYS  32           HA       CYS  32   7.482  -4.371  -0.846
  234   1HB   CYS  32          2HB       CYS  32   5.372  -3.148   0.225
  235   2HB   CYS  32          1HB       CYS  32   6.616  -2.419   1.234
  236    H    SER  33           H        SER  33   9.484  -5.273  -0.277
  237    HA   SER  33           HA       SER  33  11.625  -5.077   0.489
  238   1HB   SER  33          2HB       SER  33  10.773  -2.536   0.751
  239   2HB   SER  33          1HB       SER  33  11.037  -2.928   2.451
  240    HG   SER  33           HG       SER  33  12.947  -3.278   0.380
  241    H    HIS  34           H        HIS  34  12.690  -4.683   2.956
  242    HA   HIS  34           HA       HIS  34  11.282  -6.694   4.582
  243   1HB   HIS  34          2HB       HIS  34  14.228  -6.056   4.366
  244   2HB   HIS  34          1HB       HIS  34  13.551  -7.148   5.569
  245    HD1  HIS  34           1HD      HIS  34  14.381  -6.898   1.944
  246    HD2  HIS  34           2HD      HIS  34  12.706  -9.642   4.577
  247    HE1  HIS  34           1HE      HIS  34  14.320  -9.078   0.693
  248    HE2  HIS  34           2HE      HIS  34  13.394 -10.744   2.341
  249    H    ARG  35           H        ARG  35  10.000  -5.002   5.551
  250    HA   ARG  35           HA       ARG  35  11.295  -2.949   7.093
  251   1HB   ARG  35          2HB       ARG  35   9.140  -2.472   6.113
  252   2HB   ARG  35          1HB       ARG  35   8.415  -3.848   6.931
  253   1HG   ARG  35          2HG       ARG  35   8.618  -2.791   9.055
  254   2HG   ARG  35          1HG       ARG  35   9.602  -1.493   8.377
  255   1HD   ARG  35          2HD       ARG  35   6.825  -2.001   7.375
  256   2HD   ARG  35          1HD       ARG  35   7.097  -1.058   8.838
  257    HE   ARG  35           HE       ARG  35   8.040   0.639   7.561
  258   1HH1  ARG  35          1HH1      ARG  35   7.249  -2.114   5.556
  259   2HH1  ARG  35          2HH1      ARG  35   7.413  -1.234   4.074
  260   1HH2  ARG  35          1HH2      ARG  35   8.261   1.787   5.612
  261   2HH2  ARG  35          2HH2      ARG  35   7.989   0.977   4.104
  262    H    ILE  36           H        ILE  36  11.962  -3.065   9.136
  263    HA   ILE  36           HA       ILE  36  10.850  -5.127  10.898
  264    HB   ILE  36           HB       ILE  36  12.931  -6.052   9.978
  265   1HG1  ILE  36          2HG1      ILE  36  13.363  -5.246  12.858
  266   2HG1  ILE  36          1HG1      ILE  36  12.180  -6.455  12.366
  267   1HG2  ILE  36          1HG2      ILE  36  14.656  -4.138  11.402
  268   2HG2  ILE  36          2HG2      ILE  36  13.872  -3.527   9.946
  269   3HG2  ILE  36          3HG2      ILE  36  14.898  -4.960   9.861
  270   1HD1  ILE  36          1HD1      ILE  36  13.735  -8.024  12.222
  271   2HD1  ILE  36          2HD1      ILE  36  14.839  -6.886  12.994
  272   3HD1  ILE  36          3HD1      ILE  36  14.778  -7.001  11.235
  Start of MODEL    3
    1   1H    GLY   1          1HT       GLY   1  -8.456  10.591   2.123
    2   2H    GLY   1          2HT       GLY   1  -9.991  11.267   2.336
    3   3H    GLY   1          3HT       GLY   1  -8.636  12.015   3.019
    4   1HA   GLY   1          1HA       GLY   1  -8.647  11.617   0.123
    5   2HA   GLY   1          2HA       GLY   1  -9.701  12.861   0.776
    6    H    SER   2           H        SER   2  -7.266  13.031  -0.910
    7    HA   SER   2           HA       SER   2  -5.482  14.415  -1.164
    8   1HB   SER   2          2HB       SER   2  -6.709  15.710   1.277
    9   2HB   SER   2          1HB       SER   2  -5.321  16.379   0.418
   10    HG   SER   2           HG       SER   2  -7.966  16.020  -0.509
   11    H    LEU   3           H        LEU   3  -5.546  14.529   2.381
   12    HA   LEU   3           HA       LEU   3  -3.136  12.855   2.446
   13   1HB   LEU   3          2HB       LEU   3  -2.196  14.421   4.174
   14   2HB   LEU   3          1HB       LEU   3  -2.234  15.041   2.534
   15    HG   LEU   3           HG       LEU   3  -4.546  15.706   4.271
   16   1HD1  LEU   3          1HD1      LEU   3  -1.757  16.479   4.856
   17   2HD1  LEU   3          2HD1      LEU   3  -3.152  16.352   5.928
   18   3HD1  LEU   3          3HD1      LEU   3  -2.959  17.768   4.895
   19   1HD2  LEU   3          1HD2      LEU   3  -3.834  16.403   1.777
   20   2HD2  LEU   3          2HD2      LEU   3  -3.080  17.713   2.685
   21   3HD2  LEU   3          3HD2      LEU   3  -4.812  17.424   2.831
   22    H    LEU   4           H        LEU   4  -2.558  12.656   4.995
   23    HA   LEU   4           HA       LEU   4  -3.136  11.765   7.006
   24   1HB   LEU   4          2HB       LEU   4  -5.032  13.745   6.564
   25   2HB   LEU   4          1HB       LEU   4  -5.990  12.332   6.963
   26    HG   LEU   4           HG       LEU   4  -5.480  13.726   8.932
   27   1HD1  LEU   4          1HD1      LEU   4  -5.527  11.047   8.787
   28   2HD1  LEU   4          2HD1      LEU   4  -5.331  11.936  10.297
   29   3HD1  LEU   4          3HD1      LEU   4  -3.918  11.283   9.469
   30   1HD2  LEU   4          1HD2      LEU   4  -3.051  14.119   7.848
   31   2HD2  LEU   4          2HD2      LEU   4  -2.667  12.841   9.001
   32   3HD2  LEU   4          3HD2      LEU   4  -3.402  14.342   9.562
   33    H    LYS   5           H        LYS   5  -6.200  11.376   5.229
   34    HA   LYS   5           HA       LYS   5  -6.103   8.515   5.802
   35   1HB   LYS   5          2HB       LYS   5  -8.295  10.322   4.789
   36   2HB   LYS   5          1HB       LYS   5  -8.468   8.575   4.889
   37   1HG   LYS   5          2HG       LYS   5  -7.881   8.811   7.348
   38   2HG   LYS   5          1HG       LYS   5  -8.130  10.544   7.127
   39   1HD   LYS   5          2HD       LYS   5 -10.260  10.053   7.676
   40   2HD   LYS   5          1HD       LYS   5 -10.378   9.564   5.985
   41   1HE   LYS   5          2HE       LYS   5  -9.513   7.269   6.919
   42   2HE   LYS   5          1HE       LYS   5 -10.155   7.887   8.440
   43   1HZ   LYS   5          1HZ       LYS   5 -11.902   8.109   6.128
   44   2HZ   LYS   5          2HZ       LYS   5 -12.269   7.698   7.727
   45   3HZ   LYS   5          3HZ       LYS   5 -11.612   6.537   6.686
   46    HA   PRO   6           HA       PRO   6  -4.678   7.343   1.778
   47   1HB   PRO   6          2HB       PRO   6  -6.608   5.095   2.048
   48   2HB   PRO   6          1HB       PRO   6  -4.875   5.055   1.707
   49   1HG   PRO   6          2HG       PRO   6  -5.805   4.380   4.109
   50   2HG   PRO   6          1HG       PRO   6  -4.297   5.297   3.939
   51   1HD   PRO   6          2HD       PRO   6  -7.012   6.244   4.749
   52   2HD   PRO   6          1HD       PRO   6  -5.416   6.745   5.345
   53    H    ALA   7           H        ALA   7  -5.957   6.111  -0.224
   54    HA   ALA   7           HA       ALA   7  -8.590   7.135  -0.699
   55   1HB   ALA   7          1HB       ALA   7  -7.562   8.378  -2.832
   56   2HB   ALA   7          2HB       ALA   7  -6.230   8.608  -1.700
   57   3HB   ALA   7          3HB       ALA   7  -7.844   9.190  -1.292
   58    H    ARG   8           H        ARG   8  -5.798   6.522  -2.828
   59    HA   ARG   8           HA       ARG   8  -7.391   4.470  -4.193
   60   1HB   ARG   8          2HB       ARG   8  -5.717   4.708  -6.018
   61   2HB   ARG   8          1HB       ARG   8  -6.587   6.194  -5.667
   62   1HG   ARG   8          2HG       ARG   8  -4.721   7.284  -5.140
   63   2HG   ARG   8          1HG       ARG   8  -4.130   5.959  -4.136
   64   1HD   ARG   8          2HD       ARG   8  -2.645   6.441  -6.043
   65   2HD   ARG   8          1HD       ARG   8  -3.296   4.802  -6.086
   66    HE   ARG   8           HE       ARG   8  -4.999   6.382  -7.597
   67   1HH1  ARG   8          1HH1      ARG   8  -1.656   5.380  -7.690
   68   2HH1  ARG   8          2HH1      ARG   8  -1.551   5.460  -9.416
   69   1HH2  ARG   8          1HH2      ARG   8  -4.861   6.486  -9.867
   70   2HH2  ARG   8          2HH2      ARG   8  -3.370   6.088 -10.653
   71    H    PHE   9           H        PHE   9  -5.825   2.756  -5.263
   72    HA   PHE   9           HA       PHE   9  -4.100   1.713  -3.113
   73   1HB   PHE   9          2HB       PHE   9  -5.108  -0.298  -4.983
   74   2HB   PHE   9          1HB       PHE   9  -5.103  -0.301  -3.225
   75    HD1  PHE   9           1HD      PHE   9  -6.952   0.830  -1.994
   76    HD2  PHE   9           2HD      PHE   9  -7.049   0.230  -6.206
   77    HE1  PHE   9           1HE      PHE   9  -9.384   1.203  -1.987
   78    HE2  PHE   9           2HE      PHE   9  -9.481   0.601  -6.207
   79    HZ   PHE   9           HZ       PHE   9 -10.652   1.088  -4.095
   80    H    MET  10           H        MET  10  -3.120  -0.484  -4.669
   81    HA   MET  10           HA       MET  10  -1.562  -1.059  -6.228
   82   1HB   MET  10          2HB       MET  10  -2.979   0.253  -7.830
   83   2HB   MET  10          1HB       MET  10  -1.990   1.661  -7.474
   84   1HG   MET  10          2HG       MET  10  -0.370  -0.619  -8.197
   85   2HG   MET  10          1HG       MET  10  -1.552  -0.231  -9.446
   86   1HE   MET  10          1HE       MET  10   0.525  -0.050 -10.891
   87   2HE   MET  10          2HE       MET  10   1.245   1.526 -11.218
   88   3HE   MET  10          3HE       MET  10  -0.482   1.275 -11.473
   89    H    CYS  11           H        CYS  11   0.582  -1.098  -6.019
   90    HA   CYS  11           HA       CYS  11   1.843   1.044  -4.482
   91   1HB   CYS  11          2HB       CYS  11   2.012  -1.540  -4.017
   92   2HB   CYS  11          1HB       CYS  11   3.253  -1.483  -5.263
   93    H    LEU  12           H        LEU  12   2.111   2.622  -6.059
   94    HA   LEU  12           HA       LEU  12   3.029   2.344  -8.638
   95   1HB   LEU  12          2HB       LEU  12   4.008   4.653  -7.015
   96   2HB   LEU  12          1HB       LEU  12   3.433   4.622  -8.669
   97    HG   LEU  12           HG       LEU  12   1.171   3.925  -7.318
   98   1HD1  LEU  12          1HD1      LEU  12   1.319   5.999  -5.584
   99   2HD1  LEU  12          2HD1      LEU  12   2.947   5.333  -5.453
  100   3HD1  LEU  12          3HD1      LEU  12   1.548   4.308  -5.138
  101   1HD2  LEU  12          1HD2      LEU  12   2.275   6.431  -8.442
  102   2HD2  LEU  12          2HD2      LEU  12   0.814   6.562  -7.463
  103   3HD2  LEU  12          3HD2      LEU  12   0.829   5.525  -8.890
  104    HA   PRO  13           HA       PRO  13   7.570   2.551  -7.182
  105   1HB   PRO  13          2HB       PRO  13   8.190   2.510  -4.583
  106   2HB   PRO  13          1HB       PRO  13   7.663   4.001  -5.374
  107   1HG   PRO  13          2HG       PRO  13   6.117   2.133  -3.625
  108   2HG   PRO  13          1HG       PRO  13   6.099   3.904  -3.665
  109   1HD   PRO  13          2HD       PRO  13   4.220   2.277  -4.878
  110   2HD   PRO  13          1HD       PRO  13   4.549   3.959  -5.336
  111    H    CYS  14           H        CYS  14   6.161   0.253  -7.732
  112    HA   CYS  14           HA       CYS  14   7.875  -1.751  -6.576
  113   1HB   CYS  14          2HB       CYS  14   5.199  -1.344  -5.577
  114   2HB   CYS  14          1HB       CYS  14   5.345  -2.937  -6.308
  115    H    GLY  15           H        GLY  15   4.977  -1.170  -8.533
  116   1HA   GLY  15          2HA       GLY  15   5.156  -1.606 -10.929
  117   2HA   GLY  15          1HA       GLY  15   6.046  -3.050 -10.500
  118    H    ILE  16           H        ILE  16   4.143  -3.566  -8.241
  119    HA   ILE  16           HA       ILE  16   2.226  -5.068  -9.803
  120    HB   ILE  16           HB       ILE  16   2.446  -4.924  -6.796
  121   1HG1  ILE  16          2HG1      ILE  16   3.528  -7.277  -8.206
  122   2HG1  ILE  16          1HG1      ILE  16   4.444  -5.793  -8.444
  123   1HG2  ILE  16          1HG2      ILE  16   1.007  -6.711  -8.716
  124   2HG2  ILE  16          2HG2      ILE  16   0.397  -5.896  -7.277
  125   3HG2  ILE  16          3HG2      ILE  16   1.463  -7.291  -7.114
  126   1HD1  ILE  16          1HD1      ILE  16   5.217  -7.222  -6.557
  127   2HD1  ILE  16          2HD1      ILE  16   3.694  -6.868  -5.742
  128   3HD1  ILE  16          3HD1      ILE  16   4.822  -5.564  -6.111
  129    H    ALA  17           H        ALA  17  -0.074  -5.044  -9.344
  130    HA   ALA  17           HA       ALA  17  -1.049  -2.474  -8.293
  131   1HB   ALA  17          1HB       ALA  17  -0.981  -2.926 -10.931
  132   2HB   ALA  17          2HB       ALA  17  -2.235  -1.962 -10.152
  133   3HB   ALA  17          3HB       ALA  17  -2.543  -3.651 -10.555
  134    H    PHE  18           H        PHE  18  -2.262  -2.901  -6.571
  135    HA   PHE  18           HA       PHE  18  -3.565  -5.448  -6.246
  136   1HB   PHE  18          2HB       PHE  18  -3.076  -3.033  -4.548
  137   2HB   PHE  18          1HB       PHE  18  -4.289  -4.196  -4.066
  138    HD1  PHE  18           1HD      PHE  18  -3.657  -6.485  -3.455
  139    HD2  PHE  18           2HD      PHE  18  -0.745  -3.543  -4.442
  140    HE1  PHE  18           1HE      PHE  18  -1.902  -7.891  -2.454
  141    HE2  PHE  18           2HE      PHE  18   1.014  -4.943  -3.444
  142    HZ   PHE  18           HZ       PHE  18   0.437  -7.120  -2.449
  143    H    SER  19           H        SER  19  -5.823  -4.815  -4.833
  144    HA   SER  19           HA       SER  19  -7.455  -2.973  -6.346
  145   1HB   SER  19          2HB       SER  19  -7.448  -5.095  -7.700
  146   2HB   SER  19          1HB       SER  19  -8.203  -5.905  -6.327
  147    HG   SER  19           HG       SER  19  -9.663  -5.071  -7.989
  148    H    SER  20           H        SER  20  -6.562  -3.394  -3.577
  149    HA   SER  20           HA       SER  20  -9.053  -2.912  -2.291
  150   1HB   SER  20          2HB       SER  20  -7.889  -5.610  -2.167
  151   2HB   SER  20          1HB       SER  20  -8.277  -4.917  -0.591
  152    HG   SER  20           HG       SER  20 -10.398  -4.477  -1.482
  153    HA   PRO  21           HA       PRO  21  -6.251  -0.562   0.199
  154   1HB   PRO  21          2HB       PRO  21  -7.831  -0.149   2.385
  155   2HB   PRO  21          1HB       PRO  21  -8.023   0.727   0.864
  156   1HG   PRO  21          2HG       PRO  21  -9.544  -1.635   1.896
  157   2HG   PRO  21          1HG       PRO  21 -10.150  -0.187   1.069
  158   1HD   PRO  21          2HD       PRO  21  -9.814  -2.537  -0.213
  159   2HD   PRO  21          1HD       PRO  21  -9.557  -0.977  -1.019
  160    H    SER  22           H        SER  22  -8.107  -2.990   2.051
  161    HA   SER  22           HA       SER  22  -6.278  -3.289   4.140
  162   1HB   SER  22          2HB       SER  22  -7.474  -5.266   4.732
  163   2HB   SER  22          1HB       SER  22  -8.662  -4.170   4.027
  164    HG   SER  22           HG       SER  22  -8.510  -5.336   2.092
  165    H    THR  23           H        THR  23  -6.410  -4.795   0.966
  166    HA   THR  23           HA       THR  23  -4.501  -6.804   1.410
  167    HB   THR  23           HB       THR  23  -4.743  -5.435  -1.245
  168    HG1  THR  23           1HG      THR  23  -6.678  -7.204  -0.168
  169   1HG2  THR  23          1HG2      THR  23  -4.642  -7.661  -2.144
  170   2HG2  THR  23          2HG2      THR  23  -4.684  -8.353  -0.523
  171   3HG2  THR  23          3HG2      THR  23  -3.289  -7.407  -1.043
  172    H    LEU  24           H        LEU  24  -4.184  -3.452   0.370
  173    HA   LEU  24           HA       LEU  24  -1.466  -3.431  -0.229
  174   1HB   LEU  24          2HB       LEU  24  -2.708  -1.105   1.169
  175   2HB   LEU  24          1HB       LEU  24  -1.597  -1.125  -0.178
  176    HG   LEU  24           HG       LEU  24  -4.553  -1.646  -0.230
  177   1HD1  LEU  24          1HD1      LEU  24  -3.126   0.244  -2.025
  178   2HD1  LEU  24          2HD1      LEU  24  -3.361   0.703  -0.338
  179   3HD1  LEU  24          3HD1      LEU  24  -4.755   0.330  -1.352
  180   1HD2  LEU  24          1HD2      LEU  24  -3.837  -3.268  -1.720
  181   2HD2  LEU  24          2HD2      LEU  24  -2.442  -2.322  -2.239
  182   3HD2  LEU  24          3HD2      LEU  24  -4.061  -1.870  -2.770
  183    H    GLU  25           H        GLU  25  -3.164  -2.941   2.813
  184    HA   GLU  25           HA       GLU  25  -0.979  -2.307   4.425
  185   1HB   GLU  25          2HB       GLU  25  -3.617  -2.502   4.879
  186   2HB   GLU  25          1HB       GLU  25  -3.105  -4.022   5.598
  187   1HG   GLU  25          2HG       GLU  25  -1.445  -1.786   6.418
  188   2HG   GLU  25          1HG       GLU  25  -3.145  -1.558   6.825
  189    H    ALA  26           H        ALA  26  -2.110  -5.367   3.230
  190    HA   ALA  26           HA       ALA  26  -0.498  -6.969   4.897
  191   1HB   ALA  26          1HB       ALA  26  -2.156  -8.300   4.127
  192   2HB   ALA  26          2HB       ALA  26  -1.006  -8.606   2.825
  193   3HB   ALA  26          3HB       ALA  26  -2.291  -7.418   2.606
  194    H    HIS  27           H        HIS  27  -0.190  -5.484   1.772
  195    HA   HIS  27           HA       HIS  27   2.255  -6.775   1.037
  196   1HB   HIS  27          2HB       HIS  27   0.821  -5.913  -0.701
  197   2HB   HIS  27          1HB       HIS  27   0.825  -4.312   0.017
  198    HD1  HIS  27           1HD      HIS  27   3.038  -6.638  -1.976
  199    HD2  HIS  27           2HD      HIS  27   2.902  -2.690  -0.690
  200    HE1  HIS  27           1HE      HIS  27   4.871  -5.420  -3.224
  201    H    GLN  28           H        GLN  28   1.361  -3.579   2.230
  202    HA   GLN  28           HA       GLN  28   3.988  -2.575   2.500
  203   1HB   GLN  28          2HB       GLN  28   1.287  -1.731   3.145
  204   2HB   GLN  28          1HB       GLN  28   2.406  -1.298   4.428
  205   1HG   GLN  28          2HG       GLN  28   3.728  -0.587   2.103
  206   2HG   GLN  28          1HG       GLN  28   2.050  -0.138   1.808
  207   1HE2  GLN  28          1HE2      GLN  28   4.913   0.934   2.988
  208   2HE2  GLN  28          2HE2      GLN  28   4.350   2.195   4.027
  209    H    ALA  29           H        ALA  29   2.193  -4.854   4.303
  210    HA   ALA  29           HA       ALA  29   3.344  -4.441   6.859
  211   1HB   ALA  29          1HB       ALA  29   1.665  -6.501   5.576
  212   2HB   ALA  29          2HB       ALA  29   1.464  -5.665   7.115
  213   3HB   ALA  29          3HB       ALA  29   2.600  -7.008   6.984
  214    H    TYR  30           H        TYR  30   3.943  -7.090   4.506
  215    HA   TYR  30           HA       TYR  30   6.751  -7.056   5.316
  216   1HB   TYR  30          2HB       TYR  30   4.838  -9.336   5.645
  217   2HB   TYR  30          1HB       TYR  30   6.543  -9.647   5.362
  218    HD1  TYR  30           1HD      TYR  30   4.055  -8.789   7.786
  219    HD2  TYR  30           2HD      TYR  30   8.232  -8.645   6.989
  220    HE1  TYR  30           1HE      TYR  30   4.495  -8.471  10.183
  221    HE2  TYR  30           2HE      TYR  30   8.684  -8.328   9.385
  222    HH   TYR  30           HH       TYR  30   7.072  -7.280  11.440
  223    H    TYR  31           H        TYR  31   4.873  -6.687   2.803
  224    HA   TYR  31           HA       TYR  31   6.311  -8.548   1.045
  225   1HB   TYR  31          2HB       TYR  31   3.653  -7.990   1.134
  226   2HB   TYR  31          1HB       TYR  31   4.184  -6.879  -0.124
  227    HD1  TYR  31           1HD      TYR  31   3.765 -10.389   0.814
  228    HD2  TYR  31           2HD      TYR  31   5.050  -7.719  -2.238
  229    HE1  TYR  31           1HE      TYR  31   3.743 -12.240  -0.802
  230    HE2  TYR  31           2HE      TYR  31   5.031  -9.563  -3.867
  231    HH   TYR  31           HH       TYR  31   3.590 -12.584  -3.206
  232    H    CYS  32           H        CYS  32   5.562  -5.115   1.472
  233    HA   CYS  32           HA       CYS  32   7.101  -4.290  -0.798
  234   1HB   CYS  32          2HB       CYS  32   5.149  -3.062   0.482
  235   2HB   CYS  32          1HB       CYS  32   6.472  -2.425   1.454
  236    H    SER  33           H        SER  33   9.123  -5.299  -0.448
  237    HA   SER  33           HA       SER  33  11.344  -5.174   0.068
  238   1HB   SER  33          2HB       SER  33  10.838  -2.649   0.218
  239   2HB   SER  33          1HB       SER  33  10.798  -2.897   1.964
  240    HG   SER  33           HG       SER  33  12.917  -2.566   0.418
  241    H    HIS  34           H        HIS  34  12.833  -5.338   2.060
  242    HA   HIS  34           HA       HIS  34  11.492  -7.102   3.960
  243   1HB   HIS  34          2HB       HIS  34  14.413  -6.613   3.359
  244   2HB   HIS  34          1HB       HIS  34  13.846  -7.688   4.633
  245    HD1  HIS  34           1HD      HIS  34  13.717  -7.322   0.867
  246    HD2  HIS  34           2HD      HIS  34  13.214 -10.217   3.806
  247    HE1  HIS  34           1HE      HIS  34  13.484  -9.500  -0.367
  248    HE2  HIS  34           2HE      HIS  34  13.268 -11.248   1.434
  249    H    ARG  35           H        ARG  35  10.439  -5.376   5.117
  250    HA   ARG  35           HA       ARG  35  12.055  -3.454   6.537
  251   1HB   ARG  35          2HB       ARG  35   9.122  -4.097   6.878
  252   2HB   ARG  35          1HB       ARG  35   9.956  -2.671   7.481
  253   1HG   ARG  35          2HG       ARG  35  10.486  -2.123   5.071
  254   2HG   ARG  35          1HG       ARG  35   9.340  -3.392   4.631
  255   1HD   ARG  35          2HD       ARG  35   7.572  -2.240   5.840
  256   2HD   ARG  35          1HD       ARG  35   8.710  -0.996   6.352
  257    HE   ARG  35           HE       ARG  35   8.537  -1.298   3.500
  258   1HH1  ARG  35          1HH1      ARG  35   7.155   0.258   6.300
  259   2HH1  ARG  35          2HH1      ARG  35   6.483   1.572   5.394
  260   1HH2  ARG  35          1HH2      ARG  35   7.656   0.430   2.306
  261   2HH2  ARG  35          2HH2      ARG  35   6.766   1.669   3.127
  262    H    ILE  36           H        ILE  36  12.426  -3.374   8.749
  263    HA   ILE  36           HA       ILE  36  12.375  -5.971  10.071
  264    HB   ILE  36           HB       ILE  36  14.475  -4.686  10.064
  265   1HG1  ILE  36          2HG1      ILE  36  14.448  -4.533  12.803
  266   2HG1  ILE  36          1HG1      ILE  36  13.092  -5.613  12.488
  267   1HG2  ILE  36          1HG2      ILE  36  14.656  -2.673  11.498
  268   2HG2  ILE  36          2HG2      ILE  36  12.901  -2.686  11.677
  269   3HG2  ILE  36          3HG2      ILE  36  13.624  -2.439  10.087
  270   1HD1  ILE  36          1HD1      ILE  36  14.441  -7.302  11.988
  271   2HD1  ILE  36          2HD1      ILE  36  15.743  -6.320  12.661
  272   3HD1  ILE  36          3HD1      ILE  36  15.431  -6.302  10.925
  Start of MODEL    4
    1   1H    GLY   1          1HT       GLY   1  -9.193  10.971   1.757
    2   2H    GLY   1          2HT       GLY   1  -9.838  12.505   2.059
    3   3H    GLY   1          3HT       GLY   1  -8.246  12.154   2.510
    4   1HA   GLY   1          1HA       GLY   1  -8.148  11.598  -0.103
    5   2HA   GLY   1          2HA       GLY   1  -9.324  12.903  -0.072
    6    H    SER   2           H        SER   2  -6.798  13.071  -1.309
    7    HA   SER   2           HA       SER   2  -5.107  14.575  -1.548
    8   1HB   SER   2          2HB       SER   2  -7.034  16.016  -0.273
    9   2HB   SER   2          1HB       SER   2  -5.704  16.149   0.877
   10    HG   SER   2           HG       SER   2  -5.944  17.692  -1.056
   11    H    LEU   3           H        LEU   3  -5.501  14.516   1.995
   12    HA   LEU   3           HA       LEU   3  -2.893  13.186   2.201
   13   1HB   LEU   3          2HB       LEU   3  -2.380  14.692   4.151
   14   2HB   LEU   3          1HB       LEU   3  -2.328  15.451   2.571
   15    HG   LEU   3           HG       LEU   3  -4.896  15.639   4.039
   16   1HD1  LEU   3          1HD1      LEU   3  -2.337  16.693   5.071
   17   2HD1  LEU   3          2HD1      LEU   3  -3.820  16.272   5.924
   18   3HD1  LEU   3          3HD1      LEU   3  -3.706  17.805   5.060
   19   1HD2  LEU   3          1HD2      LEU   3  -3.973  16.684   1.739
   20   2HD2  LEU   3          2HD2      LEU   3  -3.536  17.975   2.860
   21   3HD2  LEU   3          3HD2      LEU   3  -5.214  17.450   2.731
   22    H    LEU   4           H        LEU   4  -2.518  12.669   4.674
   23    HA   LEU   4           HA       LEU   4  -3.127  11.436   6.482
   24   1HB   LEU   4          2HB       LEU   4  -5.420  13.196   6.003
   25   2HB   LEU   4          1HB       LEU   4  -5.833  11.724   6.862
   26    HG   LEU   4           HG       LEU   4  -5.379  13.460   8.461
   27   1HD1  LEU   4          1HD1      LEU   4  -4.306  10.997   8.561
   28   2HD1  LEU   4          2HD1      LEU   4  -4.166  12.179   9.863
   29   3HD1  LEU   4          3HD1      LEU   4  -2.847  11.974   8.710
   30   1HD2  LEU   4          1HD2      LEU   4  -3.055  13.957   6.705
   31   2HD2  LEU   4          2HD2      LEU   4  -2.795  14.164   8.438
   32   3HD2  LEU   4          3HD2      LEU   4  -4.053  15.088   7.618
   33    H    LYS   5           H        LYS   5  -6.236  11.223   4.787
   34    HA   LYS   5           HA       LYS   5  -6.281   8.383   5.021
   35   1HB   LYS   5          2HB       LYS   5  -8.040  10.332   3.533
   36   2HB   LYS   5          1HB       LYS   5  -8.338   8.600   3.558
   37   1HG   LYS   5          2HG       LYS   5  -8.153   9.030   6.186
   38   2HG   LYS   5          1HG       LYS   5  -8.715  10.623   5.676
   39   1HD   LYS   5          2HD       LYS   5 -10.725   9.571   5.987
   40   2HD   LYS   5          1HD       LYS   5 -10.441   9.192   4.287
   41   1HE   LYS   5          2HE       LYS   5 -10.038   6.994   4.702
   42   2HE   LYS   5          1HE       LYS   5  -9.336   7.311   6.288
   43   1HZ   LYS   5          1HZ       LYS   5 -11.686   6.196   6.016
   44   2HZ   LYS   5          2HZ       LYS   5 -12.197   7.807   5.939
   45   3HZ   LYS   5          3HZ       LYS   5 -11.356   7.252   7.297
   46    HA   PRO   6           HA       PRO   6  -4.064   7.022   1.459
   47   1HB   PRO   6          2HB       PRO   6  -6.365   5.178   1.028
   48   2HB   PRO   6          1HB       PRO   6  -4.639   4.818   1.138
   49   1HG   PRO   6          2HG       PRO   6  -6.271   4.267   3.166
   50   2HG   PRO   6          1HG       PRO   6  -4.636   4.892   3.456
   51   1HD   PRO   6          2HD       PRO   6  -7.263   6.297   3.631
   52   2HD   PRO   6          1HD       PRO   6  -5.807   6.495   4.627
   53    H    ALA   7           H        ALA   7  -3.954   7.914  -0.499
   54    HA   ALA   7           HA       ALA   7  -6.295   9.132  -1.675
   55   1HB   ALA   7          1HB       ALA   7  -4.647   9.895  -3.417
   56   2HB   ALA   7          2HB       ALA   7  -3.393   9.089  -2.474
   57   3HB   ALA   7          3HB       ALA   7  -4.307  10.424  -1.770
   58    H    ARG   8           H        ARG   8  -3.945   6.635  -2.625
   59    HA   ARG   8           HA       ARG   8  -5.994   5.509  -4.406
   60   1HB   ARG   8          2HB       ARG   8  -3.109   6.071  -5.076
   61   2HB   ARG   8          1HB       ARG   8  -4.083   4.928  -5.989
   62   1HG   ARG   8          2HG       ARG   8  -5.204   6.542  -7.063
   63   2HG   ARG   8          1HG       ARG   8  -5.318   7.560  -5.627
   64   1HD   ARG   8          2HD       ARG   8  -3.938   8.817  -6.978
   65   2HD   ARG   8          1HD       ARG   8  -2.768   7.918  -6.013
   66    HE   ARG   8           HE       ARG   8  -2.098   6.812  -7.905
   67   1HH1  ARG   8          1HH1      ARG   8  -5.113   8.449  -8.551
   68   2HH1  ARG   8          2HH1      ARG   8  -5.060   8.138 -10.253
   69   1HH2  ARG   8          1HH2      ARG   8  -2.026   6.406 -10.143
   70   2HH2  ARG   8          2HH2      ARG   8  -3.308   6.979 -11.159
   71    H    PHE   9           H        PHE   9  -5.191   3.252  -5.197
   72    HA   PHE   9           HA       PHE   9  -3.906   1.848  -2.950
   73   1HB   PHE   9          2HB       PHE   9  -5.489  -0.059  -3.431
   74   2HB   PHE   9          1HB       PHE   9  -6.237   1.373  -2.732
   75    HD1  PHE   9           1HD      PHE   9  -7.273   3.054  -4.420
   76    HD2  PHE   9           2HD      PHE   9  -6.396  -1.010  -5.326
   77    HE1  PHE   9           1HE      PHE   9  -8.877   3.128  -6.283
   78    HE2  PHE   9           2HE      PHE   9  -7.999  -0.944  -7.192
   79    HZ   PHE   9           HZ       PHE   9  -9.242   1.127  -7.673
   80    H    MET  10           H        MET  10  -1.999   2.091  -4.340
   81    HA   MET  10           HA       MET  10  -1.551  -0.262  -5.881
   82   1HB   MET  10          2HB       MET  10  -2.691   1.060  -7.592
   83   2HB   MET  10          1HB       MET  10  -1.581   2.397  -7.324
   84   1HG   MET  10          2HG       MET  10   0.277   0.884  -8.032
   85   2HG   MET  10          1HG       MET  10  -0.946  -0.303  -8.482
   86   1HE   MET  10          1HE       MET  10   0.162  -0.491 -10.525
   87   2HE   MET  10          2HE       MET  10   1.028   0.906 -11.166
   88   3HE   MET  10          3HE       MET  10  -0.440   0.338 -11.961
   89    H    CYS  11           H        CYS  11   0.500  -0.823  -5.579
   90    HA   CYS  11           HA       CYS  11   2.314   1.067  -4.342
   91   1HB   CYS  11          2HB       CYS  11   1.981  -1.511  -3.830
   92   2HB   CYS  11          1HB       CYS  11   3.184  -1.689  -5.104
   93    H    LEU  12           H        LEU  12   2.684   2.513  -6.056
   94    HA   LEU  12           HA       LEU  12   3.505   1.873  -8.631
   95   1HB   LEU  12          2HB       LEU  12   4.675   4.253  -7.254
   96   2HB   LEU  12          1HB       LEU  12   4.095   4.097  -8.899
   97    HG   LEU  12           HG       LEU  12   1.806   3.712  -7.398
   98   1HD1  LEU  12          1HD1      LEU  12   2.444   6.200  -6.195
   99   2HD1  LEU  12          2HD1      LEU  12   3.685   5.036  -5.730
  100   3HD1  LEU  12          3HD1      LEU  12   1.985   4.686  -5.417
  101   1HD2  LEU  12          1HD2      LEU  12   2.511   6.461  -8.279
  102   2HD2  LEU  12          2HD2      LEU  12   1.037   5.528  -8.544
  103   3HD2  LEU  12          3HD2      LEU  12   2.485   5.179  -9.489
  104    HA   PRO  13           HA       PRO  13   8.108   2.186  -6.852
  105   1HB   PRO  13          2HB       PRO  13   7.530   0.919  -4.225
  106   2HB   PRO  13          1HB       PRO  13   8.672   2.206  -4.628
  107   1HG   PRO  13          2HG       PRO  13   6.400   2.753  -3.348
  108   2HG   PRO  13          1HG       PRO  13   7.037   3.850  -4.589
  109   1HD   PRO  13          2HD       PRO  13   4.790   1.886  -4.763
  110   2HD   PRO  13          1HD       PRO  13   4.930   3.506  -5.475
  111    H    CYS  14           H        CYS  14   5.681  -0.244  -6.531
  112    HA   CYS  14           HA       CYS  14   7.662  -2.358  -7.000
  113   1HB   CYS  14          2HB       CYS  14   4.966  -2.357  -5.670
  114   2HB   CYS  14          1HB       CYS  14   5.654  -3.841  -6.310
  115    H    GLY  15           H        GLY  15   4.828  -0.727  -8.163
  116   1HA   GLY  15          2HA       GLY  15   3.939  -0.686 -10.277
  117   2HA   GLY  15          1HA       GLY  15   5.175  -1.831 -10.754
  118    H    ILE  16           H        ILE  16   2.857  -2.267  -8.154
  119    HA   ILE  16           HA       ILE  16   1.402  -4.238  -9.770
  120    HB   ILE  16           HB       ILE  16   2.209  -4.821  -6.927
  121   1HG1  ILE  16          2HG1      ILE  16   3.504  -5.978  -9.399
  122   2HG1  ILE  16          1HG1      ILE  16   4.190  -4.629  -8.500
  123   1HG2  ILE  16          1HG2      ILE  16   0.725  -6.236  -9.067
  124   2HG2  ILE  16          2HG2      ILE  16   0.459  -6.215  -7.323
  125   3HG2  ILE  16          3HG2      ILE  16   1.751  -7.203  -8.007
  126   1HD1  ILE  16          1HD1      ILE  16   4.557  -7.363  -8.043
  127   2HD1  ILE  16          2HD1      ILE  16   3.571  -6.770  -6.706
  128   3HD1  ILE  16          3HD1      ILE  16   5.126  -6.015  -7.058
  129    H    ALA  17           H        ALA  17  -0.568  -3.330  -9.844
  130    HA   ALA  17           HA       ALA  17  -1.655  -1.923  -7.555
  131   1HB   ALA  17          1HB       ALA  17  -1.955  -1.523 -10.199
  132   2HB   ALA  17          2HB       ALA  17  -3.122  -0.980  -8.994
  133   3HB   ALA  17          3HB       ALA  17  -3.397  -2.486  -9.871
  134    H    PHE  18           H        PHE  18  -2.806  -2.875  -6.004
  135    HA   PHE  18           HA       PHE  18  -3.625  -5.620  -6.302
  136   1HB   PHE  18          2HB       PHE  18  -3.372  -3.664  -4.079
  137   2HB   PHE  18          1HB       PHE  18  -4.455  -5.022  -3.860
  138    HD1  PHE  18           1HD      PHE  18  -3.609  -7.047  -3.094
  139    HD2  PHE  18           2HD      PHE  18  -0.980  -4.223  -4.889
  140    HE1  PHE  18           1HE      PHE  18  -1.688  -8.468  -2.507
  141    HE2  PHE  18           2HE      PHE  18   0.946  -5.638  -4.307
  142    HZ   PHE  18           HZ       PHE  18   0.595  -7.764  -3.117
  143    H    SER  19           H        SER  19  -5.840  -6.060  -5.044
  144    HA   SER  19           HA       SER  19  -7.860  -4.846  -6.718
  145   1HB   SER  19          2HB       SER  19  -8.051  -7.196  -6.509
  146   2HB   SER  19          1HB       SER  19  -7.895  -7.130  -4.754
  147    HG   SER  19           HG       SER  19 -10.087  -6.378  -6.365
  148    H    SER  20           H        SER  20  -6.804  -4.564  -3.415
  149    HA   SER  20           HA       SER  20  -8.740  -2.465  -3.010
  150   1HB   SER  20          2HB       SER  20  -9.137  -5.086  -1.919
  151   2HB   SER  20          1HB       SER  20  -8.868  -3.946  -0.603
  152    HG   SER  20           HG       SER  20 -11.046  -4.268  -2.131
  153    HA   PRO  21           HA       PRO  21  -5.666  -0.616  -0.455
  154   1HB   PRO  21          2HB       PRO  21  -6.984   0.336   1.706
  155   2HB   PRO  21          1HB       PRO  21  -7.182   1.025   0.091
  156   1HG   PRO  21          2HG       PRO  21  -8.942  -0.899   1.558
  157   2HG   PRO  21          1HG       PRO  21  -9.393   0.509   0.578
  158   1HD   PRO  21          2HD       PRO  21  -9.506  -2.042  -0.350
  159   2HD   PRO  21          1HD       PRO  21  -9.193  -0.647  -1.398
  160    H    SER  22           H        SER  22  -7.811  -2.661   1.524
  161    HA   SER  22           HA       SER  22  -6.126  -3.025   3.713
  162   1HB   SER  22          2HB       SER  22  -8.049  -5.059   2.553
  163   2HB   SER  22          1HB       SER  22  -7.440  -5.019   4.207
  164    HG   SER  22           HG       SER  22  -9.138  -3.841   4.570
  165    H    THR  23           H        THR  23  -6.205  -4.673   0.601
  166    HA   THR  23           HA       THR  23  -4.424  -6.754   1.239
  167    HB   THR  23           HB       THR  23  -4.129  -7.027  -1.157
  168    HG1  THR  23           1HG      THR  23  -5.486  -4.561  -1.462
  169   1HG2  THR  23          1HG2      THR  23  -6.737  -6.458  -1.763
  170   2HG2  THR  23          2HG2      THR  23  -6.776  -6.680  -0.013
  171   3HG2  THR  23          3HG2      THR  23  -6.142  -7.957  -1.052
  172    H    LEU  24           H        LEU  24  -3.929  -3.442   0.199
  173    HA   LEU  24           HA       LEU  24  -1.190  -3.560  -0.359
  174   1HB   LEU  24          2HB       LEU  24  -2.380  -1.160   0.966
  175   2HB   LEU  24          1HB       LEU  24  -1.212  -1.245  -0.330
  176    HG   LEU  24           HG       LEU  24  -4.158  -1.799  -0.580
  177   1HD1  LEU  24          1HD1      LEU  24  -2.614   0.420  -1.876
  178   2HD1  LEU  24          2HD1      LEU  24  -3.336   0.603  -0.277
  179   3HD1  LEU  24          3HD1      LEU  24  -4.358   0.256  -1.672
  180   1HD2  LEU  24          1HD2      LEU  24  -3.148  -3.194  -2.156
  181   2HD2  LEU  24          2HD2      LEU  24  -1.881  -2.022  -2.516
  182   3HD2  LEU  24          3HD2      LEU  24  -3.532  -1.731  -3.062
  183    H    GLU  25           H        GLU  25  -2.970  -2.938   2.610
  184    HA   GLU  25           HA       GLU  25  -0.810  -2.397   4.291
  185   1HB   GLU  25          2HB       GLU  25  -3.466  -2.411   4.641
  186   2HB   GLU  25          1HB       GLU  25  -3.093  -3.951   5.400
  187   1HG   GLU  25          2HG       GLU  25  -1.563  -2.852   6.929
  188   2HG   GLU  25          1HG       GLU  25  -1.855  -1.305   6.134
  189    H    ALA  26           H        ALA  26  -2.080  -5.401   3.097
  190    HA   ALA  26           HA       ALA  26  -0.594  -7.055   4.842
  191   1HB   ALA  26          1HB       ALA  26  -2.276  -8.360   4.117
  192   2HB   ALA  26          2HB       ALA  26  -1.209  -8.679   2.750
  193   3HB   ALA  26          3HB       ALA  26  -2.460  -7.444   2.621
  194    H    HIS  27           H        HIS  27  -0.178  -5.661   1.694
  195    HA   HIS  27           HA       HIS  27   2.172  -7.133   0.987
  196   1HB   HIS  27          2HB       HIS  27   0.849  -6.230  -0.792
  197   2HB   HIS  27          1HB       HIS  27   0.863  -4.627  -0.081
  198    HD1  HIS  27           1HD      HIS  27   3.075  -6.996  -2.024
  199    HD2  HIS  27           2HD      HIS  27   2.987  -3.044  -0.747
  200    HE1  HIS  27           1HE      HIS  27   4.952  -5.814  -3.240
  201    H    GLN  28           H        GLN  28   1.524  -3.831   2.055
  202    HA   GLN  28           HA       GLN  28   4.208  -3.026   2.341
  203   1HB   GLN  28          2HB       GLN  28   1.591  -1.948   2.864
  204   2HB   GLN  28          1HB       GLN  28   2.637  -1.631   4.241
  205   1HG   GLN  28          2HG       GLN  28   3.843  -1.081   1.629
  206   2HG   GLN  28          1HG       GLN  28   2.454  -0.074   2.033
  207   1HE2  GLN  28          1HE2      GLN  28   5.754  -0.707   2.596
  208   2HE2  GLN  28          2HE2      GLN  28   6.025   0.513   3.790
  209    H    ALA  29           H        ALA  29   2.207  -5.088   4.209
  210    HA   ALA  29           HA       ALA  29   3.368  -4.708   6.756
  211   1HB   ALA  29          1HB       ALA  29   1.585  -6.697   5.496
  212   2HB   ALA  29          2HB       ALA  29   1.404  -5.798   7.002
  213   3HB   ALA  29          3HB       ALA  29   2.458  -7.211   6.940
  214    H    TYR  30           H        TYR  30   3.820  -7.448   4.477
  215    HA   TYR  30           HA       TYR  30   6.603  -7.603   5.378
  216   1HB   TYR  30          2HB       TYR  30   4.525  -9.753   5.552
  217   2HB   TYR  30          1HB       TYR  30   6.220 -10.172   5.349
  218    HD1  TYR  30           1HD      TYR  30   3.725  -9.724   7.707
  219    HD2  TYR  30           2HD      TYR  30   7.826  -8.805   7.044
  220    HE1  TYR  30           1HE      TYR  30   4.059  -9.496  10.131
  221    HE2  TYR  30           2HE      TYR  30   8.171  -8.575   9.468
  222    HH   TYR  30           HH       TYR  30   7.175  -9.269  11.545
  223    H    TYR  31           H        TYR  31   4.771  -7.147   2.786
  224    HA   TYR  31           HA       TYR  31   6.231  -9.012   1.058
  225   1HB   TYR  31          2HB       TYR  31   3.587  -8.286   1.059
  226   2HB   TYR  31          1HB       TYR  31   4.248  -7.273  -0.220
  227    HD1  TYR  31           1HD      TYR  31   2.939 -10.449   0.573
  228    HD2  TYR  31           2HD      TYR  31   5.745  -8.521  -1.976
  229    HE1  TYR  31           1HE      TYR  31   2.856 -12.369  -0.959
  230    HE2  TYR  31           2HE      TYR  31   5.669 -10.434  -3.518
  231    HH   TYR  31           HH       TYR  31   3.301 -12.771  -3.434
  232    H    CYS  32           H        CYS  32   5.547  -5.553   1.447
  233    HA   CYS  32           HA       CYS  32   7.259  -4.782  -0.717
  234   1HB   CYS  32          2HB       CYS  32   5.247  -3.506   0.446
  235   2HB   CYS  32          1HB       CYS  32   6.537  -2.869   1.460
  236    H    SER  33           H        SER  33   9.380  -5.111  -0.601
  237    HA   SER  33           HA       SER  33  11.496  -5.345   0.235
  238   1HB   SER  33          2HB       SER  33  10.816  -2.839   1.781
  239   2HB   SER  33          1HB       SER  33  12.398  -3.342   1.185
  240    HG   SER  33           HG       SER  33  11.702  -2.974  -0.905
  241    H    HIS  34           H        HIS  34  12.719  -4.708   2.605
  242    HA   HIS  34           HA       HIS  34  11.250  -6.343   4.570
  243   1HB   HIS  34          2HB       HIS  34  14.245  -6.264   4.146
  244   2HB   HIS  34          1HB       HIS  34  13.385  -7.263   5.313
  245    HD1  HIS  34           1HD      HIS  34  13.885  -6.886   1.588
  246    HD2  HIS  34           2HD      HIS  34  12.445  -9.653   4.334
  247    HE1  HIS  34           1HE      HIS  34  13.509  -9.000   0.279
  248    HE2  HIS  34           2HE      HIS  34  12.733 -10.687   1.981
  249    H    ARG  35           H        ARG  35  10.571  -3.957   4.993
  250    HA   ARG  35           HA       ARG  35  12.483  -2.371   6.452
  251   1HB   ARG  35          2HB       ARG  35  10.794  -1.236   5.145
  252   2HB   ARG  35          1HB       ARG  35   9.509  -2.067   6.008
  253   1HG   ARG  35          2HG       ARG  35  10.859  -0.836   8.042
  254   2HG   ARG  35          1HG       ARG  35  11.015   0.326   6.724
  255   1HD   ARG  35          2HD       ARG  35   9.027   0.827   7.983
  256   2HD   ARG  35          1HD       ARG  35   8.566   0.219   6.393
  257    HE   ARG  35           HE       ARG  35   8.529  -2.001   7.934
  258   1HH1  ARG  35          1HH1      ARG  35   7.073   1.152   8.266
  259   2HH1  ARG  35          2HH1      ARG  35   5.702   0.565   9.147
  260   1HH2  ARG  35          1HH2      ARG  35   6.726  -2.776   9.093
  261   2HH2  ARG  35          2HH2      ARG  35   5.507  -1.664   9.617
  262    H    ILE  36           H        ILE  36  12.908  -2.491   8.556
  263    HA   ILE  36           HA       ILE  36  10.952  -3.822  10.313
  264    HB   ILE  36           HB       ILE  36  12.864  -5.309   9.904
  265   1HG1  ILE  36          2HG1      ILE  36  13.405  -4.480  12.687
  266   2HG1  ILE  36          1HG1      ILE  36  11.708  -4.740  12.298
  267   1HG2  ILE  36          1HG2      ILE  36  15.081  -4.615  10.931
  268   2HG2  ILE  36          2HG2      ILE  36  14.449  -2.969  10.918
  269   3HG2  ILE  36          3HG2      ILE  36  14.639  -3.853   9.403
  270   1HD1  ILE  36          1HD1      ILE  36  11.952  -6.950  12.256
  271   2HD1  ILE  36          2HD1      ILE  36  13.488  -6.662  13.074
  272   3HD1  ILE  36          3HD1      ILE  36  13.445  -6.860  11.321
  Start of MODEL    5
    1   1H    GLY   1          1HT       GLY   1 -10.609  11.092   1.376
    2   2H    GLY   1          2HT       GLY   1 -11.319  12.584   1.017
    3   3H    GLY   1          3HT       GLY   1 -10.053  12.499   2.134
    4   1HA   GLY   1          1HA       GLY   1  -8.902  11.390  -0.016
    5   2HA   GLY   1          2HA       GLY   1  -9.975  12.566  -0.758
    6    H    SER   2           H        SER   2  -7.371  12.945  -1.166
    7    HA   SER   2           HA       SER   2  -5.690  14.470  -1.007
    8   1HB   SER   2          2HB       SER   2  -7.871  15.950  -0.960
    9   2HB   SER   2          1HB       SER   2  -7.380  16.251   0.707
   10    HG   SER   2           HG       SER   2  -6.417  17.334  -1.534
   11    H    LEU   3           H        LEU   3  -4.235  13.356   0.226
   12    HA   LEU   3           HA       LEU   3  -3.027  12.687   2.037
   13   1HB   LEU   3          2HB       LEU   3  -2.240  14.432   3.419
   14   2HB   LEU   3          1HB       LEU   3  -2.534  15.138   1.843
   15    HG   LEU   3           HG       LEU   3  -4.761  15.352   3.777
   16   1HD1  LEU   3          1HD1      LEU   3  -2.056  16.413   4.312
   17   2HD1  LEU   3          2HD1      LEU   3  -3.352  15.986   5.429
   18   3HD1  LEU   3          3HD1      LEU   3  -3.409  17.517   4.555
   19   1HD2  LEU   3          1HD2      LEU   3  -4.229  16.397   1.337
   20   2HD2  LEU   3          2HD2      LEU   3  -3.661  17.696   2.387
   21   3HD2  LEU   3          3HD2      LEU   3  -5.325  17.124   2.512
   22    H    LEU   4           H        LEU   4  -3.042  12.928   4.661
   23    HA   LEU   4           HA       LEU   4  -4.010  12.237   6.596
   24   1HB   LEU   4          2HB       LEU   4  -5.841  14.018   5.462
   25   2HB   LEU   4          1HB       LEU   4  -6.801  12.628   5.929
   26    HG   LEU   4           HG       LEU   4  -6.697  14.388   7.671
   27   1HD1  LEU   4          1HD1      LEU   4  -6.710  11.726   7.993
   28   2HD1  LEU   4          2HD1      LEU   4  -6.799  12.867   9.336
   29   3HD1  LEU   4          3HD1      LEU   4  -5.256  12.129   8.906
   30   1HD2  LEU   4          1HD2      LEU   4  -4.126  14.711   7.012
   31   2HD2  LEU   4          2HD2      LEU   4  -3.932  13.622   8.385
   32   3HD2  LEU   4          3HD2      LEU   4  -4.775  15.158   8.590
   33    H    LYS   5           H        LYS   5  -6.658  11.469   4.342
   34    HA   LYS   5           HA       LYS   5  -6.498   8.680   5.227
   35   1HB   LYS   5          2HB       LYS   5  -8.661  10.445   4.250
   36   2HB   LYS   5          1HB       LYS   5  -8.745   8.772   3.715
   37   1HG   LYS   5          2HG       LYS   5  -8.565   8.084   6.112
   38   2HG   LYS   5          1HG       LYS   5  -8.719   9.789   6.545
   39   1HD   LYS   5          2HD       LYS   5 -10.900   9.908   5.566
   40   2HD   LYS   5          1HD       LYS   5 -10.734   8.294   4.872
   41   1HE   LYS   5          2HE       LYS   5 -10.309   7.753   7.483
   42   2HE   LYS   5          1HE       LYS   5 -11.411   9.122   7.619
   43   1HZ   LYS   5          1HZ       LYS   5 -12.642   7.670   5.758
   44   2HZ   LYS   5          2HZ       LYS   5 -12.955   7.519   7.414
   45   3HZ   LYS   5          3HZ       LYS   5 -11.907   6.433   6.649
   46    HA   PRO   6           HA       PRO   6  -4.790   7.443   1.336
   47   1HB   PRO   6          2HB       PRO   6  -5.415   4.816   1.361
   48   2HB   PRO   6          1HB       PRO   6  -4.180   5.504   2.422
   49   1HG   PRO   6          2HG       PRO   6  -7.029   4.813   3.033
   50   2HG   PRO   6          1HG       PRO   6  -5.574   4.516   4.002
   51   1HD   PRO   6          2HD       PRO   6  -7.274   6.582   4.480
   52   2HD   PRO   6          1HD       PRO   6  -5.536   6.661   4.829
   53    H    ALA   7           H        ALA   7  -5.451   6.119  -0.660
   54    HA   ALA   7           HA       ALA   7  -8.225   5.800  -1.229
   55   1HB   ALA   7          1HB       ALA   7  -7.930   7.613  -3.174
   56   2HB   ALA   7          2HB       ALA   7  -6.908   8.350  -1.939
   57   3HB   ALA   7          3HB       ALA   7  -8.602   8.004  -1.591
   58    H    ARG   8           H        ARG   8  -5.008   6.371  -2.604
   59    HA   ARG   8           HA       ARG   8  -5.542   4.873  -4.986
   60   1HB   ARG   8          2HB       ARG   8  -3.190   6.243  -3.792
   61   2HB   ARG   8          1HB       ARG   8  -2.868   4.972  -4.964
   62   1HG   ARG   8          2HG       ARG   8  -4.605   6.249  -6.421
   63   2HG   ARG   8          1HG       ARG   8  -4.231   7.596  -5.344
   64   1HD   ARG   8          2HD       ARG   8  -2.750   7.850  -7.139
   65   2HD   ARG   8          1HD       ARG   8  -1.781   7.106  -5.868
   66    HE   ARG   8           HE       ARG   8  -1.559   5.235  -7.173
   67   1HH1  ARG   8          1HH1      ARG   8  -4.093   7.244  -8.485
   68   2HH1  ARG   8          2HH1      ARG   8  -4.252   6.312  -9.935
   69   1HH2  ARG   8          1HH2      ARG   8  -1.766   4.008  -9.080
   70   2HH2  ARG   8          2HH2      ARG   8  -2.931   4.473 -10.273
   71    H    PHE   9           H        PHE   9  -5.448   2.749  -5.268
   72    HA   PHE   9           HA       PHE   9  -4.157   1.121  -3.182
   73   1HB   PHE   9          2HB       PHE   9  -5.713  -0.692  -4.378
   74   2HB   PHE   9          1HB       PHE   9  -6.303   0.337  -3.079
   75    HD1  PHE   9           1HD      PHE   9  -8.226   1.565  -3.395
   76    HD2  PHE   9           2HD      PHE   9  -6.043   0.224  -6.794
   77    HE1  PHE   9           1HE      PHE   9 -10.010   2.404  -4.868
   78    HE2  PHE   9           2HE      PHE   9  -7.822   1.062  -8.272
   79    HZ   PHE   9           HZ       PHE   9  -9.809   2.155  -7.309
   80    H    MET  10           H        MET  10  -2.191   1.705  -4.523
   81    HA   MET  10           HA       MET  10  -1.474  -0.559  -6.102
   82   1HB   MET  10          2HB       MET  10  -2.672   0.705  -7.820
   83   2HB   MET  10          1HB       MET  10  -1.689   2.123  -7.485
   84   1HG   MET  10          2HG       MET  10   0.305   0.605  -8.089
   85   2HG   MET  10          1HG       MET  10  -0.914  -0.432  -8.827
   86   1HE   MET  10          1HE       MET  10  -2.306   0.014 -10.640
   87   2HE   MET  10          2HE       MET  10  -2.075   1.236 -11.891
   88   3HE   MET  10          3HE       MET  10  -3.004   1.620 -10.442
   89    H    CYS  11           H        CYS  11   0.586  -0.956  -5.656
   90    HA   CYS  11           HA       CYS  11   2.193   1.087  -4.374
   91   1HB   CYS  11          2HB       CYS  11   2.035  -1.464  -3.778
   92   2HB   CYS  11          1HB       CYS  11   3.237  -1.641  -5.051
   93    H    LEU  12           H        LEU  12   2.534   2.528  -6.099
   94    HA   LEU  12           HA       LEU  12   3.457   1.962  -8.635
   95   1HB   LEU  12          2HB       LEU  12   4.553   4.343  -7.195
   96   2HB   LEU  12          1HB       LEU  12   4.002   4.203  -8.853
   97    HG   LEU  12           HG       LEU  12   1.683   3.759  -7.475
   98   1HD1  LEU  12          1HD1      LEU  12   1.489   5.281  -5.677
   99   2HD1  LEU  12          2HD1      LEU  12   3.077   5.975  -5.999
  100   3HD1  LEU  12          3HD1      LEU  12   2.944   4.334  -5.369
  101   1HD2  LEU  12          1HD2      LEU  12   2.371   6.582  -8.033
  102   2HD2  LEU  12          2HD2      LEU  12   0.970   5.635  -8.530
  103   3HD2  LEU  12          3HD2      LEU  12   2.507   5.443  -9.372
  104    HA   PRO  13           HA       PRO  13   8.026   2.347  -6.813
  105   1HB   PRO  13          2HB       PRO  13   7.486   1.105  -4.171
  106   2HB   PRO  13          1HB       PRO  13   8.575   2.432  -4.591
  107   1HG   PRO  13          2HG       PRO  13   6.281   2.900  -3.318
  108   2HG   PRO  13          1HG       PRO  13   6.874   4.008  -4.569
  109   1HD   PRO  13          2HD       PRO  13   4.717   1.943  -4.732
  110   2HD   PRO  13          1HD       PRO  13   4.779   3.568  -5.444
  111    H    CYS  14           H        CYS  14   5.663  -0.144  -6.504
  112    HA   CYS  14           HA       CYS  14   7.716  -2.198  -6.938
  113   1HB   CYS  14          2HB       CYS  14   5.033  -2.288  -5.578
  114   2HB   CYS  14          1HB       CYS  14   5.812  -3.748  -6.163
  115    H    GLY  15           H        GLY  15   4.787  -0.717  -8.079
  116   1HA   GLY  15          2HA       GLY  15   3.879  -0.759 -10.188
  117   2HA   GLY  15          1HA       GLY  15   5.126  -1.901 -10.645
  118    H    ILE  16           H        ILE  16   2.938  -2.340  -7.947
  119    HA   ILE  16           HA       ILE  16   1.513  -4.425  -9.463
  120    HB   ILE  16           HB       ILE  16   2.230  -4.748  -6.556
  121   1HG1  ILE  16          2HG1      ILE  16   3.693  -6.024  -8.873
  122   2HG1  ILE  16          1HG1      ILE  16   4.279  -4.589  -8.035
  123   1HG2  ILE  16          1HG2      ILE  16   0.869  -6.358  -8.626
  124   2HG2  ILE  16          2HG2      ILE  16   0.591  -6.271  -6.887
  125   3HG2  ILE  16          3HG2      ILE  16   1.932  -7.226  -7.519
  126   1HD1  ILE  16          1HD1      ILE  16   5.278  -6.769  -7.306
  127   2HD1  ILE  16          2HD1      ILE  16   3.699  -7.181  -6.635
  128   3HD1  ILE  16          3HD1      ILE  16   4.582  -5.784  -6.018
  129    H    ALA  17           H        ALA  17  -0.482  -3.600  -9.661
  130    HA   ALA  17           HA       ALA  17  -1.672  -2.033  -7.534
  131   1HB   ALA  17          1HB       ALA  17  -1.915  -1.899 -10.220
  132   2HB   ALA  17          2HB       ALA  17  -3.108  -1.255  -9.092
  133   3HB   ALA  17          3HB       ALA  17  -3.349  -2.843  -9.818
  134    H    PHE  18           H        PHE  18  -2.776  -2.912  -5.909
  135    HA   PHE  18           HA       PHE  18  -3.553  -5.683  -6.012
  136   1HB   PHE  18          2HB       PHE  18  -3.312  -3.575  -3.931
  137   2HB   PHE  18          1HB       PHE  18  -4.390  -4.920  -3.613
  138    HD1  PHE  18           1HD      PHE  18  -3.456  -7.267  -3.700
  139    HD2  PHE  18           2HD      PHE  18  -0.997  -3.793  -3.715
  140    HE1  PHE  18           1HE      PHE  18  -1.524  -8.635  -3.025
  141    HE2  PHE  18           2HE      PHE  18   0.938  -5.154  -3.040
  142    HZ   PHE  18           HZ       PHE  18   0.677  -7.579  -2.696
  143    H    SER  19           H        SER  19  -5.768  -5.953  -4.586
  144    HA   SER  19           HA       SER  19  -7.812  -5.002  -6.395
  145   1HB   SER  19          2HB       SER  19  -7.499  -7.371  -5.187
  146   2HB   SER  19          1HB       SER  19  -8.544  -6.596  -3.997
  147    HG   SER  19           HG       SER  19  -9.997  -7.368  -5.362
  148    H    SER  20           H        SER  20  -6.755  -4.330  -3.128
  149    HA   SER  20           HA       SER  20  -8.417  -2.008  -3.030
  150   1HB   SER  20          2HB       SER  20  -9.260  -4.478  -1.679
  151   2HB   SER  20          1HB       SER  20  -9.245  -3.054  -0.639
  152    HG   SER  20           HG       SER  20 -10.458  -2.032  -2.438
  153    HA   PRO  21           HA       PRO  21  -5.457  -0.283  -0.279
  154   1HB   PRO  21          2HB       PRO  21  -6.982   0.394   1.959
  155   2HB   PRO  21          1HB       PRO  21  -6.747   1.399   0.526
  156   1HG   PRO  21          2HG       PRO  21  -9.023  -0.393   1.237
  157   2HG   PRO  21          1HG       PRO  21  -9.043   1.182   0.422
  158   1HD   PRO  21          2HD       PRO  21  -9.373  -1.089  -0.948
  159   2HD   PRO  21          1HD       PRO  21  -8.449   0.266  -1.629
  160    H    SER  22           H        SER  22  -7.775  -2.224   1.631
  161    HA   SER  22           HA       SER  22  -6.113  -2.900   3.738
  162   1HB   SER  22          2HB       SER  22  -8.662  -3.487   3.148
  163   2HB   SER  22          1HB       SER  22  -7.926  -5.031   2.720
  164    HG   SER  22           HG       SER  22  -7.659  -3.695   5.211
  165    H    THR  23           H        THR  23  -6.226  -4.202   0.494
  166    HA   THR  23           HA       THR  23  -4.671  -6.514   0.977
  167    HB   THR  23           HB       THR  23  -4.449  -5.191  -1.666
  168    HG1  THR  23           1HG      THR  23  -6.923  -6.237  -0.770
  169   1HG2  THR  23          1HG2      THR  23  -5.327  -7.953  -0.861
  170   2HG2  THR  23          2HG2      THR  23  -3.705  -7.489  -1.378
  171   3HG2  THR  23          3HG2      THR  23  -5.056  -7.383  -2.508
  172    H    LEU  24           H        LEU  24  -3.875  -3.202   0.110
  173    HA   LEU  24           HA       LEU  24  -1.147  -3.523  -0.391
  174   1HB   LEU  24          2HB       LEU  24  -2.154  -1.098   1.033
  175   2HB   LEU  24          1HB       LEU  24  -0.974  -1.221  -0.251
  176    HG   LEU  24           HG       LEU  24  -3.956  -1.481  -0.554
  177   1HD1  LEU  24          1HD1      LEU  24  -2.418   0.574  -1.996
  178   2HD1  LEU  24          2HD1      LEU  24  -2.569   0.801  -0.254
  179   3HD1  LEU  24          3HD1      LEU  24  -4.014   0.660  -1.253
  180   1HD2  LEU  24          1HD2      LEU  24  -2.371  -2.892  -2.059
  181   2HD2  LEU  24          2HD2      LEU  24  -2.026  -1.342  -2.828
  182   3HD2  LEU  24          3HD2      LEU  24  -3.677  -1.962  -2.793
  183    H    GLU  25           H        GLU  25  -2.928  -2.897   2.575
  184    HA   GLU  25           HA       GLU  25  -0.834  -2.542   4.343
  185   1HB   GLU  25          2HB       GLU  25  -3.497  -2.584   4.617
  186   2HB   GLU  25          1HB       GLU  25  -3.138  -4.168   5.286
  187   1HG   GLU  25          2HG       GLU  25  -1.758  -3.223   6.980
  188   2HG   GLU  25          1HG       GLU  25  -1.820  -1.633   6.223
  189    H    ALA  26           H        ALA  26  -2.089  -5.486   2.975
  190    HA   ALA  26           HA       ALA  26  -0.612  -7.216   4.649
  191   1HB   ALA  26          1HB       ALA  26  -2.449  -7.510   2.385
  192   2HB   ALA  26          2HB       ALA  26  -2.303  -8.473   3.854
  193   3HB   ALA  26          3HB       ALA  26  -1.210  -8.758   2.500
  194    H    HIS  27           H        HIS  27  -0.148  -5.659   1.586
  195    HA   HIS  27           HA       HIS  27   2.199  -7.126   0.845
  196   1HB   HIS  27          2HB       HIS  27   0.937  -6.138  -0.925
  197   2HB   HIS  27          1HB       HIS  27   0.923  -4.569  -0.137
  198    HD1  HIS  27           1HD      HIS  27   3.319  -6.882  -1.965
  199    HD2  HIS  27           2HD      HIS  27   2.948  -2.909  -0.811
  200    HE1  HIS  27           1HE      HIS  27   5.208  -5.636  -3.093
  201    H    GLN  28           H        GLN  28   1.575  -3.843   2.005
  202    HA   GLN  28           HA       GLN  28   4.251  -3.086   2.381
  203   1HB   GLN  28          2HB       GLN  28   1.654  -1.993   2.875
  204   2HB   GLN  28          1HB       GLN  28   2.622  -1.793   4.328
  205   1HG   GLN  28          2HG       GLN  28   3.758  -1.035   1.680
  206   2HG   GLN  28          1HG       GLN  28   2.613   0.036   2.483
  207   1HE2  GLN  28          1HE2      GLN  28   4.096   1.650   2.849
  208   2HE2  GLN  28          2HE2      GLN  28   5.388   1.500   3.986
  209    H    ALA  29           H        ALA  29   2.212  -5.214   4.143
  210    HA   ALA  29           HA       ALA  29   3.336  -4.961   6.713
  211   1HB   ALA  29          1HB       ALA  29   1.620  -6.922   5.322
  212   2HB   ALA  29          2HB       ALA  29   1.391  -6.103   6.867
  213   3HB   ALA  29          3HB       ALA  29   2.477  -7.488   6.756
  214    H    TYR  30           H        TYR  30   3.928  -7.515   4.255
  215    HA   TYR  30           HA       TYR  30   6.669  -7.693   5.276
  216   1HB   TYR  30          2HB       TYR  30   4.617  -9.850   5.239
  217   2HB   TYR  30          1HB       TYR  30   6.292 -10.283   4.922
  218    HD1  TYR  30           1HD      TYR  30   3.975  -8.882   7.416
  219    HD2  TYR  30           2HD      TYR  30   7.926 -10.273   6.676
  220    HE1  TYR  30           1HE      TYR  30   4.411  -8.907   9.834
  221    HE2  TYR  30           2HE      TYR  30   8.375 -10.303   9.094
  222    HH   TYR  30           HH       TYR  30   7.206  -8.863  11.200
  223    H    TYR  31           H        TYR  31   4.854  -7.199   2.588
  224    HA   TYR  31           HA       TYR  31   6.525  -8.825   0.826
  225   1HB   TYR  31          2HB       TYR  31   3.932  -7.437   0.558
  226   2HB   TYR  31          1HB       TYR  31   4.941  -7.454  -0.882
  227    HD1  TYR  31           1HD      TYR  31   3.004  -9.497   1.461
  228    HD2  TYR  31           2HD      TYR  31   5.425  -9.532  -2.037
  229    HE1  TYR  31           1HE      TYR  31   2.243 -11.782   0.964
  230    HE2  TYR  31           2HE      TYR  31   4.670 -11.817  -2.544
  231    HH   TYR  31           HH       TYR  31   3.043 -13.755  -0.308
  232    H    CYS  32           H        CYS  32   5.533  -5.409   1.068
  233    HA   CYS  32           HA       CYS  32   7.387  -4.419  -0.779
  234   1HB   CYS  32          2HB       CYS  32   5.339  -3.311   0.559
  235   2HB   CYS  32          1HB       CYS  32   6.672  -2.686   1.523
  236    H    SER  33           H        SER  33   9.488  -4.917  -0.614
  237    HA   SER  33           HA       SER  33  11.582  -5.221   0.251
  238   1HB   SER  33          2HB       SER  33  10.659  -2.528   0.854
  239   2HB   SER  33          1HB       SER  33  11.898  -3.066   1.988
  240    HG   SER  33           HG       SER  33  12.052  -2.834  -0.823
  241    H    HIS  34           H        HIS  34  12.826  -4.705   2.598
  242    HA   HIS  34           HA       HIS  34  11.391  -6.464   4.464
  243   1HB   HIS  34          2HB       HIS  34  14.350  -5.854   4.286
  244   2HB   HIS  34          1HB       HIS  34  13.601  -6.984   5.409
  245    HD1  HIS  34           1HD      HIS  34  13.496  -6.549   1.619
  246    HD2  HIS  34           2HD      HIS  34  13.954  -9.498   4.511
  247    HE1  HIS  34           1HE      HIS  34  13.787  -8.699   0.347
  248    HE2  HIS  34           2HE      HIS  34  14.162 -10.453   2.117
  249    H    ARG  35           H        ARG  35  10.206  -4.389   5.005
  250    HA   ARG  35           HA       ARG  35  11.654  -2.449   6.571
  251   1HB   ARG  35          2HB       ARG  35   9.615  -1.969   5.121
  252   2HB   ARG  35          1HB       ARG  35   8.658  -2.739   6.379
  253   1HG   ARG  35          2HG       ARG  35   9.491  -1.083   7.995
  254   2HG   ARG  35          1HG       ARG  35  10.384  -0.292   6.695
  255   1HD   ARG  35          2HD       ARG  35   8.544   0.698   5.872
  256   2HD   ARG  35          1HD       ARG  35   7.548  -0.738   6.112
  257    HE   ARG  35           HE       ARG  35   8.041   0.339   8.621
  258   1HH1  ARG  35          1HH1      ARG  35   6.428   1.283   5.674
  259   2HH1  ARG  35          2HH1      ARG  35   5.273   2.290   6.482
  260   1HH2  ARG  35          1HH2      ARG  35   6.525   1.663   9.685
  261   2HH2  ARG  35          2HH2      ARG  35   5.328   2.506   8.759
  262    H    ILE  36           H        ILE  36  11.900  -2.401   8.722
  263    HA   ILE  36           HA       ILE  36  10.643  -4.555  10.278
  264    HB   ILE  36           HB       ILE  36  13.107  -4.528  10.274
  265   1HG1  ILE  36          2HG1      ILE  36  13.169  -4.047  12.964
  266   2HG1  ILE  36          1HG1      ILE  36  11.445  -4.278  12.693
  267   1HG2  ILE  36          1HG2      ILE  36  14.238  -2.693  11.580
  268   2HG2  ILE  36          2HG2      ILE  36  12.732  -1.785  11.448
  269   3HG2  ILE  36          3HG2      ILE  36  13.622  -2.235   9.993
  270   1HD1  ILE  36          1HD1      ILE  36  11.703  -6.469  12.557
  271   2HD1  ILE  36          2HD1      ILE  36  13.383  -6.242  13.042
  272   3HD1  ILE  36          3HD1      ILE  36  12.959  -6.303  11.331
  Start of MODEL    6
    1   1H    GLY   1          1HT       GLY   1 -10.028  11.054  -0.207
    2   2H    GLY   1          2HT       GLY   1  -8.442  10.818   0.330
    3   3H    GLY   1          3HT       GLY   1  -8.917  10.234  -1.185
    4   1HA   GLY   1          1HA       GLY   1  -7.990  12.097  -1.972
    5   2HA   GLY   1          2HA       GLY   1  -9.515  12.814  -1.475
    6    H    SER   2           H        SER   2  -6.831  14.002  -1.659
    7    HA   SER   2           HA       SER   2  -5.535  15.482  -0.516
    8   1HB   SER   2          2HB       SER   2  -8.097  15.477   0.984
    9   2HB   SER   2          1HB       SER   2  -6.706  16.184   1.805
   10    HG   SER   2           HG       SER   2  -6.453  17.599   0.072
   11    H    LEU   3           H        LEU   3  -4.392  15.843   1.655
   12    HA   LEU   3           HA       LEU   3  -3.156  13.406   2.407
   13   1HB   LEU   3          2HB       LEU   3  -1.948  14.784   4.065
   14   2HB   LEU   3          1HB       LEU   3  -1.891  15.446   2.442
   15    HG   LEU   3           HG       LEU   3  -4.068  16.481   4.142
   16   1HD1  LEU   3          1HD1      LEU   3  -1.230  16.628   4.942
   17   2HD1  LEU   3          2HD1      LEU   3  -2.694  16.736   5.918
   18   3HD1  LEU   3          3HD1      LEU   3  -2.145  18.135   4.996
   19   1HD2  LEU   3          1HD2      LEU   3  -2.293  17.364   1.963
   20   2HD2  LEU   3          2HD2      LEU   3  -2.759  18.604   3.127
   21   3HD2  LEU   3          3HD2      LEU   3  -3.999  17.707   2.251
   22    H    LEU   4           H        LEU   4  -2.812  13.032   4.902
   23    HA   LEU   4           HA       LEU   4  -3.697  12.212   6.828
   24   1HB   LEU   4          2HB       LEU   4  -4.749  14.806   6.495
   25   2HB   LEU   4          1HB       LEU   4  -6.087  13.804   7.024
   26    HG   LEU   4           HG       LEU   4  -5.082  14.777   8.960
   27   1HD1  LEU   4          1HD1      LEU   4  -5.567  12.155   8.729
   28   2HD1  LEU   4          2HD1      LEU   4  -5.019  12.907  10.226
   29   3HD1  LEU   4          3HD1      LEU   4  -3.861  12.098   9.171
   30   1HD2  LEU   4          1HD2      LEU   4  -2.563  14.022   7.600
   31   2HD2  LEU   4          2HD2      LEU   4  -2.587  13.934   9.361
   32   3HD2  LEU   4          3HD2      LEU   4  -2.957  15.455   8.550
   33    H    LYS   5           H        LYS   5  -4.525  11.087   4.280
   34    HA   LYS   5           HA       LYS   5  -6.568   9.361   5.209
   35   1HB   LYS   5          2HB       LYS   5  -7.378  11.716   3.662
   36   2HB   LYS   5          1HB       LYS   5  -7.958  10.200   2.987
   37   1HG   LYS   5          2HG       LYS   5  -8.319  10.427   5.880
   38   2HG   LYS   5          1HG       LYS   5  -9.197  11.635   4.942
   39   1HD   LYS   5          2HD       LYS   5 -10.728  10.123   4.386
   40   2HD   LYS   5          1HD       LYS   5  -9.484   9.102   3.662
   41   1HE   LYS   5          2HE       LYS   5  -9.007   8.190   5.928
   42   2HE   LYS   5          1HE       LYS   5 -10.375   9.115   6.543
   43   1HZ   LYS   5          1HZ       LYS   5 -11.525   7.824   4.526
   44   2HZ   LYS   5          2HZ       LYS   5 -11.466   7.215   6.102
   45   3HZ   LYS   5          3HZ       LYS   5 -10.345   6.688   4.951
   46    HA   PRO   6           HA       PRO   6  -4.642   6.872   2.111
   47   1HB   PRO   6          2HB       PRO   6  -6.507   4.935   1.792
   48   2HB   PRO   6          1HB       PRO   6  -5.496   5.056   3.237
   49   1HG   PRO   6          2HG       PRO   6  -8.317   5.970   2.817
   50   2HG   PRO   6          1HG       PRO   6  -7.609   5.127   4.207
   51   1HD   PRO   6          2HD       PRO   6  -8.052   7.801   4.188
   52   2HD   PRO   6          1HD       PRO   6  -6.710   7.059   5.081
   53    H    ALA   7           H        ALA   7  -4.724   6.323  -0.098
   54    HA   ALA   7           HA       ALA   7  -7.039   6.847  -1.700
   55   1HB   ALA   7          1HB       ALA   7  -6.587   8.863  -2.608
   56   2HB   ALA   7          2HB       ALA   7  -4.842   8.620  -2.545
   57   3HB   ALA   7          3HB       ALA   7  -5.716   9.110  -1.094
   58    H    ARG   8           H        ARG   8  -6.898   5.906  -3.694
   59    HA   ARG   8           HA       ARG   8  -6.117   4.572  -5.361
   60   1HB   ARG   8          2HB       ARG   8  -4.344   6.568  -5.264
   61   2HB   ARG   8          1HB       ARG   8  -3.274   5.250  -4.805
   62   1HG   ARG   8          2HG       ARG   8  -2.997   4.855  -6.966
   63   2HG   ARG   8          1HG       ARG   8  -4.661   4.268  -6.996
   64   1HD   ARG   8          2HD       ARG   8  -5.335   6.006  -8.212
   65   2HD   ARG   8          1HD       ARG   8  -4.561   7.155  -7.122
   66    HE   ARG   8           HE       ARG   8  -3.539   6.176  -9.621
   67   1HH1  ARG   8          1HH1      ARG   8  -2.677   7.534  -6.522
   68   2HH1  ARG   8          2HH1      ARG   8  -1.173   8.181  -7.083
   69   1HH2  ARG   8          1HH2      ARG   8  -1.557   7.025 -10.360
   70   2HH2  ARG   8          2HH2      ARG   8  -0.535   7.891  -9.262
   71    H    PHE   9           H        PHE   9  -5.968   2.431  -5.308
   72    HA   PHE   9           HA       PHE   9  -4.464   1.195  -3.105
   73   1HB   PHE   9          2HB       PHE   9  -5.918  -0.866  -3.998
   74   2HB   PHE   9          1HB       PHE   9  -6.536   0.280  -2.815
   75    HD1  PHE   9           1HD      PHE   9  -8.708   0.891  -3.152
   76    HD2  PHE   9           2HD      PHE   9  -6.249   0.134  -6.542
   77    HE1  PHE   9           1HE      PHE   9 -10.603   1.402  -4.635
   78    HE2  PHE   9           2HE      PHE   9  -8.139   0.645  -8.032
   79    HZ   PHE   9           HZ       PHE   9 -10.319   1.280  -7.079
   80    H    MET  10           H        MET  10  -2.555   1.671  -4.518
   81    HA   MET  10           HA       MET  10  -1.746  -0.710  -5.842
   82   1HB   MET  10          2HB       MET  10  -3.076   0.427  -7.631
   83   2HB   MET  10          1HB       MET  10  -1.959   1.782  -7.542
   84   1HG   MET  10          2HG       MET  10  -0.630  -0.784  -7.909
   85   2HG   MET  10          1HG       MET  10  -1.747  -0.379  -9.211
   86   1HE   MET  10          1HE       MET  10   1.244  -0.908  -9.475
   87   2HE   MET  10          2HE       MET  10   2.039   0.443 -10.284
   88   3HE   MET  10          3HE       MET  10   0.578  -0.263 -10.975
   89    H    CYS  11           H        CYS  11   0.385  -0.923  -5.637
   90    HA   CYS  11           HA       CYS  11   1.883   1.219  -4.395
   91   1HB   CYS  11          2HB       CYS  11   1.949  -1.424  -3.979
   92   2HB   CYS  11          1HB       CYS  11   3.217  -1.320  -5.195
   93    H    LEU  12           H        LEU  12   2.002   2.722  -6.095
   94    HA   LEU  12           HA       LEU  12   2.801   2.320  -8.694
   95   1HB   LEU  12          2HB       LEU  12   3.849   4.713  -7.243
   96   2HB   LEU  12          1HB       LEU  12   3.194   4.595  -8.863
   97    HG   LEU  12           HG       LEU  12   1.603   4.518  -6.298
   98   1HD1  LEU  12          1HD1      LEU  12   0.661   6.604  -7.712
   99   2HD1  LEU  12          2HD1      LEU  12   2.357   6.636  -8.196
  100   3HD1  LEU  12          3HD1      LEU  12   1.925   6.735  -6.489
  101   1HD2  LEU  12          1HD2      LEU  12   0.955   3.773  -9.062
  102   2HD2  LEU  12          2HD2      LEU  12  -0.186   4.885  -8.305
  103   3HD2  LEU  12          3HD2      LEU  12   0.164   3.331  -7.549
  104    HA   PRO  13           HA       PRO  13   7.401   2.623  -7.456
  105   1HB   PRO  13          2HB       PRO  13   7.739   2.567  -4.610
  106   2HB   PRO  13          1HB       PRO  13   8.060   3.904  -5.713
  107   1HG   PRO  13          2HG       PRO  13   6.069   3.886  -3.801
  108   2HG   PRO  13          1HG       PRO  13   6.079   4.920  -5.240
  109   1HD   PRO  13          2HD       PRO  13   4.622   2.351  -4.757
  110   2HD   PRO  13          1HD       PRO  13   4.079   3.813  -5.607
  111    H    CYS  14           H        CYS  14   5.974   0.320  -7.827
  112    HA   CYS  14           HA       CYS  14   7.725  -1.649  -6.693
  113   1HB   CYS  14          2HB       CYS  14   5.155  -1.126  -5.486
  114   2HB   CYS  14          1HB       CYS  14   5.211  -2.761  -6.128
  115    H    GLY  15           H        GLY  15   4.740  -1.014  -8.480
  116   1HA   GLY  15          2HA       GLY  15   4.276  -1.649 -10.669
  117   2HA   GLY  15          1HA       GLY  15   5.662  -2.721 -10.612
  118    H    ILE  16           H        ILE  16   3.156  -2.690  -8.171
  119    HA   ILE  16           HA       ILE  16   1.973  -5.125  -9.289
  120    HB   ILE  16           HB       ILE  16   2.783  -4.982  -6.390
  121   1HG1  ILE  16          2HG1      ILE  16   4.185  -6.460  -8.628
  122   2HG1  ILE  16          1HG1      ILE  16   4.785  -4.992  -7.862
  123   1HG2  ILE  16          1HG2      ILE  16   0.901  -6.520  -7.529
  124   2HG2  ILE  16          2HG2      ILE  16   1.872  -7.033  -6.149
  125   3HG2  ILE  16          3HG2      ILE  16   2.317  -7.543  -7.777
  126   1HD1  ILE  16          1HD1      ILE  16   5.258  -7.637  -7.101
  127   2HD1  ILE  16          2HD1      ILE  16   4.189  -6.964  -5.870
  128   3HD1  ILE  16          3HD1      ILE  16   5.720  -6.169  -6.241
  129    H    ALA  17           H        ALA  17  -0.007  -4.227  -9.649
  130    HA   ALA  17           HA       ALA  17  -1.311  -2.641  -7.599
  131   1HB   ALA  17          1HB       ALA  17  -2.515  -3.609 -10.185
  132   2HB   ALA  17          2HB       ALA  17  -1.498  -2.173 -10.072
  133   3HB   ALA  17          3HB       ALA  17  -3.025  -2.244  -9.191
  134    H    PHE  18           H        PHE  18  -2.531  -3.487  -6.026
  135    HA   PHE  18           HA       PHE  18  -3.184  -6.291  -6.085
  136   1HB   PHE  18          2HB       PHE  18  -3.195  -4.110  -4.056
  137   2HB   PHE  18          1HB       PHE  18  -4.201  -5.518  -3.772
  138    HD1  PHE  18           1HD      PHE  18  -3.239  -7.651  -3.234
  139    HD2  PHE  18           2HD      PHE  18  -0.766  -4.323  -4.193
  140    HE1  PHE  18           1HE      PHE  18  -1.271  -8.877  -2.406
  141    HE2  PHE  18           2HE      PHE  18   1.204  -5.542  -3.367
  142    HZ   PHE  18           HZ       PHE  18   0.955  -7.822  -2.475
  143    H    SER  19           H        SER  19  -5.351  -3.874  -4.686
  144    HA   SER  19           HA       SER  19  -7.280  -3.723  -6.662
  145   1HB   SER  19          2HB       SER  19  -7.363  -6.253  -5.120
  146   2HB   SER  19          1HB       SER  19  -8.906  -5.435  -5.357
  147    HG   SER  19           HG       SER  19  -8.708  -6.653  -7.136
  148    H    SER  20           H        SER  20  -6.707  -4.051  -3.200
  149    HA   SER  20           HA       SER  20  -8.453  -1.767  -2.770
  150   1HB   SER  20          2HB       SER  20  -8.848  -4.484  -1.717
  151   2HB   SER  20          1HB       SER  20  -8.955  -3.207  -0.505
  152    HG   SER  20           HG       SER  20 -10.707  -3.876  -2.463
  153    HA   PRO  21           HA       PRO  21  -5.415  -0.176  -0.019
  154   1HB   PRO  21          2HB       PRO  21  -6.829   0.523   2.219
  155   2HB   PRO  21          1HB       PRO  21  -6.829   1.460   0.722
  156   1HG   PRO  21          2HG       PRO  21  -8.841  -0.517   1.720
  157   2HG   PRO  21          1HG       PRO  21  -9.105   1.050   0.932
  158   1HD   PRO  21          2HD       PRO  21  -9.339  -1.268  -0.409
  159   2HD   PRO  21          1HD       PRO  21  -8.698   0.197  -1.181
  160    H    SER  22           H        SER  22  -7.706  -2.139   1.896
  161    HA   SER  22           HA       SER  22  -6.012  -2.855   3.961
  162   1HB   SER  22          2HB       SER  22  -8.490  -3.957   2.790
  163   2HB   SER  22          1HB       SER  22  -7.525  -5.107   3.715
  164    HG   SER  22           HG       SER  22  -7.733  -3.853   5.504
  165    H    THR  23           H        THR  23  -6.365  -4.328   0.768
  166    HA   THR  23           HA       THR  23  -4.756  -6.582   1.226
  167    HB   THR  23           HB       THR  23  -4.684  -5.317  -1.462
  168    HG1  THR  23           1HG      THR  23  -7.066  -6.266  -0.255
  169   1HG2  THR  23          1HG2      THR  23  -5.136  -7.505  -2.264
  170   2HG2  THR  23          2HG2      THR  23  -5.552  -8.075  -0.648
  171   3HG2  THR  23          3HG2      THR  23  -3.886  -7.635  -1.026
  172    H    LEU  24           H        LEU  24  -3.977  -3.314   0.171
  173    HA   LEU  24           HA       LEU  24  -1.275  -3.688  -0.420
  174   1HB   LEU  24          2HB       LEU  24  -2.183  -1.179   0.916
  175   2HB   LEU  24          1HB       LEU  24  -1.084  -1.388  -0.426
  176    HG   LEU  24           HG       LEU  24  -4.086  -1.530  -0.500
  177   1HD1  LEU  24          1HD1      LEU  24  -2.725   0.204  -2.384
  178   2HD1  LEU  24          2HD1      LEU  24  -2.366   0.620  -0.708
  179   3HD1  LEU  24          3HD1      LEU  24  -4.039   0.559  -1.263
  180   1HD2  LEU  24          1HD2      LEU  24  -2.966  -3.273  -1.925
  181   2HD2  LEU  24          2HD2      LEU  24  -2.213  -1.952  -2.818
  182   3HD2  LEU  24          3HD2      LEU  24  -3.969  -2.116  -2.800
  183    H    GLU  25           H        GLU  25  -2.926  -2.904   2.583
  184    HA   GLU  25           HA       GLU  25  -0.808  -2.442   4.270
  185   1HB   GLU  25          2HB       GLU  25  -3.455  -2.619   4.636
  186   2HB   GLU  25          1HB       GLU  25  -2.985  -4.163   5.333
  187   1HG   GLU  25          2HG       GLU  25  -1.249  -2.689   6.632
  188   2HG   GLU  25          1HG       GLU  25  -2.389  -1.398   6.256
  189    H    ALA  26           H        ALA  26  -2.005  -5.496   3.084
  190    HA   ALA  26           HA       ALA  26  -0.390  -7.113   4.729
  191   1HB   ALA  26          1HB       ALA  26  -2.539  -7.620   3.180
  192   2HB   ALA  26          2HB       ALA  26  -1.444  -8.869   3.772
  193   3HB   ALA  26          3HB       ALA  26  -1.245  -8.223   2.143
  194    H    HIS  27           H        HIS  27  -0.075  -5.622   1.609
  195    HA   HIS  27           HA       HIS  27   2.326  -6.968   0.838
  196   1HB   HIS  27          2HB       HIS  27   0.989  -6.051  -0.909
  197   2HB   HIS  27          1HB       HIS  27   0.903  -4.484  -0.122
  198    HD1  HIS  27           1HD      HIS  27   3.350  -6.654  -2.042
  199    HD2  HIS  27           2HD      HIS  27   2.855  -2.727  -0.784
  200    HE1  HIS  27           1HE      HIS  27   5.155  -5.308  -3.191
  201    H    GLN  28           H        GLN  28   1.595  -3.692   1.979
  202    HA   GLN  28           HA       GLN  28   4.246  -2.829   2.284
  203   1HB   GLN  28          2HB       GLN  28   1.631  -1.829   2.845
  204   2HB   GLN  28          1HB       GLN  28   2.618  -1.603   4.282
  205   1HG   GLN  28          2HG       GLN  28   3.767  -0.809   1.666
  206   2HG   GLN  28          1HG       GLN  28   2.500   0.201   2.362
  207   1HE2  GLN  28          1HE2      GLN  28   4.545   1.621   2.184
  208   2HE2  GLN  28          2HE2      GLN  28   5.499   1.721   3.620
  209    H    ALA  29           H        ALA  29   2.342  -5.020   4.126
  210    HA   ALA  29           HA       ALA  29   3.551  -4.716   6.654
  211   1HB   ALA  29          1HB       ALA  29   1.777  -6.650   5.348
  212   2HB   ALA  29          2HB       ALA  29   1.705  -5.949   6.964
  213   3HB   ALA  29          3HB       ALA  29   2.774  -7.314   6.643
  214    H    TYR  30           H        TYR  30   4.096  -7.317   4.238
  215    HA   TYR  30           HA       TYR  30   6.890  -7.402   5.140
  216   1HB   TYR  30          2HB       TYR  30   4.896  -9.617   5.150
  217   2HB   TYR  30          1HB       TYR  30   6.574  -9.999   4.787
  218    HD1  TYR  30           1HD      TYR  30   4.218  -8.952   7.361
  219    HD2  TYR  30           2HD      TYR  30   8.317  -9.685   6.488
  220    HE1  TYR  30           1HE      TYR  30   4.718  -8.986   9.768
  221    HE2  TYR  30           2HE      TYR  30   8.828  -9.724   8.893
  222    HH   TYR  30           HH       TYR  30   7.493  -8.546  11.079
  223    H    TYR  31           H        TYR  31   4.977  -6.916   2.542
  224    HA   TYR  31           HA       TYR  31   6.614  -8.475   0.686
  225   1HB   TYR  31          2HB       TYR  31   4.154  -6.788   0.188
  226   2HB   TYR  31          1HB       TYR  31   5.013  -7.704  -1.043
  227    HD1  TYR  31           1HD      TYR  31   3.575  -8.332   2.358
  228    HD2  TYR  31           2HD      TYR  31   4.070  -9.711  -1.637
  229    HE1  TYR  31           1HE      TYR  31   2.212 -10.312   2.878
  230    HE2  TYR  31           2HE      TYR  31   2.707 -11.693  -1.127
  231    HH   TYR  31           HH       TYR  31   0.939 -12.340   0.522
  232    H    CYS  32           H        CYS  32   5.583  -5.098   1.158
  233    HA   CYS  32           HA       CYS  32   7.326  -4.038  -0.806
  234   1HB   CYS  32          2HB       CYS  32   5.237  -3.013   0.526
  235   2HB   CYS  32          1HB       CYS  32   6.536  -2.329   1.496
  236    H    SER  33           H        SER  33   9.311  -5.143  -0.286
  237    HA   SER  33           HA       SER  33  11.481  -5.027   0.410
  238   1HB   SER  33          2HB       SER  33  10.693  -2.451   0.741
  239   2HB   SER  33          1HB       SER  33  11.089  -2.879   2.405
  240    HG   SER  33           HG       SER  33  12.745  -2.316   0.382
  241    H    HIS  34           H        HIS  34  12.787  -5.085   2.585
  242    HA   HIS  34           HA       HIS  34  11.475  -7.071   4.219
  243   1HB   HIS  34          2HB       HIS  34  14.250  -6.085   3.855
  244   2HB   HIS  34          1HB       HIS  34  13.853  -6.752   5.435
  245    HD1  HIS  34           1HD      HIS  34  13.572  -7.786   1.783
  246    HD2  HIS  34           2HD      HIS  34  14.118  -9.441   5.555
  247    HE1  HIS  34           1HE      HIS  34  13.960 -10.240   1.390
  248    HE2  HIS  34           2HE      HIS  34  14.370 -11.206   3.681
  249    H    ARG  35           H        ARG  35   9.842  -5.682   5.141
  250    HA   ARG  35           HA       ARG  35  10.531  -3.460   6.781
  251   1HB   ARG  35          2HB       ARG  35   7.999  -5.096   6.923
  252   2HB   ARG  35          1HB       ARG  35   8.222  -3.427   7.431
  253   1HG   ARG  35          2HG       ARG  35   8.421  -4.403   4.590
  254   2HG   ARG  35          1HG       ARG  35   7.000  -3.639   5.306
  255   1HD   ARG  35          2HD       ARG  35   9.730  -2.374   5.085
  256   2HD   ARG  35          1HD       ARG  35   8.379  -2.065   3.994
  257    HE   ARG  35           HE       ARG  35   7.672  -1.590   6.713
  258   1HH1  ARG  35          1HH1      ARG  35   9.346  -0.204   3.983
  259   2HH1  ARG  35          2HH1      ARG  35   9.104   1.429   4.504
  260   1HH2  ARG  35          1HH2      ARG  35   7.350   0.558   7.399
  261   2HH2  ARG  35          2HH2      ARG  35   7.972   1.862   6.444
  262    H    ILE  36           H        ILE  36  10.572  -3.296   9.030
  263    HA   ILE  36           HA       ILE  36  10.794  -5.852  10.483
  264    HB   ILE  36           HB       ILE  36  13.023  -4.885  10.129
  265   1HG1  ILE  36          2HG1      ILE  36  12.402  -4.433  13.028
  266   2HG1  ILE  36          1HG1      ILE  36  12.202  -6.038  12.331
  267   1HG2  ILE  36          1HG2      ILE  36  13.634  -2.762  11.197
  268   2HG2  ILE  36          2HG2      ILE  36  11.948  -2.513  11.649
  269   3HG2  ILE  36          3HG2      ILE  36  12.409  -2.544   9.947
  270   1HD1  ILE  36          1HD1      ILE  36  14.368  -6.421  12.516
  271   2HD1  ILE  36          2HD1      ILE  36  14.546  -4.860  13.315
  272   3HD1  ILE  36          3HD1      ILE  36  14.741  -4.983  11.566
  Start of MODEL    7
    1   1H    GLY   1          1HT       GLY   1  -9.677  10.911   1.162
    2   2H    GLY   1          2HT       GLY   1  -9.916  12.126   2.313
    3   3H    GLY   1          3HT       GLY   1  -8.352  11.578   1.975
    4   1HA   GLY   1          1HA       GLY   1  -9.055  12.326  -0.459
    5   2HA   GLY   1          2HA       GLY   1 -10.043  13.428   0.488
    6    H    SER   2           H        SER   2  -7.506  13.640  -1.241
    7    HA   SER   2           HA       SER   2  -5.677  14.987  -1.315
    8   1HB   SER   2          2HB       SER   2  -7.280  16.142   0.898
    9   2HB   SER   2          1HB       SER   2  -5.585  16.622   0.828
   10    HG   SER   2           HG       SER   2  -7.228  17.886  -0.425
   11    H    LEU   3           H        LEU   3  -5.886  14.791   2.221
   12    HA   LEU   3           HA       LEU   3  -3.616  12.951   2.270
   13   1HB   LEU   3          2HB       LEU   3  -2.415  14.351   3.894
   14   2HB   LEU   3          1HB       LEU   3  -2.573  15.129   2.330
   15    HG   LEU   3           HG       LEU   3  -4.638  15.772   4.362
   16   1HD1  LEU   3          1HD1      LEU   3  -1.756  16.279   4.720
   17   2HD1  LEU   3          2HD1      LEU   3  -3.051  16.180   5.912
   18   3HD1  LEU   3          3HD1      LEU   3  -2.826  17.658   4.976
   19   1HD2  LEU   3          1HD2      LEU   3  -3.515  16.882   1.919
   20   2HD2  LEU   3          2HD2      LEU   3  -3.664  18.077   3.207
   21   3HD2  LEU   3          3HD2      LEU   3  -5.080  17.168   2.680
   22    H    LEU   4           H        LEU   4  -3.060  12.693   4.820
   23    HA   LEU   4           HA       LEU   4  -3.728  11.897   6.844
   24   1HB   LEU   4          2HB       LEU   4  -5.480  14.010   6.338
   25   2HB   LEU   4          1HB       LEU   4  -6.520  12.678   6.803
   26    HG   LEU   4           HG       LEU   4  -6.001  13.956   8.762
   27   1HD1  LEU   4          1HD1      LEU   4  -5.735  11.288   8.612
   28   2HD1  LEU   4          2HD1      LEU   4  -5.585  12.201  10.113
   29   3HD1  LEU   4          3HD1      LEU   4  -4.139  11.719   9.226
   30   1HD2  LEU   4          1HD2      LEU   4  -3.268  13.886   7.640
   31   2HD2  LEU   4          2HD2      LEU   4  -3.406  13.800   9.396
   32   3HD2  LEU   4          3HD2      LEU   4  -4.103  15.165   8.522
   33    H    LYS   5           H        LYS   5  -6.670  11.717   4.826
   34    HA   LYS   5           HA       LYS   5  -6.833   8.857   5.471
   35   1HB   LYS   5          2HB       LYS   5  -8.792  10.979   5.168
   36   2HB   LYS   5          1HB       LYS   5  -9.188   9.587   4.170
   37   1HG   LYS   5          2HG       LYS   5  -8.553   8.388   6.522
   38   2HG   LYS   5          1HG       LYS   5  -9.262   9.906   7.078
   39   1HD   LYS   5          2HD       LYS   5 -11.253   9.470   5.722
   40   2HD   LYS   5          1HD       LYS   5 -10.542   7.954   5.165
   41   1HE   LYS   5          2HE       LYS   5 -10.359   7.436   7.716
   42   2HE   LYS   5          1HE       LYS   5 -11.602   8.677   7.863
   43   1HZ   LYS   5          1HZ       LYS   5 -12.713   7.259   5.982
   44   2HZ   LYS   5          2HZ       LYS   5 -12.884   6.828   7.608
   45   3HZ   LYS   5          3HZ       LYS   5 -11.760   6.023   6.635
   46    HA   PRO   6           HA       PRO   6  -5.169   8.408   1.252
   47   1HB   PRO   6          2HB       PRO   6  -5.646   5.569   2.014
   48   2HB   PRO   6          1HB       PRO   6  -4.213   6.317   1.302
   49   1HG   PRO   6          2HG       PRO   6  -4.248   5.635   3.873
   50   2HG   PRO   6          1HG       PRO   6  -3.463   7.132   3.339
   51   1HD   PRO   6          2HD       PRO   6  -6.096   6.748   4.696
   52   2HD   PRO   6          1HD       PRO   6  -4.902   8.047   4.894
   53    H    ALA   7           H        ALA   7  -5.935   6.856  -0.583
   54    HA   ALA   7           HA       ALA   7  -8.580   5.895  -0.613
   55   1HB   ALA   7          1HB       ALA   7  -9.307   7.772  -2.333
   56   2HB   ALA   7          2HB       ALA   7  -8.194   8.741  -1.368
   57   3HB   ALA   7          3HB       ALA   7  -9.568   7.949  -0.598
   58    H    ARG   8           H        ARG   8  -6.029   5.041  -1.492
   59    HA   ARG   8           HA       ARG   8  -6.660   4.502  -4.285
   60   1HB   ARG   8          2HB       ARG   8  -4.324   6.058  -3.345
   61   2HB   ARG   8          1HB       ARG   8  -3.992   4.823  -4.551
   62   1HG   ARG   8          2HG       ARG   8  -5.509   5.826  -6.099
   63   2HG   ARG   8          1HG       ARG   8  -6.086   6.958  -4.874
   64   1HD   ARG   8          2HD       ARG   8  -4.558   8.107  -6.325
   65   2HD   ARG   8          1HD       ARG   8  -3.797   7.906  -4.748
   66    HE   ARG   8           HE       ARG   8  -2.972   5.747  -6.221
   67   1HH1  ARG   8          1HH1      ARG   8  -2.785   9.216  -6.565
   68   2HH1  ARG   8          2HH1      ARG   8  -1.297   9.173  -7.451
   69   1HH2  ARG   8          1HH2      ARG   8  -1.016   5.690  -7.387
   70   2HH2  ARG   8          2HH2      ARG   8  -0.293   7.171  -7.918
   71    H    PHE   9           H        PHE   9  -5.123   2.799  -5.178
   72    HA   PHE   9           HA       PHE   9  -3.927   1.072  -3.174
   73   1HB   PHE   9          2HB       PHE   9  -5.259  -0.897  -4.273
   74   2HB   PHE   9          1HB       PHE   9  -6.004   0.058  -2.997
   75    HD1  PHE   9           1HD      PHE   9  -7.815   1.583  -3.477
   76    HD2  PHE   9           2HD      PHE   9  -6.015  -0.725  -6.564
   77    HE1  PHE   9           1HE      PHE   9  -9.709   2.097  -4.960
   78    HE2  PHE   9           2HE      PHE   9  -7.905  -0.214  -8.054
   79    HZ   PHE   9           HZ       PHE   9  -9.755   1.200  -7.253
   80    H    MET  10           H        MET  10  -2.047   1.727  -4.391
   81    HA   MET  10           HA       MET  10  -1.376  -0.158  -6.429
   82   1HB   MET  10          2HB       MET  10  -2.271   2.526  -7.196
   83   2HB   MET  10          1HB       MET  10  -0.697   2.098  -7.853
   84   1HG   MET  10          2HG       MET  10  -1.540   0.505  -9.214
   85   2HG   MET  10          1HG       MET  10  -2.829   0.071  -8.093
   86   1HE   MET  10          1HE       MET  10  -1.883   1.119 -11.129
   87   2HE   MET  10          2HE       MET  10  -2.245   2.835 -11.317
   88   3HE   MET  10          3HE       MET  10  -3.395   1.623 -11.883
   89    H    CYS  11           H        CYS  11   0.676  -0.670  -6.054
   90    HA   CYS  11           HA       CYS  11   2.361   1.192  -4.572
   91   1HB   CYS  11          2HB       CYS  11   2.072  -1.370  -4.104
   92   2HB   CYS  11          1HB       CYS  11   3.256  -1.548  -5.393
   93    H    LEU  12           H        LEU  12   2.855   2.709  -6.139
   94    HA   LEU  12           HA       LEU  12   3.663   2.312  -8.738
   95   1HB   LEU  12          2HB       LEU  12   5.002   4.427  -7.108
   96   2HB   LEU  12          1HB       LEU  12   4.415   4.503  -8.757
   97    HG   LEU  12           HG       LEU  12   2.088   4.128  -7.367
   98   1HD1  LEU  12          1HD1      LEU  12   3.307   6.259  -5.744
   99   2HD1  LEU  12          2HD1      LEU  12   3.803   4.613  -5.344
  100   3HD1  LEU  12          3HD1      LEU  12   2.095   5.051  -5.316
  101   1HD2  LEU  12          1HD2      LEU  12   3.518   6.455  -8.521
  102   2HD2  LEU  12          2HD2      LEU  12   2.095   6.783  -7.534
  103   3HD2  LEU  12          3HD2      LEU  12   1.962   5.749  -8.956
  104    HA   PRO  13           HA       PRO  13   8.290   2.085  -7.231
  105   1HB   PRO  13          2HB       PRO  13   8.619   1.056  -4.711
  106   2HB   PRO  13          1HB       PRO  13   8.618   2.781  -5.087
  107   1HG   PRO  13          2HG       PRO  13   6.417   1.075  -4.006
  108   2HG   PRO  13          1HG       PRO  13   6.883   2.725  -3.554
  109   1HD   PRO  13          2HD       PRO  13   4.777   2.217  -5.148
  110   2HD   PRO  13          1HD       PRO  13   5.781   3.663  -5.354
  111    H    CYS  14           H        CYS  14   5.753  -0.147  -6.877
  112    HA   CYS  14           HA       CYS  14   7.611  -2.397  -7.240
  113   1HB   CYS  14          2HB       CYS  14   4.983  -2.178  -5.819
  114   2HB   CYS  14          1HB       CYS  14   5.493  -3.722  -6.482
  115    H    GLY  15           H        GLY  15   4.762  -0.733  -8.377
  116   1HA   GLY  15          2HA       GLY  15   3.836  -0.732 -10.482
  117   2HA   GLY  15          1HA       GLY  15   5.028  -1.928 -10.950
  118    H    ILE  16           H        ILE  16   2.850  -2.286  -8.233
  119    HA   ILE  16           HA       ILE  16   1.300  -4.277  -9.748
  120    HB   ILE  16           HB       ILE  16   2.157  -4.673  -6.882
  121   1HG1  ILE  16          2HG1      ILE  16   3.283  -6.129  -9.272
  122   2HG1  ILE  16          1HG1      ILE  16   4.051  -4.693  -8.602
  123   1HG2  ILE  16          1HG2      ILE  16   0.483  -6.154  -8.815
  124   2HG2  ILE  16          2HG2      ILE  16   0.363  -6.041  -7.060
  125   3HG2  ILE  16          3HG2      ILE  16   1.553  -7.116  -7.795
  126   1HD1  ILE  16          1HD1      ILE  16   4.858  -7.032  -7.870
  127   2HD1  ILE  16          2HD1      ILE  16   3.424  -7.021  -6.843
  128   3HD1  ILE  16          3HD1      ILE  16   4.654  -5.771  -6.654
  129    H    ALA  17           H        ALA  17  -0.682  -3.430  -9.857
  130    HA   ALA  17           HA       ALA  17  -1.728  -1.777  -7.719
  131   1HB   ALA  17          1HB       ALA  17  -2.109  -1.191 -10.082
  132   2HB   ALA  17          2HB       ALA  17  -3.615  -1.395  -9.189
  133   3HB   ALA  17          3HB       ALA  17  -3.057  -2.665 -10.278
  134    H    PHE  18           H        PHE  18  -2.679  -2.643  -5.996
  135    HA   PHE  18           HA       PHE  18  -3.727  -5.336  -6.079
  136   1HB   PHE  18          2HB       PHE  18  -3.023  -3.346  -3.994
  137   2HB   PHE  18          1HB       PHE  18  -4.246  -4.534  -3.586
  138    HD1  PHE  18           1HD      PHE  18  -3.683  -6.912  -3.473
  139    HD2  PHE  18           2HD      PHE  18  -0.733  -3.960  -4.307
  140    HE1  PHE  18           1HE      PHE  18  -1.912  -8.548  -2.984
  141    HE2  PHE  18           2HE      PHE  18   1.043  -5.591  -3.819
  142    HZ   PHE  18           HZ       PHE  18   0.455  -7.889  -3.158
  143    H    SER  19           H        SER  19  -5.859  -5.915  -5.790
  144    HA   SER  19           HA       SER  19  -7.804  -3.895  -6.502
  145   1HB   SER  19          2HB       SER  19  -7.551  -6.512  -7.183
  146   2HB   SER  19          1HB       SER  19  -8.758  -6.621  -5.901
  147    HG   SER  19           HG       SER  19  -8.970  -5.587  -8.433
  148    H    SER  20           H        SER  20  -6.579  -3.989  -3.711
  149    HA   SER  20           HA       SER  20  -8.992  -3.390  -2.333
  150   1HB   SER  20          2HB       SER  20  -7.861  -6.068  -2.060
  151   2HB   SER  20          1HB       SER  20  -8.060  -5.246  -0.513
  152    HG   SER  20           HG       SER  20 -10.121  -5.352  -2.445
  153    HA   PRO  21           HA       PRO  21  -6.122  -0.831  -0.137
  154   1HB   PRO  21          2HB       PRO  21  -8.048  -0.714   2.075
  155   2HB   PRO  21          1HB       PRO  21  -7.502   0.574   0.999
  156   1HG   PRO  21          2HG       PRO  21  -9.993  -0.443   0.866
  157   2HG   PRO  21          1HG       PRO  21  -9.128   0.135  -0.569
  158   1HD   PRO  21          2HD       PRO  21  -9.540  -2.672   0.394
  159   2HD   PRO  21          1HD       PRO  21  -9.621  -2.023  -1.258
  160    H    SER  22           H        SER  22  -7.855  -3.222   1.864
  161    HA   SER  22           HA       SER  22  -6.014  -3.331   3.969
  162   1HB   SER  22          2HB       SER  22  -8.417  -4.549   3.413
  163   2HB   SER  22          1HB       SER  22  -7.288  -5.901   3.325
  164    HG   SER  22           HG       SER  22  -7.893  -4.223   5.497
  165    H    THR  23           H        THR  23  -6.033  -4.876   0.829
  166    HA   THR  23           HA       THR  23  -4.011  -6.780   1.340
  167    HB   THR  23           HB       THR  23  -4.205  -5.617  -1.384
  168    HG1  THR  23           1HG      THR  23  -6.353  -7.055  -0.220
  169   1HG2  THR  23          1HG2      THR  23  -2.979  -7.643  -1.172
  170   2HG2  THR  23          2HG2      THR  23  -4.497  -8.010  -1.992
  171   3HG2  THR  23          3HG2      THR  23  -4.296  -8.412  -0.287
  172    H    LEU  24           H        LEU  24  -3.965  -3.406   0.424
  173    HA   LEU  24           HA       LEU  24  -1.271  -3.195  -0.314
  174   1HB   LEU  24          2HB       LEU  24  -2.640  -0.984   1.159
  175   2HB   LEU  24          1HB       LEU  24  -1.552  -0.897  -0.207
  176    HG   LEU  24           HG       LEU  24  -4.417  -1.816  -0.324
  177   1HD1  LEU  24          1HD1      LEU  24  -4.892   0.266  -1.397
  178   2HD1  LEU  24          2HD1      LEU  24  -3.189   0.723  -1.374
  179   3HD1  LEU  24          3HD1      LEU  24  -4.091   0.607   0.136
  180   1HD2  LEU  24          1HD2      LEU  24  -3.593  -2.886  -2.138
  181   2HD2  LEU  24          2HD2      LEU  24  -2.186  -1.830  -2.258
  182   3HD2  LEU  24          3HD2      LEU  24  -3.752  -1.285  -2.860
  183    H    GLU  25           H        GLU  25  -2.924  -2.864   2.766
  184    HA   GLU  25           HA       GLU  25  -0.653  -2.201   4.301
  185   1HB   GLU  25          2HB       GLU  25  -3.284  -2.239   4.826
  186   2HB   GLU  25          1HB       GLU  25  -2.841  -3.771   5.567
  187   1HG   GLU  25          2HG       GLU  25  -1.296  -2.684   7.035
  188   2HG   GLU  25          1HG       GLU  25  -1.509  -1.147   6.198
  189    H    ALA  26           H        ALA  26  -1.933  -5.199   3.135
  190    HA   ALA  26           HA       ALA  26  -0.379  -6.861   4.814
  191   1HB   ALA  26          1HB       ALA  26  -2.396  -7.797   3.973
  192   2HB   ALA  26          2HB       ALA  26  -1.070  -8.665   3.199
  193   3HB   ALA  26          3HB       ALA  26  -1.944  -7.419   2.310
  194    H    HIS  27           H        HIS  27  -0.087  -5.445   1.657
  195    HA   HIS  27           HA       HIS  27   2.284  -6.871   0.905
  196   1HB   HIS  27          2HB       HIS  27   0.862  -6.023  -0.845
  197   2HB   HIS  27          1HB       HIS  27   0.917  -4.398  -0.179
  198    HD1  HIS  27           1HD      HIS  27   3.016  -6.839  -2.149
  199    HD2  HIS  27           2HD      HIS  27   3.064  -2.869  -0.924
  200    HE1  HIS  27           1HE      HIS  27   4.890  -5.723  -3.428
  201    H    GLN  28           H        GLN  28   1.542  -3.588   1.967
  202    HA   GLN  28           HA       GLN  28   4.199  -2.674   2.157
  203   1HB   GLN  28          2HB       GLN  28   1.542  -1.734   2.894
  204   2HB   GLN  28          1HB       GLN  28   2.750  -1.272   4.083
  205   1HG   GLN  28          2HG       GLN  28   3.971  -0.682   1.695
  206   2HG   GLN  28          1HG       GLN  28   2.285  -0.268   1.398
  207   1HE2  GLN  28          1HE2      GLN  28   4.881   0.180   3.762
  208   2HE2  GLN  28          2HE2      GLN  28   4.429   1.783   4.216
  209    H    ALA  29           H        ALA  29   2.335  -4.794   4.106
  210    HA   ALA  29           HA       ALA  29   3.574  -4.373   6.607
  211   1HB   ALA  29          1HB       ALA  29   1.859  -6.467   5.406
  212   2HB   ALA  29          2HB       ALA  29   1.650  -5.541   6.891
  213   3HB   ALA  29          3HB       ALA  29   2.778  -6.896   6.849
  214    H    TYR  30           H        TYR  30   4.047  -7.122   4.344
  215    HA   TYR  30           HA       TYR  30   6.889  -7.083   4.969
  216   1HB   TYR  30          2HB       TYR  30   4.994  -9.301   5.660
  217   2HB   TYR  30          1HB       TYR  30   6.687  -9.631   5.336
  218    HD1  TYR  30           1HD      TYR  30   4.292  -8.314   7.704
  219    HD2  TYR  30           2HD      TYR  30   8.439  -8.668   6.828
  220    HE1  TYR  30           1HE      TYR  30   4.825  -7.739  10.033
  221    HE2  TYR  30           2HE      TYR  30   8.986  -8.095   9.156
  222    HH   TYR  30           HH       TYR  30   7.167  -8.345  11.588
  223    H    TYR  31           H        TYR  31   4.961  -6.819   2.566
  224    HA   TYR  31           HA       TYR  31   6.180  -8.924   0.909
  225   1HB   TYR  31          2HB       TYR  31   3.532  -8.339   1.157
  226   2HB   TYR  31          1HB       TYR  31   3.960  -7.376  -0.254
  227    HD1  TYR  31           1HD      TYR  31   3.640 -10.769   1.093
  228    HD2  TYR  31           2HD      TYR  31   4.633  -8.444  -2.329
  229    HE1  TYR  31           1HE      TYR  31   3.488 -12.781  -0.311
  230    HE2  TYR  31           2HE      TYR  31   4.483 -10.451  -3.743
  231    HH   TYR  31           HH       TYR  31   3.103 -13.357  -2.669
  232    H    CYS  32           H        CYS  32   5.800  -5.485   1.312
  233    HA   CYS  32           HA       CYS  32   6.832  -4.780  -1.264
  234   1HB   CYS  32          2HB       CYS  32   5.368  -3.355   0.330
  235   2HB   CYS  32          1HB       CYS  32   6.886  -2.961   1.128
  236    H    SER  33           H        SER  33   8.183  -5.105   1.980
  237    HA   SER  33           HA       SER  33  10.756  -5.747   1.063
  238   1HB   SER  33          2HB       SER  33  10.422  -3.113   0.692
  239   2HB   SER  33          1HB       SER  33  10.929  -3.087   2.382
  240    HG   SER  33           HG       SER  33  12.869  -3.813   1.835
  241    H    HIS  34           H        HIS  34  12.293  -6.046   2.815
  242    HA   HIS  34           HA       HIS  34  10.987  -6.932   5.205
  243   1HB   HIS  34          2HB       HIS  34  13.934  -6.795   4.528
  244   2HB   HIS  34          1HB       HIS  34  13.244  -7.642   5.908
  245    HD1  HIS  34           1HD      HIS  34  13.351  -7.795   2.137
  246    HD2  HIS  34           2HD      HIS  34  12.329 -10.180   5.383
  247    HE1  HIS  34           1HE      HIS  34  12.951 -10.088   1.186
  248    HE2  HIS  34           2HE      HIS  34  12.409 -11.531   3.179
  249    H    ARG  35           H        ARG  35  10.172  -4.666   5.627
  250    HA   ARG  35           HA       ARG  35  12.022  -2.726   6.629
  251   1HB   ARG  35          2HB       ARG  35   9.934  -1.979   5.669
  252   2HB   ARG  35          1HB       ARG  35   9.012  -2.933   6.823
  253   1HG   ARG  35          2HG       ARG  35   9.913  -1.522   8.644
  254   2HG   ARG  35          1HG       ARG  35  10.713  -0.524   7.428
  255   1HD   ARG  35          2HD       ARG  35   7.742  -1.018   7.588
  256   2HD   ARG  35          1HD       ARG  35   8.561   0.421   8.193
  257    HE   ARG  35           HE       ARG  35   9.333   0.323   5.607
  258   1HH1  ARG  35          1HH1      ARG  35   6.211   0.197   7.161
  259   2HH1  ARG  35          2HH1      ARG  35   5.382   0.939   5.834
  260   1HH2  ARG  35          1HH2      ARG  35   8.244   1.299   3.861
  261   2HH2  ARG  35          2HH2      ARG  35   6.536   1.564   3.961
  262    H    ILE  36           H        ILE  36  12.212  -2.004   8.805
  263    HA   ILE  36           HA       ILE  36  11.224  -3.805  10.885
  264    HB   ILE  36           HB       ILE  36  13.454  -4.656  10.282
  265   1HG1  ILE  36          2HG1      ILE  36  14.443  -3.913  12.739
  266   2HG1  ILE  36          1HG1      ILE  36  12.718  -3.618  12.929
  267   1HG2  ILE  36          1HG2      ILE  36  15.435  -3.214  10.900
  268   2HG2  ILE  36          2HG2      ILE  36  14.316  -1.851  10.935
  269   3HG2  ILE  36          3HG2      ILE  36  14.563  -2.749   9.438
  270   1HD1  ILE  36          1HD1      ILE  36  12.207  -5.808  12.887
  271   2HD1  ILE  36          2HD1      ILE  36  13.883  -5.976  13.410
  272   3HD1  ILE  36          3HD1      ILE  36  13.463  -6.194  11.711
  Start of MODEL    8
    1   1H    GLY   1          1HT       GLY   1  -7.071  12.112  -2.925
    2   2H    GLY   1          2HT       GLY   1  -6.554  13.232  -4.081
    3   3H    GLY   1          3HT       GLY   1  -8.189  12.813  -3.984
    4   1HA   GLY   1          1HA       GLY   1  -8.387  14.688  -2.800
    5   2HA   GLY   1          2HA       GLY   1  -7.798  13.666  -1.497
    6    H    SER   2           H        SER   2  -6.061  14.350  -0.431
    7    HA   SER   2           HA       SER   2  -3.787  15.509  -1.592
    8   1HB   SER   2          2HB       SER   2  -5.825  17.355  -1.491
    9   2HB   SER   2          1HB       SER   2  -4.954  17.678   0.007
   10    HG   SER   2           HG       SER   2  -3.042  17.864  -1.253
   11    H    LEU   3           H        LEU   3  -5.801  15.694   1.336
   12    HA   LEU   3           HA       LEU   3  -3.581  15.812   3.116
   13   1HB   LEU   3          2HB       LEU   3  -5.336  15.267   4.854
   14   2HB   LEU   3          1HB       LEU   3  -5.599  16.723   3.915
   15    HG   LEU   3           HG       LEU   3  -6.889  14.351   2.775
   16   1HD1  LEU   3          1HD1      LEU   3  -7.015  14.018   5.307
   17   2HD1  LEU   3          2HD1      LEU   3  -8.525  13.986   4.399
   18   3HD1  LEU   3          3HD1      LEU   3  -8.076  15.427   5.310
   19   1HD2  LEU   3          1HD2      LEU   3  -7.678  16.224   1.780
   20   2HD2  LEU   3          2HD2      LEU   3  -7.415  17.227   3.207
   21   3HD2  LEU   3          3HD2      LEU   3  -8.823  16.168   3.120
   22    H    LEU   4           H        LEU   4  -3.885  14.030   5.068
   23    HA   LEU   4           HA       LEU   4  -2.599  11.741   4.177
   24   1HB   LEU   4          2HB       LEU   4  -4.207  12.232   6.678
   25   2HB   LEU   4          1HB       LEU   4  -3.268  10.776   6.414
   26    HG   LEU   4           HG       LEU   4  -1.547  12.985   5.941
   27   1HD1  LEU   4          1HD1      LEU   4  -3.110  13.197   8.507
   28   2HD1  LEU   4          2HD1      LEU   4  -3.036  14.388   7.208
   29   3HD1  LEU   4          3HD1      LEU   4  -1.600  14.045   8.172
   30   1HD2  LEU   4          1HD2      LEU   4  -1.034  10.664   6.771
   31   2HD2  LEU   4          2HD2      LEU   4  -1.618  11.184   8.352
   32   3HD2  LEU   4          3HD2      LEU   4  -0.217  11.973   7.625
   33    H    LYS   5           H        LYS   5  -3.736   9.492   5.121
   34    HA   LYS   5           HA       LYS   5  -5.322   7.879   4.803
   35   1HB   LYS   5          2HB       LYS   5  -6.870  10.204   4.817
   36   2HB   LYS   5          1HB       LYS   5  -7.336   9.374   3.339
   37   1HG   LYS   5          2HG       LYS   5  -7.474   7.299   4.960
   38   2HG   LYS   5          1HG       LYS   5  -7.697   8.562   6.171
   39   1HD   LYS   5          2HD       LYS   5  -9.468   9.494   4.534
   40   2HD   LYS   5          1HD       LYS   5  -9.410   7.888   3.806
   41   1HE   LYS   5          2HE       LYS   5 -10.325   6.871   5.646
   42   2HE   LYS   5          1HE       LYS   5  -9.726   8.101   6.757
   43   1HZ   LYS   5          1HZ       LYS   5 -12.268   7.900   5.680
   44   2HZ   LYS   5          2HZ       LYS   5 -11.564   9.249   4.942
   45   3HZ   LYS   5          3HZ       LYS   5 -11.653   9.159   6.629
   46    HA   PRO   6           HA       PRO   6  -4.055   6.862   0.664
   47   1HB   PRO   6          2HB       PRO   6  -5.155   4.387   0.515
   48   2HB   PRO   6          1HB       PRO   6  -3.692   4.731   1.446
   49   1HG   PRO   6          2HG       PRO   6  -6.521   4.465   2.392
   50   2HG   PRO   6          1HG       PRO   6  -5.035   3.817   3.112
   51   1HD   PRO   6          2HD       PRO   6  -6.242   6.056   4.036
   52   2HD   PRO   6          1HD       PRO   6  -4.482   5.830   4.092
   53    H    ALA   7           H        ALA   7  -4.942   7.574  -1.158
   54    HA   ALA   7           HA       ALA   7  -7.852   7.619  -1.424
   55   1HB   ALA   7          1HB       ALA   7  -6.223   8.815  -3.559
   56   2HB   ALA   7          2HB       ALA   7  -6.007   9.527  -1.960
   57   3HB   ALA   7          3HB       ALA   7  -7.613   9.464  -2.687
   58    H    ARG   8           H        ARG   8  -4.978   6.299  -2.966
   59    HA   ARG   8           HA       ARG   8  -6.727   4.697  -4.717
   60   1HB   ARG   8          2HB       ARG   8  -4.733   4.581  -6.261
   61   2HB   ARG   8          1HB       ARG   8  -5.500   6.158  -6.133
   62   1HG   ARG   8          2HG       ARG   8  -3.758   6.909  -4.620
   63   2HG   ARG   8          1HG       ARG   8  -3.002   5.316  -4.677
   64   1HD   ARG   8          2HD       ARG   8  -3.299   7.295  -6.927
   65   2HD   ARG   8          1HD       ARG   8  -1.805   6.749  -6.167
   66    HE   ARG   8           HE       ARG   8  -2.907   4.465  -7.137
   67   1HH1  ARG   8          1HH1      ARG   8  -2.105   7.553  -8.552
   68   2HH1  ARG   8          2HH1      ARG   8  -1.793   6.893 -10.123
   69   1HH2  ARG   8          1HH2      ARG   8  -2.496   3.595  -9.202
   70   2HH2  ARG   8          2HH2      ARG   8  -2.016   4.646 -10.492
   71    H    PHE   9           H        PHE   9  -5.362   2.710  -5.562
   72    HA   PHE   9           HA       PHE   9  -3.850   1.537  -3.337
   73   1HB   PHE   9          2HB       PHE   9  -5.370  -0.555  -4.514
   74   2HB   PHE   9          1HB       PHE   9  -5.456   0.054  -2.868
   75    HD1  PHE   9           1HD      PHE   9  -7.074   1.867  -2.317
   76    HD2  PHE   9           2HD      PHE   9  -7.080  -0.127  -6.075
   77    HE1  PHE   9           1HE      PHE   9  -9.361   2.671  -2.735
   78    HE2  PHE   9           2HE      PHE   9  -9.367   0.673  -6.500
   79    HZ   PHE   9           HZ       PHE   9 -10.511   2.075  -4.829
   80    H    MET  10           H        MET  10  -1.985   1.913  -4.621
   81    HA   MET  10           HA       MET  10  -1.336  -0.269  -6.342
   82   1HB   MET  10          2HB       MET  10  -2.489   1.972  -7.591
   83   2HB   MET  10          1HB       MET  10  -0.767   2.075  -7.928
   84   1HG   MET  10          2HG       MET  10  -0.741   0.017  -9.033
   85   2HG   MET  10          1HG       MET  10  -2.302  -0.459  -8.367
   86   1HE   MET  10          1HE       MET  10  -0.562   0.174 -11.219
   87   2HE   MET  10          2HE       MET  10  -0.609   1.936 -11.252
   88   3HE   MET  10          3HE       MET  10  -1.583   1.007 -12.392
   89    H    CYS  11           H        CYS  11   0.710  -0.734  -5.900
   90    HA   CYS  11           HA       CYS  11   2.400   1.242  -4.621
   91   1HB   CYS  11          2HB       CYS  11   2.142  -1.416  -4.223
   92   2HB   CYS  11          1HB       CYS  11   3.515  -1.413  -5.325
   93    H    LEU  12           H        LEU  12   2.736   2.694  -6.357
   94    HA   LEU  12           HA       LEU  12   3.602   2.102  -8.910
   95   1HB   LEU  12          2HB       LEU  12   4.770   4.467  -7.505
   96   2HB   LEU  12          1HB       LEU  12   4.185   4.329  -9.150
   97    HG   LEU  12           HG       LEU  12   1.878   3.950  -7.751
   98   1HD1  LEU  12          1HD1      LEU  12   2.182   6.138  -6.202
   99   2HD1  LEU  12          2HD1      LEU  12   3.769   5.392  -6.019
  100   3HD1  LEU  12          3HD1      LEU  12   2.316   4.483  -5.609
  101   1HD2  LEU  12          1HD2      LEU  12   2.751   5.646  -9.626
  102   2HD2  LEU  12          2HD2      LEU  12   2.631   6.762  -8.265
  103   3HD2  LEU  12          3HD2      LEU  12   1.213   5.851  -8.786
  104    HA   PRO  13           HA       PRO  13   8.149   2.113  -7.414
  105   1HB   PRO  13          2HB       PRO  13   8.263   2.073  -4.536
  106   2HB   PRO  13          1HB       PRO  13   8.822   3.335  -5.634
  107   1HG   PRO  13          2HG       PRO  13   6.709   3.620  -3.904
  108   2HG   PRO  13          1HG       PRO  13   6.911   4.558  -5.394
  109   1HD   PRO  13          2HD       PRO  13   5.201   2.152  -4.885
  110   2HD   PRO  13          1HD       PRO  13   4.833   3.618  -5.818
  111    H    CYS  14           H        CYS  14   6.560  -0.094  -7.832
  112    HA   CYS  14           HA       CYS  14   8.090  -2.153  -6.527
  113   1HB   CYS  14          2HB       CYS  14   5.451  -1.454  -5.592
  114   2HB   CYS  14          1HB       CYS  14   5.467  -3.100  -6.210
  115    H    GLY  15           H        GLY  15   5.335  -1.387  -8.608
  116   1HA   GLY  15          2HA       GLY  15   5.274  -2.010 -10.900
  117   2HA   GLY  15          1HA       GLY  15   6.304  -3.370 -10.504
  118    H    ILE  16           H        ILE  16   3.544  -2.537  -8.559
  119    HA   ILE  16           HA       ILE  16   1.956  -4.677  -9.777
  120    HB   ILE  16           HB       ILE  16   2.104  -4.533  -6.789
  121   1HG1  ILE  16          2HG1      ILE  16   3.916  -6.245  -8.507
  122   2HG1  ILE  16          1HG1      ILE  16   4.437  -4.803  -7.640
  123   1HG2  ILE  16          1HG2      ILE  16   0.848  -6.196  -8.789
  124   2HG2  ILE  16          2HG2      ILE  16   0.538  -6.087  -7.056
  125   3HG2  ILE  16          3HG2      ILE  16   1.805  -7.156  -7.660
  126   1HD1  ILE  16          1HD1      ILE  16   4.882  -7.081  -6.579
  127   2HD1  ILE  16          2HD1      ILE  16   3.157  -7.098  -6.209
  128   3HD1  ILE  16          3HD1      ILE  16   4.185  -5.819  -5.563
  129    H    ALA  17           H        ALA  17  -0.314  -4.632  -9.115
  130    HA   ALA  17           HA       ALA  17  -1.198  -2.083  -7.963
  131   1HB   ALA  17          1HB       ALA  17  -2.989  -2.018  -9.771
  132   2HB   ALA  17          2HB       ALA  17  -1.994  -3.183 -10.645
  133   3HB   ALA  17          3HB       ALA  17  -1.350  -1.587 -10.258
  134    H    PHE  18           H        PHE  18  -2.403  -2.610  -6.260
  135    HA   PHE  18           HA       PHE  18  -3.761  -5.142  -6.110
  136   1HB   PHE  18          2HB       PHE  18  -3.281  -2.849  -4.232
  137   2HB   PHE  18          1HB       PHE  18  -4.410  -4.120  -3.832
  138    HD1  PHE  18           1HD      PHE  18  -3.564  -5.668  -2.369
  139    HD2  PHE  18           2HD      PHE  18  -0.990  -3.973  -5.302
  140    HE1  PHE  18           1HE      PHE  18  -1.710  -7.057  -1.538
  141    HE2  PHE  18           2HE      PHE  18   0.868  -5.359  -4.479
  142    HZ   PHE  18           HZ       PHE  18   0.510  -6.903  -2.593
  143    H    SER  19           H        SER  19  -6.000  -4.657  -4.689
  144    HA   SER  19           HA       SER  19  -7.605  -2.618  -5.960
  145   1HB   SER  19          2HB       SER  19  -7.802  -5.499  -6.693
  146   2HB   SER  19          1HB       SER  19  -9.307  -4.599  -6.516
  147    HG   SER  19           HG       SER  19  -8.489  -3.095  -8.037
  148    H    SER  20           H        SER  20  -6.758  -3.328  -3.263
  149    HA   SER  20           HA       SER  20  -9.279  -3.053  -1.972
  150   1HB   SER  20          2HB       SER  20  -8.030  -5.715  -2.107
  151   2HB   SER  20          1HB       SER  20  -8.505  -5.207  -0.487
  152    HG   SER  20           HG       SER  20 -10.584  -5.096  -1.115
  153    HA   PRO  21           HA       PRO  21  -6.548  -0.690   0.636
  154   1HB   PRO  21          2HB       PRO  21  -8.726  -1.142   2.620
  155   2HB   PRO  21          1HB       PRO  21  -7.951   0.366   2.123
  156   1HG   PRO  21          2HG       PRO  21 -10.390  -0.245   1.259
  157   2HG   PRO  21          1HG       PRO  21  -9.213   0.530   0.182
  158   1HD   PRO  21          2HD       PRO  21 -10.110  -2.317   0.280
  159   2HD   PRO  21          1HD       PRO  21  -9.692  -1.311  -1.122
  160    H    SER  22           H        SER  22  -8.356  -3.240   2.373
  161    HA   SER  22           HA       SER  22  -6.472  -3.712   4.359
  162   1HB   SER  22          2HB       SER  22  -8.620  -5.417   3.128
  163   2HB   SER  22          1HB       SER  22  -7.543  -6.089   4.351
  164    HG   SER  22           HG       SER  22  -9.377  -5.232   5.338
  165    H    THR  23           H        THR  23  -6.683  -5.034   1.097
  166    HA   THR  23           HA       THR  23  -4.710  -7.017   1.392
  167    HB   THR  23           HB       THR  23  -5.149  -5.540  -1.187
  168    HG1  THR  23           1HG      THR  23  -6.880  -7.504  -0.100
  169   1HG2  THR  23          1HG2      THR  23  -4.594  -7.473  -2.258
  170   2HG2  THR  23          2HG2      THR  23  -5.111  -8.496  -0.918
  171   3HG2  THR  23          3HG2      THR  23  -3.588  -7.612  -0.817
  172    H    LEU  24           H        LEU  24  -4.528  -3.602   0.559
  173    HA   LEU  24           HA       LEU  24  -1.840  -3.480  -0.182
  174   1HB   LEU  24          2HB       LEU  24  -3.050  -1.269   1.416
  175   2HB   LEU  24          1HB       LEU  24  -2.019  -1.187   0.009
  176    HG   LEU  24           HG       LEU  24  -4.965  -1.773   0.083
  177   1HD1  LEU  24          1HD1      LEU  24  -3.655   0.296  -1.605
  178   2HD1  LEU  24          2HD1      LEU  24  -3.867   0.608   0.117
  179   3HD1  LEU  24          3HD1      LEU  24  -5.270   0.272  -0.897
  180   1HD2  LEU  24          1HD2      LEU  24  -4.211  -3.271  -1.550
  181   2HD2  LEU  24          2HD2      LEU  24  -2.973  -2.157  -2.128
  182   3HD2  LEU  24          3HD2      LEU  24  -4.675  -1.834  -2.458
  183    H    GLU  25           H        GLU  25  -3.409  -3.211   2.957
  184    HA   GLU  25           HA       GLU  25  -1.161  -2.632   4.506
  185   1HB   GLU  25          2HB       GLU  25  -3.773  -2.872   5.056
  186   2HB   GLU  25          1HB       GLU  25  -3.226  -4.426   5.669
  187   1HG   GLU  25          2HG       GLU  25  -1.453  -3.038   6.934
  188   2HG   GLU  25          1HG       GLU  25  -2.519  -1.674   6.597
  189    H    ALA  26           H        ALA  26  -2.301  -5.627   3.173
  190    HA   ALA  26           HA       ALA  26  -0.685  -7.331   4.708
  191   1HB   ALA  26          1HB       ALA  26  -2.687  -8.132   3.547
  192   2HB   ALA  26          2HB       ALA  26  -1.256  -9.054   3.086
  193   3HB   ALA  26          3HB       ALA  26  -1.901  -7.824   1.998
  194    H    HIS  27           H        HIS  27  -0.304  -5.640   1.676
  195    HA   HIS  27           HA       HIS  27   2.187  -6.866   0.979
  196   1HB   HIS  27          2HB       HIS  27   0.798  -5.903  -0.767
  197   2HB   HIS  27          1HB       HIS  27   0.834  -4.330   0.017
  198    HD1  HIS  27           1HD      HIS  27   3.221  -6.732  -1.729
  199    HD2  HIS  27           2HD      HIS  27   2.820  -2.702  -0.797
  200    HE1  HIS  27           1HE      HIS  27   5.117  -5.539  -2.903
  201    H    GLN  28           H        GLN  28   1.224  -3.720   2.271
  202    HA   GLN  28           HA       GLN  28   3.817  -2.719   2.701
  203   1HB   GLN  28          2HB       GLN  28   1.083  -1.972   3.375
  204   2HB   GLN  28          1HB       GLN  28   2.208  -1.570   4.665
  205   1HG   GLN  28          2HG       GLN  28   3.624  -0.506   2.799
  206   2HG   GLN  28          1HG       GLN  28   2.145  -0.584   1.842
  207   1HE2  GLN  28          1HE2      GLN  28   3.448   0.588   4.909
  208   2HE2  GLN  28          2HE2      GLN  28   2.409   1.964   5.029
  209    H    ALA  29           H        ALA  29   1.999  -5.132   4.308
  210    HA   ALA  29           HA       ALA  29   3.040  -4.901   6.914
  211   1HB   ALA  29          1HB       ALA  29   2.479  -7.596   6.522
  212   2HB   ALA  29          2HB       ALA  29   1.372  -6.742   5.447
  213   3HB   ALA  29          3HB       ALA  29   1.392  -6.366   7.170
  214    H    TYR  30           H        TYR  30   3.915  -7.309   4.392
  215    HA   TYR  30           HA       TYR  30   6.679  -7.144   5.311
  216   1HB   TYR  30          2HB       TYR  30   4.914  -9.552   5.486
  217   2HB   TYR  30          1HB       TYR  30   6.640  -9.747   5.233
  218    HD1  TYR  30           1HD      TYR  30   4.122  -8.302   7.531
  219    HD2  TYR  30           2HD      TYR  30   8.155  -9.563   7.039
  220    HE1  TYR  30           1HE      TYR  30   4.486  -8.061   9.951
  221    HE2  TYR  30           2HE      TYR  30   8.530  -9.326   9.459
  222    HH   TYR  30           HH       TYR  30   7.315  -7.796  11.369
  223    H    TYR  31           H        TYR  31   4.849  -6.828   2.717
  224    HA   TYR  31           HA       TYR  31   6.397  -8.574   0.954
  225   1HB   TYR  31          2HB       TYR  31   3.908  -6.959   0.624
  226   2HB   TYR  31          1HB       TYR  31   4.846  -7.380  -0.800
  227    HD1  TYR  31           1HD      TYR  31   2.643  -8.621   1.816
  228    HD2  TYR  31           2HD      TYR  31   5.106  -9.733  -1.467
  229    HE1  TYR  31           1HE      TYR  31   1.560 -10.829   1.760
  230    HE2  TYR  31           2HE      TYR  31   4.032 -11.942  -1.535
  231    HH   TYR  31           HH       TYR  31   1.999 -13.024  -0.840
  232    H    CYS  32           H        CYS  32   5.533  -5.119   1.113
  233    HA   CYS  32           HA       CYS  32   7.280  -4.226  -0.857
  234   1HB   CYS  32          2HB       CYS  32   5.428  -3.024   0.706
  235   2HB   CYS  32          1HB       CYS  32   6.902  -2.426   1.460
  236    H    SER  33           H        SER  33   9.361  -4.826  -0.883
  237    HA   SER  33           HA       SER  33  11.507  -5.233  -0.208
  238   1HB   SER  33          2HB       SER  33  11.084  -2.608  -0.196
  239   2HB   SER  33          1HB       SER  33  11.413  -2.806   1.525
  240    HG   SER  33           HG       SER  33  13.094  -3.407  -0.667
  241    H    HIS  34           H        HIS  34  12.950  -4.692   2.060
  242    HA   HIS  34           HA       HIS  34  11.705  -6.530   3.967
  243   1HB   HIS  34          2HB       HIS  34  14.577  -5.601   3.775
  244   2HB   HIS  34          1HB       HIS  34  13.965  -6.840   4.864
  245    HD1  HIS  34           1HD      HIS  34  14.534  -6.209   1.183
  246    HD2  HIS  34           2HD      HIS  34  13.816  -9.363   3.791
  247    HE1  HIS  34           1HE      HIS  34  14.854  -8.297  -0.183
  248    HE2  HIS  34           2HE      HIS  34  14.500 -10.193   1.438
  249    H    ARG  35           H        ARG  35  10.289  -4.871   4.816
  250    HA   ARG  35           HA       ARG  35  11.257  -2.511   6.034
  251   1HB   ARG  35          2HB       ARG  35   8.704  -4.000   5.965
  252   2HB   ARG  35          1HB       ARG  35   8.945  -2.972   7.370
  253   1HG   ARG  35          2HG       ARG  35   9.435  -1.868   4.643
  254   2HG   ARG  35          1HG       ARG  35   7.782  -2.038   5.239
  255   1HD   ARG  35          2HD       ARG  35   8.747  -0.842   7.359
  256   2HD   ARG  35          1HD       ARG  35   9.993  -0.300   6.236
  257    HE   ARG  35           HE       ARG  35   8.478   1.137   5.313
  258   1HH1  ARG  35          1HH1      ARG  35   6.747  -1.275   7.148
  259   2HH1  ARG  35          2HH1      ARG  35   5.213  -0.496   6.963
  260   1HH2  ARG  35          1HH2      ARG  35   6.460   2.164   5.068
  261   2HH2  ARG  35          2HH2      ARG  35   5.049   1.456   5.781
  262    H    ILE  36           H        ILE  36  11.178  -2.027   8.359
  263    HA   ILE  36           HA       ILE  36  11.348  -4.193  10.240
  264    HB   ILE  36           HB       ILE  36  13.596  -4.299   9.256
  265   1HG1  ILE  36          2HG1      ILE  36  14.140  -3.087  11.912
  266   2HG1  ILE  36          1HG1      ILE  36  12.968  -4.400  11.873
  267   1HG2  ILE  36          1HG2      ILE  36  14.431  -1.717  10.406
  268   2HG2  ILE  36          2HG2      ILE  36  13.444  -1.635   8.947
  269   3HG2  ILE  36          3HG2      ILE  36  14.961  -2.533   8.936
  270   1HD1  ILE  36          1HD1      ILE  36  14.532  -5.956  11.441
  271   2HD1  ILE  36          2HD1      ILE  36  15.602  -4.763  12.176
  272   3HD1  ILE  36          3HD1      ILE  36  15.482  -4.878  10.420
  Start of MODEL    9
    1   1H    GLY   1          1HT       GLY   1 -11.004  11.860  -0.552
    2   2H    GLY   1          2HT       GLY   1 -10.514  13.441  -0.206
    3   3H    GLY   1          3HT       GLY   1 -11.229  12.495   1.000
    4   1HA   GLY   1          1HA       GLY   1  -9.142  12.083   1.646
    5   2HA   GLY   1          2HA       GLY   1  -9.183  10.926   0.326
    6    H    SER   2           H        SER   2  -8.322  14.256   1.153
    7    HA   SER   2           HA       SER   2  -6.777  14.598  -1.260
    8   1HB   SER   2          2HB       SER   2  -8.024  16.367   0.357
    9   2HB   SER   2          1HB       SER   2  -6.386  16.474   1.002
   10    HG   SER   2           HG       SER   2  -7.297  17.676  -1.113
   11    H    LEU   3           H        LEU   3  -6.004  14.495   2.222
   12    HA   LEU   3           HA       LEU   3  -3.581  13.026   1.689
   13   1HB   LEU   3          2HB       LEU   3  -2.217  14.771   2.989
   14   2HB   LEU   3          1HB       LEU   3  -2.559  15.072   1.296
   15    HG   LEU   3           HG       LEU   3  -4.677  16.284   2.634
   16   1HD1  LEU   3          1HD1      LEU   3  -2.149  16.468   4.210
   17   2HD1  LEU   3          2HD1      LEU   3  -3.817  16.325   4.768
   18   3HD1  LEU   3          3HD1      LEU   3  -3.232  17.859   4.123
   19   1HD2  LEU   3          1HD2      LEU   3  -2.202  17.198   1.253
   20   2HD2  LEU   3          2HD2      LEU   3  -3.208  18.388   2.078
   21   3HD2  LEU   3          3HD2      LEU   3  -3.891  17.396   0.790
   22    H    LEU   4           H        LEU   4  -4.283  11.447   3.063
   23    HA   LEU   4           HA       LEU   4  -3.757  11.718   5.804
   24   1HB   LEU   4          2HB       LEU   4  -6.023  12.962   5.450
   25   2HB   LEU   4          1HB       LEU   4  -6.695  11.344   5.352
   26    HG   LEU   4           HG       LEU   4  -6.925  12.268   7.601
   27   1HD1  LEU   4          1HD1      LEU   4  -6.194   9.768   6.982
   28   2HD1  LEU   4          2HD1      LEU   4  -6.502  10.303   8.634
   29   3HD1  LEU   4          3HD1      LEU   4  -4.848  10.213   8.030
   30   1HD2  LEU   4          1HD2      LEU   4  -4.558  13.478   7.206
   31   2HD2  LEU   4          2HD2      LEU   4  -4.037  12.097   8.170
   32   3HD2  LEU   4          3HD2      LEU   4  -5.258  13.202   8.802
   33    H    LYS   5           H        LYS   5  -5.628  10.007   3.348
   34    HA   LYS   5           HA       LYS   5  -4.604   7.477   4.430
   35   1HB   LYS   5          2HB       LYS   5  -6.768   6.396   4.013
   36   2HB   LYS   5          1HB       LYS   5  -6.917   7.694   5.190
   37   1HG   LYS   5          2HG       LYS   5  -7.421   8.385   2.359
   38   2HG   LYS   5          1HG       LYS   5  -8.616   7.371   3.170
   39   1HD   LYS   5          2HD       LYS   5  -7.706   9.685   4.732
   40   2HD   LYS   5          1HD       LYS   5  -8.573  10.092   3.249
   41   1HE   LYS   5          2HE       LYS   5  -9.781   7.951   4.865
   42   2HE   LYS   5          1HE       LYS   5  -9.764   9.543   5.622
   43   1HZ   LYS   5          1HZ       LYS   5 -10.809  10.420   3.576
   44   2HZ   LYS   5          2HZ       LYS   5 -11.778   9.297   4.391
   45   3HZ   LYS   5          3HZ       LYS   5 -10.945   8.837   2.992
   46    HA   PRO   6           HA       PRO   6  -3.341   6.378   0.363
   47   1HB   PRO   6          2HB       PRO   6  -4.504   3.844   0.139
   48   2HB   PRO   6          1HB       PRO   6  -2.917   4.198   0.828
   49   1HG   PRO   6          2HG       PRO   6  -5.525   3.748   2.203
   50   2HG   PRO   6          1HG       PRO   6  -3.894   3.261   2.697
   51   1HD   PRO   6          2HD       PRO   6  -5.129   5.337   3.846
   52   2HD   PRO   6          1HD       PRO   6  -3.382   5.372   3.523
   53    H    ALA   7           H        ALA   7  -4.548   7.859  -0.835
   54    HA   ALA   7           HA       ALA   7  -7.270   7.706  -1.419
   55   1HB   ALA   7          1HB       ALA   7  -6.748   9.165  -3.345
   56   2HB   ALA   7          2HB       ALA   7  -5.031   8.885  -3.058
   57   3HB   ALA   7          3HB       ALA   7  -6.004   9.715  -1.844
   58    H    ARG   8           H        ARG   8  -4.542   6.050  -2.844
   59    HA   ARG   8           HA       ARG   8  -6.418   4.568  -4.560
   60   1HB   ARG   8          2HB       ARG   8  -3.655   5.546  -5.292
   61   2HB   ARG   8          1HB       ARG   8  -4.575   4.390  -6.246
   62   1HG   ARG   8          2HG       ARG   8  -5.907   5.971  -7.119
   63   2HG   ARG   8          1HG       ARG   8  -5.996   6.878  -5.608
   64   1HD   ARG   8          2HD       ARG   8  -4.860   8.212  -7.255
   65   2HD   ARG   8          1HD       ARG   8  -3.701   7.711  -6.025
   66    HE   ARG   8           HE       ARG   8  -3.793   5.963  -8.304
   67   1HH1  ARG   8          1HH1      ARG   8  -2.387   8.872  -6.985
   68   2HH1  ARG   8          2HH1      ARG   8  -0.984   8.802  -7.997
   69   1HH2  ARG   8          1HH2      ARG   8  -1.946   5.869  -9.636
   70   2HH2  ARG   8          2HH2      ARG   8  -0.733   7.098  -9.501
   71    H    PHE   9           H        PHE   9  -5.264   2.504  -5.416
   72    HA   PHE   9           HA       PHE   9  -3.695   1.307  -3.231
   73   1HB   PHE   9          2HB       PHE   9  -5.012  -0.855  -4.178
   74   2HB   PHE   9          1HB       PHE   9  -5.580   0.109  -2.821
   75    HD1  PHE   9           1HD      PHE   9  -7.836   0.452  -2.848
   76    HD2  PHE   9           2HD      PHE   9  -5.731   0.406  -6.546
   77    HE1  PHE   9           1HE      PHE   9  -9.937   0.904  -4.045
   78    HE2  PHE   9           2HE      PHE   9  -7.827   0.858  -7.751
   79    HZ   PHE   9           HZ       PHE   9  -9.934   1.107  -6.500
   80    H    MET  10           H        MET  10  -1.826   1.780  -4.510
   81    HA   MET  10           HA       MET  10  -1.098  -0.380  -6.232
   82   1HB   MET  10          2HB       MET  10  -2.331   0.997  -7.844
   83   2HB   MET  10          1HB       MET  10  -1.325   2.382  -7.441
   84   1HG   MET  10          2HG       MET  10   0.639   1.190  -8.284
   85   2HG   MET  10          1HG       MET  10  -0.384  -0.179  -8.709
   86   1HE   MET  10          1HE       MET  10   0.502  -0.315 -10.791
   87   2HE   MET  10          2HE       MET  10   1.219   1.128 -11.508
   88   3HE   MET  10          3HE       MET  10  -0.252   0.439 -12.195
   89    H    CYS  11           H        CYS  11   0.948  -0.799  -5.768
   90    HA   CYS  11           HA       CYS  11   2.572   1.221  -4.463
   91   1HB   CYS  11          2HB       CYS  11   2.339  -1.324  -3.847
   92   2HB   CYS  11          1HB       CYS  11   3.577  -1.527  -5.079
   93    H    LEU  12           H        LEU  12   3.034   2.634  -6.123
   94    HA   LEU  12           HA       LEU  12   3.896   2.108  -8.678
   95   1HB   LEU  12          2HB       LEU  12   5.166   4.344  -7.161
   96   2HB   LEU  12          1HB       LEU  12   4.598   4.312  -8.818
   97    HG   LEU  12           HG       LEU  12   2.940   4.557  -6.313
   98   1HD1  LEU  12          1HD1      LEU  12   2.862   6.367  -8.685
   99   2HD1  LEU  12          2HD1      LEU  12   4.148   6.534  -7.492
  100   3HD1  LEU  12          3HD1      LEU  12   2.464   6.703  -7.001
  101   1HD2  LEU  12          1HD2      LEU  12   2.181   3.714  -9.059
  102   2HD2  LEU  12          2HD2      LEU  12   1.100   4.807  -8.196
  103   3HD2  LEU  12          3HD2      LEU  12   1.505   3.238  -7.501
  104    HA   PRO  13           HA       PRO  13   8.499   2.053  -7.145
  105   1HB   PRO  13          2HB       PRO  13   8.901   1.376  -4.538
  106   2HB   PRO  13          1HB       PRO  13   8.776   3.043  -5.107
  107   1HG   PRO  13          2HG       PRO  13   6.700   1.321  -3.814
  108   2HG   PRO  13          1HG       PRO  13   7.070   3.033  -3.534
  109   1HD   PRO  13          2HD       PRO  13   4.988   2.229  -5.049
  110   2HD   PRO  13          1HD       PRO  13   5.883   3.722  -5.388
  111    H    CYS  14           H        CYS  14   6.042  -0.184  -6.709
  112    HA   CYS  14           HA       CYS  14   7.969  -2.406  -6.647
  113   1HB   CYS  14          2HB       CYS  14   5.289  -2.068  -5.384
  114   2HB   CYS  14          1HB       CYS  14   5.768  -3.673  -5.910
  115    H    GLY  15           H        GLY  15   5.210  -0.952  -8.199
  116   1HA   GLY  15          2HA       GLY  15   4.472  -1.234 -10.361
  117   2HA   GLY  15          1HA       GLY  15   5.672  -2.496 -10.554
  118    H    ILE  16           H        ILE  16   3.419  -2.586  -7.917
  119    HA   ILE  16           HA       ILE  16   1.896  -4.701  -9.294
  120    HB   ILE  16           HB       ILE  16   2.482  -4.738  -6.340
  121   1HG1  ILE  16          2HG1      ILE  16   3.943  -6.313  -8.468
  122   2HG1  ILE  16          1HG1      ILE  16   4.593  -4.868  -7.699
  123   1HG2  ILE  16          1HG2      ILE  16   1.300  -6.664  -8.307
  124   2HG2  ILE  16          2HG2      ILE  16   0.629  -6.079  -6.784
  125   3HG2  ILE  16          3HG2      ILE  16   1.977  -7.217  -6.775
  126   1HD1  ILE  16          1HD1      ILE  16   5.571  -6.587  -6.509
  127   2HD1  ILE  16          2HD1      ILE  16   4.107  -7.571  -6.529
  128   3HD1  ILE  16          3HD1      ILE  16   4.197  -6.144  -5.495
  129    H    ALA  17           H        ALA  17   0.014  -3.681  -9.719
  130    HA   ALA  17           HA       ALA  17  -1.180  -1.886  -7.784
  131   1HB   ALA  17          1HB       ALA  17  -1.206  -1.865 -10.463
  132   2HB   ALA  17          2HB       ALA  17  -2.464  -1.113  -9.482
  133   3HB   ALA  17          3HB       ALA  17  -2.720  -2.718 -10.166
  134    H    PHE  18           H        PHE  18  -2.451  -2.557  -6.193
  135    HA   PHE  18           HA       PHE  18  -3.529  -5.230  -6.186
  136   1HB   PHE  18          2HB       PHE  18  -3.227  -2.999  -4.219
  137   2HB   PHE  18          1HB       PHE  18  -4.392  -4.261  -3.889
  138    HD1  PHE  18           1HD      PHE  18  -1.364  -5.078  -5.730
  139    HD2  PHE  18           2HD      PHE  18  -3.163  -4.908  -1.877
  140    HE1  PHE  18           1HE      PHE  18   0.436  -6.493  -4.833
  141    HE2  PHE  18           2HE      PHE  18  -1.365  -6.324  -0.973
  142    HZ   PHE  18           HZ       PHE  18   0.437  -7.118  -2.451
  143    H    SER  19           H        SER  19  -5.873  -4.803  -4.675
  144    HA   SER  19           HA       SER  19  -7.591  -3.020  -6.166
  145   1HB   SER  19          2HB       SER  19  -7.594  -5.972  -6.578
  146   2HB   SER  19          1HB       SER  19  -9.154  -5.152  -6.524
  147    HG   SER  19           HG       SER  19  -8.748  -4.253  -8.390
  148    H    SER  20           H        SER  20  -6.730  -3.463  -3.382
  149    HA   SER  20           HA       SER  20  -9.274  -3.138  -2.149
  150   1HB   SER  20          2HB       SER  20  -7.761  -5.433  -0.969
  151   2HB   SER  20          1HB       SER  20  -9.483  -5.065  -0.881
  152    HG   SER  20           HG       SER  20  -8.071  -6.486  -2.772
  153    HA   PRO  21           HA       PRO  21  -6.708  -0.793   0.568
  154   1HB   PRO  21          2HB       PRO  21  -8.280  -0.619   2.766
  155   2HB   PRO  21          1HB       PRO  21  -8.636   0.251   1.269
  156   1HG   PRO  21          2HG       PRO  21  -9.801  -2.307   2.297
  157   2HG   PRO  21          1HG       PRO  21 -10.619  -0.934   1.532
  158   1HD   PRO  21          2HD       PRO  21  -9.997  -3.212   0.191
  159   2HD   PRO  21          1HD       PRO  21 -10.057  -1.621  -0.592
  160    H    SER  22           H        SER  22  -8.273  -3.571   2.167
  161    HA   SER  22           HA       SER  22  -6.420  -3.802   4.267
  162   1HB   SER  22          2HB       SER  22  -8.756  -5.138   3.444
  163   2HB   SER  22          1HB       SER  22  -7.501  -6.376   3.511
  164    HG   SER  22           HG       SER  22  -7.645  -6.295   5.593
  165    H    THR  23           H        THR  23  -6.446  -5.101   0.998
  166    HA   THR  23           HA       THR  23  -4.343  -6.938   1.306
  167    HB   THR  23           HB       THR  23  -4.053  -6.554  -1.221
  168    HG1  THR  23           1HG      THR  23  -5.630  -5.341  -2.202
  169   1HG2  THR  23          1HG2      THR  23  -6.892  -7.180  -0.534
  170   2HG2  THR  23          2HG2      THR  23  -5.583  -8.278  -0.098
  171   3HG2  THR  23          3HG2      THR  23  -5.867  -7.874  -1.791
  172    H    LEU  24           H        LEU  24  -4.377  -3.498   0.558
  173    HA   LEU  24           HA       LEU  24  -1.692  -3.156  -0.102
  174   1HB   LEU  24          2HB       LEU  24  -3.120  -1.107   1.539
  175   2HB   LEU  24          1HB       LEU  24  -2.035  -0.883   0.188
  176    HG   LEU  24           HG       LEU  24  -4.913  -1.740   0.083
  177   1HD1  LEU  24          1HD1      LEU  24  -3.713   0.593  -1.342
  178   2HD1  LEU  24          2HD1      LEU  24  -4.141   0.725   0.364
  179   3HD1  LEU  24          3HD1      LEU  24  -5.379   0.325  -0.826
  180   1HD2  LEU  24          1HD2      LEU  24  -3.740  -3.024  -1.572
  181   2HD2  LEU  24          2HD2      LEU  24  -2.863  -1.596  -2.122
  182   3HD2  LEU  24          3HD2      LEU  24  -4.602  -1.719  -2.387
  183    H    GLU  25           H        GLU  25  -3.341  -3.108   3.007
  184    HA   GLU  25           HA       GLU  25  -1.088  -2.489   4.582
  185   1HB   GLU  25          2HB       GLU  25  -3.715  -2.675   5.109
  186   2HB   GLU  25          1HB       GLU  25  -3.199  -4.234   5.736
  187   1HG   GLU  25          2HG       GLU  25  -2.017  -1.589   6.552
  188   2HG   GLU  25          1HG       GLU  25  -3.283  -2.441   7.437
  189    H    ALA  26           H        ALA  26  -2.222  -5.433   3.167
  190    HA   ALA  26           HA       ALA  26  -0.658  -7.170   4.745
  191   1HB   ALA  26          1HB       ALA  26  -2.761  -7.573   3.117
  192   2HB   ALA  26          2HB       ALA  26  -1.661  -8.855   3.622
  193   3HB   ALA  26          3HB       ALA  26  -1.443  -8.072   2.057
  194    H    HIS  27           H        HIS  27  -0.268  -5.484   1.717
  195    HA   HIS  27           HA       HIS  27   2.191  -6.769   1.002
  196   1HB   HIS  27          2HB       HIS  27   0.822  -5.777  -0.744
  197   2HB   HIS  27          1HB       HIS  27   0.894  -4.205   0.040
  198    HD1  HIS  27           1HD      HIS  27   3.104  -6.620  -1.873
  199    HD2  HIS  27           2HD      HIS  27   3.046  -2.666  -0.598
  200    HE1  HIS  27           1HE      HIS  27   5.063  -5.482  -2.996
  201    H    GLN  28           H        GLN  28   1.289  -3.609   2.302
  202    HA   GLN  28           HA       GLN  28   3.887  -2.628   2.707
  203   1HB   GLN  28          2HB       GLN  28   1.169  -1.881   3.429
  204   2HB   GLN  28          1HB       GLN  28   2.307  -1.504   4.715
  205   1HG   GLN  28          2HG       GLN  28   3.711  -0.407   2.870
  206   2HG   GLN  28          1HG       GLN  28   2.239  -0.482   1.904
  207   1HE2  GLN  28          1HE2      GLN  28   2.965   0.291   5.293
  208   2HE2  GLN  28          2HE2      GLN  28   2.134   1.805   5.304
  209    H    ALA  29           H        ALA  29   2.080  -5.040   4.348
  210    HA   ALA  29           HA       ALA  29   3.185  -4.837   6.927
  211   1HB   ALA  29          1HB       ALA  29   1.502  -6.682   5.474
  212   2HB   ALA  29          2HB       ALA  29   1.543  -6.310   7.197
  213   3HB   ALA  29          3HB       ALA  29   2.630  -7.528   6.533
  214    H    TYR  30           H        TYR  30   4.004  -7.225   4.371
  215    HA   TYR  30           HA       TYR  30   6.800  -7.018   5.137
  216   1HB   TYR  30          2HB       TYR  30   5.100  -9.461   5.498
  217   2HB   TYR  30          1HB       TYR  30   6.828  -9.593   5.234
  218    HD1  TYR  30           1HD      TYR  30   4.252  -8.229   7.498
  219    HD2  TYR  30           2HD      TYR  30   8.371  -9.165   6.996
  220    HE1  TYR  30           1HE      TYR  30   4.623  -7.846   9.896
  221    HE2  TYR  30           2HE      TYR  30   8.755  -8.785   9.396
  222    HH   TYR  30           HH       TYR  30   7.664  -7.479  11.252
  223    H    TYR  31           H        TYR  31   4.878  -6.757   2.669
  224    HA   TYR  31           HA       TYR  31   6.218  -8.639   0.876
  225   1HB   TYR  31          2HB       TYR  31   3.909  -6.746   0.447
  226   2HB   TYR  31          1HB       TYR  31   4.625  -7.707  -0.838
  227    HD1  TYR  31           1HD      TYR  31   3.468  -8.353   2.667
  228    HD2  TYR  31           2HD      TYR  31   3.387  -9.552  -1.414
  229    HE1  TYR  31           1HE      TYR  31   2.005 -10.238   3.257
  230    HE2  TYR  31           2HE      TYR  31   1.921 -11.440  -0.836
  231    HH   TYR  31           HH       TYR  31   1.421 -12.821   1.216
  232    H    CYS  32           H        CYS  32   5.741  -5.146   1.270
  233    HA   CYS  32           HA       CYS  32   7.186  -4.281  -0.946
  234   1HB   CYS  32          2HB       CYS  32   5.819  -3.040   1.050
  235   2HB   CYS  32          1HB       CYS  32   7.476  -2.637   1.488
  236    H    SER  33           H        SER  33   9.017  -5.581  -1.196
  237    HA   SER  33           HA       SER  33  11.148  -6.330  -0.873
  238   1HB   SER  33          2HB       SER  33  11.707  -4.164  -1.677
  239   2HB   SER  33          1HB       SER  33  11.333  -3.412  -0.126
  240    HG   SER  33           HG       SER  33  13.625  -4.664  -0.966
  241    H    HIS  34           H        HIS  34  11.547  -4.038   1.765
  242    HA   HIS  34           HA       HIS  34  11.186  -6.057   3.798
  243   1HB   HIS  34          2HB       HIS  34  13.911  -5.015   3.049
  244   2HB   HIS  34          1HB       HIS  34  13.568  -5.630   4.661
  245    HD1  HIS  34           1HD      HIS  34  13.888  -6.737   1.090
  246    HD2  HIS  34           2HD      HIS  34  13.385  -8.397   4.866
  247    HE1  HIS  34           1HE      HIS  34  14.248  -9.206   0.791
  248    HE2  HIS  34           2HE      HIS  34  14.036 -10.178   3.106
  249    H    ARG  35           H        ARG  35   9.961  -4.922   5.160
  250    HA   ARG  35           HA       ARG  35  10.988  -2.342   6.112
  251   1HB   ARG  35          2HB       ARG  35   9.245  -1.784   4.534
  252   2HB   ARG  35          1HB       ARG  35   8.144  -2.931   5.282
  253   1HG   ARG  35          2HG       ARG  35   7.453  -1.427   6.757
  254   2HG   ARG  35          1HG       ARG  35   9.108  -1.024   7.217
  255   1HD   ARG  35          2HD       ARG  35   9.283   0.488   5.314
  256   2HD   ARG  35          1HD       ARG  35   7.649   0.060   4.809
  257    HE   ARG  35           HE       ARG  35   7.711   1.053   7.480
  258   1HH1  ARG  35          1HH1      ARG  35   7.761   2.034   4.131
  259   2HH1  ARG  35          2HH1      ARG  35   7.087   3.597   4.449
  260   1HH2  ARG  35          1HH2      ARG  35   6.823   3.108   7.900
  261   2HH2  ARG  35          2HH2      ARG  35   6.553   4.207   6.589
  262    H    ILE  36           H        ILE  36  11.622  -3.000   8.100
  263    HA   ILE  36           HA       ILE  36   9.814  -4.625   9.720
  264    HB   ILE  36           HB       ILE  36  12.185  -5.265   9.656
  265   1HG1  ILE  36          2HG1      ILE  36  11.509  -4.207  12.402
  266   2HG1  ILE  36          1HG1      ILE  36  10.707  -5.606  11.696
  267   1HG2  ILE  36          1HG2      ILE  36  13.856  -3.842  10.802
  268   2HG2  ILE  36          2HG2      ILE  36  12.648  -2.561  10.904
  269   3HG2  ILE  36          3HG2      ILE  36  13.214  -3.116   9.329
  270   1HD1  ILE  36          1HD1      ILE  36  12.311  -6.807  12.650
  271   2HD1  ILE  36          2HD1      ILE  36  13.311  -5.385  12.950
  272   3HD1  ILE  36          3HD1      ILE  36  13.372  -6.192  11.382
  Start of MODEL   10
    1   1H    GLY   1          1HT       GLY   1  -9.982  10.237  -0.015
    2   2H    GLY   1          2HT       GLY   1 -10.841  11.657   0.316
    3   3H    GLY   1          3HT       GLY   1  -9.549  11.200   1.308
    4   1HA   GLY   1          1HA       GLY   1  -8.343  11.289  -1.084
    5   2HA   GLY   1          2HA       GLY   1  -9.538  12.567  -1.241
    6    H    SER   2           H        SER   2  -7.131  13.497  -1.409
    7    HA   SER   2           HA       SER   2  -5.626  14.970  -0.551
    8   1HB   SER   2          2HB       SER   2  -7.581  15.257   1.741
    9   2HB   SER   2          1HB       SER   2  -6.349  16.418   1.248
   10    HG   SER   2           HG       SER   2  -8.038  17.200   0.209
   11    H    LEU   3           H        LEU   3  -4.663  15.564   1.892
   12    HA   LEU   3           HA       LEU   3  -3.103  13.304   2.535
   13   1HB   LEU   3          2HB       LEU   3  -2.241  14.673   4.389
   14   2HB   LEU   3          1HB       LEU   3  -2.242  15.534   2.861
   15    HG   LEU   3           HG       LEU   3  -4.633  15.931   4.553
   16   1HD1  LEU   3          1HD1      LEU   3  -1.894  16.521   5.485
   17   2HD1  LEU   3          2HD1      LEU   3  -3.373  16.237   6.403
   18   3HD1  LEU   3          3HD1      LEU   3  -3.083  17.811   5.662
   19   1HD2  LEU   3          1HD2      LEU   3  -3.004  17.395   2.574
   20   2HD2  LEU   3          2HD2      LEU   3  -3.763  18.366   3.835
   21   3HD2  LEU   3          3HD2      LEU   3  -4.753  17.343   2.794
   22    H    LEU   4           H        LEU   4  -2.866  12.891   5.104
   23    HA   LEU   4           HA       LEU   4  -3.724  11.860   6.941
   24   1HB   LEU   4          2HB       LEU   4  -5.548  13.952   6.357
   25   2HB   LEU   4          1HB       LEU   4  -6.498  12.544   6.789
   26    HG   LEU   4           HG       LEU   4  -6.062  13.948   8.736
   27   1HD1  LEU   4          1HD1      LEU   4  -5.908  11.269   8.642
   28   2HD1  LEU   4          2HD1      LEU   4  -5.785  12.201  10.134
   29   3HD1  LEU   4          3HD1      LEU   4  -4.324  11.641   9.322
   30   1HD2  LEU   4          1HD2      LEU   4  -3.285  13.741   7.748
   31   2HD2  LEU   4          2HD2      LEU   4  -3.510  13.693   9.496
   32   3HD2  LEU   4          3HD2      LEU   4  -4.104  15.070   8.568
   33    H    LYS   5           H        LYS   5  -6.630  11.847   4.892
   34    HA   LYS   5           HA       LYS   5  -6.888   8.989   5.254
   35   1HB   LYS   5          2HB       LYS   5  -8.592  11.189   4.252
   36   2HB   LYS   5          1HB       LYS   5  -8.869   9.615   3.518
   37   1HG   LYS   5          2HG       LYS   5  -8.667   9.482   6.414
   38   2HG   LYS   5          1HG       LYS   5  -9.971  10.534   5.862
   39   1HD   LYS   5          2HD       LYS   5 -11.213   8.794   5.225
   40   2HD   LYS   5          1HD       LYS   5  -9.869   8.074   4.337
   41   1HE   LYS   5          2HE       LYS   5  -9.319   6.693   6.034
   42   2HE   LYS   5          1HE       LYS   5  -9.688   7.897   7.269
   43   1HZ   LYS   5          1HZ       LYS   5 -11.172   5.735   6.824
   44   2HZ   LYS   5          2HZ       LYS   5 -11.970   6.839   5.822
   45   3HZ   LYS   5          3HZ       LYS   5 -11.790   7.170   7.472
   46    HA   PRO   6           HA       PRO   6  -4.872   7.927   1.451
   47   1HB   PRO   6          2HB       PRO   6  -5.770   5.402   1.153
   48   2HB   PRO   6          1HB       PRO   6  -4.603   5.844   2.405
   49   1HG   PRO   6          2HG       PRO   6  -7.561   5.436   2.630
   50   2HG   PRO   6          1HG       PRO   6  -6.271   4.892   3.718
   51   1HD   PRO   6          2HD       PRO   6  -7.796   7.096   4.200
   52   2HD   PRO   6          1HD       PRO   6  -6.122   6.931   4.764
   53    H    ALA   7           H        ALA   7  -5.345   7.220  -0.762
   54    HA   ALA   7           HA       ALA   7  -8.071   7.088  -1.655
   55   1HB   ALA   7          1HB       ALA   7  -7.550   9.148  -3.232
   56   2HB   ALA   7          2HB       ALA   7  -6.535   9.622  -1.871
   57   3HB   ALA   7          3HB       ALA   7  -8.263   9.361  -1.632
   58    H    ARG   8           H        ARG   8  -5.606   5.537  -1.842
   59    HA   ARG   8           HA       ARG   8  -5.659   5.082  -4.701
   60   1HB   ARG   8          2HB       ARG   8  -3.722   6.767  -3.847
   61   2HB   ARG   8          1HB       ARG   8  -2.903   5.226  -3.633
   62   1HG   ARG   8          2HG       ARG   8  -2.318   5.445  -5.771
   63   2HG   ARG   8          1HG       ARG   8  -3.975   4.958  -6.131
   64   1HD   ARG   8          2HD       ARG   8  -4.204   6.899  -7.199
   65   2HD   ARG   8          1HD       ARG   8  -4.153   7.681  -5.620
   66    HE   ARG   8           HE       ARG   8  -1.524   7.280  -6.434
   67   1HH1  ARG   8          1HH1      ARG   8  -4.317   9.105  -7.460
   68   2HH1  ARG   8          2HH1      ARG   8  -3.381  10.377  -8.170
   69   1HH2  ARG   8          1HH2      ARG   8  -0.291   8.951  -7.369
   70   2HH2  ARG   8          2HH2      ARG   8  -1.095  10.289  -8.120
   71    H    PHE   9           H        PHE   9  -4.832   3.027  -5.307
   72    HA   PHE   9           HA       PHE   9  -4.038   1.235  -3.139
   73   1HB   PHE   9          2HB       PHE   9  -5.689  -0.466  -4.343
   74   2HB   PHE   9          1HB       PHE   9  -6.233   0.590  -3.045
   75    HD1  PHE   9           1HD      PHE   9  -8.008   2.041  -3.376
   76    HD2  PHE   9           2HD      PHE   9  -6.039   0.349  -6.747
   77    HE1  PHE   9           1HE      PHE   9  -9.741   2.974  -4.849
   78    HE2  PHE   9           2HE      PHE   9  -7.769   1.281  -8.229
   79    HZ   PHE   9           HZ       PHE   9  -9.623   2.596  -7.280
   80    H    MET  10           H        MET  10  -2.066   1.800  -4.521
   81    HA   MET  10           HA       MET  10  -1.455  -0.473  -6.131
   82   1HB   MET  10          2HB       MET  10  -2.664   0.869  -7.799
   83   2HB   MET  10          1HB       MET  10  -1.578   2.220  -7.501
   84   1HG   MET  10          2HG       MET  10   0.285   0.986  -8.378
   85   2HG   MET  10          1HG       MET  10  -0.703  -0.466  -8.536
   86   1HE   MET  10          1HE       MET  10   0.276   2.992 -10.080
   87   2HE   MET  10          2HE       MET  10  -1.300   3.324  -9.361
   88   3HE   MET  10          3HE       MET  10  -1.112   3.333 -11.114
   89    H    CYS  11           H        CYS  11   0.594  -0.943  -5.704
   90    HA   CYS  11           HA       CYS  11   2.304   1.046  -4.477
   91   1HB   CYS  11          2HB       CYS  11   2.046  -1.509  -3.878
   92   2HB   CYS  11          1HB       CYS  11   3.257  -1.711  -5.139
   93    H    LEU  12           H        LEU  12   2.677   2.455  -6.226
   94    HA   LEU  12           HA       LEU  12   3.555   1.786  -8.766
   95   1HB   LEU  12          2HB       LEU  12   4.685   4.197  -7.411
   96   2HB   LEU  12          1HB       LEU  12   4.129   4.011  -9.062
   97    HG   LEU  12           HG       LEU  12   1.809   3.639  -7.652
   98   1HD1  LEU  12          1HD1      LEU  12   2.040   5.899  -6.225
   99   2HD1  LEU  12          2HD1      LEU  12   3.667   5.250  -6.025
  100   3HD1  LEU  12          3HD1      LEU  12   2.269   4.289  -5.542
  101   1HD2  LEU  12          1HD2      LEU  12   2.580   6.417  -8.373
  102   2HD2  LEU  12          2HD2      LEU  12   1.105   5.521  -8.736
  103   3HD2  LEU  12          3HD2      LEU  12   2.582   5.194  -9.643
  104    HA   PRO  13           HA       PRO  13   8.127   2.161  -6.947
  105   1HB   PRO  13          2HB       PRO  13   7.560   0.990  -4.279
  106   2HB   PRO  13          1HB       PRO  13   8.670   2.290  -4.725
  107   1HG   PRO  13          2HG       PRO  13   6.380   2.825  -3.473
  108   2HG   PRO  13          1HG       PRO  13   6.993   3.891  -4.751
  109   1HD   PRO  13          2HD       PRO  13   4.807   1.853  -4.869
  110   2HD   PRO  13          1HD       PRO  13   4.894   3.459  -5.621
  111    H    CYS  14           H        CYS  14   5.727  -0.284  -6.601
  112    HA   CYS  14           HA       CYS  14   7.749  -2.385  -6.945
  113   1HB   CYS  14          2HB       CYS  14   5.036  -2.374  -5.651
  114   2HB   CYS  14          1HB       CYS  14   5.748  -3.870  -6.231
  115    H    GLY  15           H        GLY  15   4.863  -0.888  -8.188
  116   1HA   GLY  15          2HA       GLY  15   4.037  -0.932 -10.334
  117   2HA   GLY  15          1HA       GLY  15   5.279  -2.100 -10.732
  118    H    ILE  16           H        ILE  16   3.047  -2.519  -8.084
  119    HA   ILE  16           HA       ILE  16   1.584  -4.547  -9.637
  120    HB   ILE  16           HB       ILE  16   2.375  -4.909  -6.749
  121   1HG1  ILE  16          2HG1      ILE  16   3.618  -6.193  -9.192
  122   2HG1  ILE  16          1HG1      ILE  16   4.362  -4.904  -8.251
  123   1HG2  ILE  16          1HG2      ILE  16   0.967  -6.594  -8.783
  124   2HG2  ILE  16          2HG2      ILE  16   0.484  -6.202  -7.133
  125   3HG2  ILE  16          3HG2      ILE  16   1.807  -7.333  -7.420
  126   1HD1  ILE  16          1HD1      ILE  16   4.647  -7.630  -7.866
  127   2HD1  ILE  16          2HD1      ILE  16   3.573  -7.109  -6.568
  128   3HD1  ILE  16          3HD1      ILE  16   5.150  -6.345  -6.768
  129    H    ALA  17           H        ALA  17  -0.380  -3.642  -9.832
  130    HA   ALA  17           HA       ALA  17  -1.528  -2.078  -7.683
  131   1HB   ALA  17          1HB       ALA  17  -1.759  -1.968 -10.403
  132   2HB   ALA  17          2HB       ALA  17  -2.834  -1.167  -9.257
  133   3HB   ALA  17          3HB       ALA  17  -3.276  -2.735  -9.933
  134    H    PHE  18           H        PHE  18  -2.547  -3.006  -6.045
  135    HA   PHE  18           HA       PHE  18  -3.580  -5.692  -6.247
  136   1HB   PHE  18          2HB       PHE  18  -3.046  -3.722  -4.083
  137   2HB   PHE  18          1HB       PHE  18  -4.234  -4.971  -3.775
  138    HD1  PHE  18           1HD      PHE  18  -3.552  -7.372  -3.890
  139    HD2  PHE  18           2HD      PHE  18  -0.740  -4.183  -4.078
  140    HE1  PHE  18           1HE      PHE  18  -1.738  -8.941  -3.337
  141    HE2  PHE  18           2HE      PHE  18   1.078  -5.745  -3.527
  142    HZ   PHE  18           HZ       PHE  18   0.580  -8.128  -3.155
  143    H    SER  19           H        SER  19  -4.842  -2.451  -5.520
  144    HA   SER  19           HA       SER  19  -6.897  -1.521  -5.810
  145   1HB   SER  19          2HB       SER  19  -6.706  -3.074  -7.970
  146   2HB   SER  19          1HB       SER  19  -8.025  -3.925  -7.165
  147    HG   SER  19           HG       SER  19  -9.057  -2.404  -8.300
  148    H    SER  20           H        SER  20  -6.438  -2.646  -3.394
  149    HA   SER  20           HA       SER  20  -9.079  -3.189  -2.485
  150   1HB   SER  20          2HB       SER  20  -8.495  -5.440  -3.278
  151   2HB   SER  20          1HB       SER  20  -7.055  -5.426  -2.260
  152    HG   SER  20           HG       SER  20  -9.720  -5.774  -1.574
  153    HA   PRO  21           HA       PRO  21  -6.679  -0.942   0.676
  154   1HB   PRO  21          2HB       PRO  21  -9.403  -0.611   1.799
  155   2HB   PRO  21          1HB       PRO  21  -8.183   0.611   1.428
  156   1HG   PRO  21          2HG       PRO  21 -10.361   0.334  -0.091
  157   2HG   PRO  21          1HG       PRO  21  -8.785   0.728  -0.803
  158   1HD   PRO  21          2HD       PRO  21 -10.228  -1.895  -0.723
  159   2HD   PRO  21          1HD       PRO  21  -9.292  -1.163  -2.044
  160    H    SER  22           H        SER  22  -5.981  -3.177   1.184
  161    HA   SER  22           HA       SER  22  -6.257  -3.802   3.866
  162   1HB   SER  22          2HB       SER  22  -8.554  -4.625   2.597
  163   2HB   SER  22          1HB       SER  22  -7.561  -6.080   2.513
  164    HG   SER  22           HG       SER  22  -8.015  -4.612   4.897
  165    H    THR  23           H        THR  23  -6.018  -5.385   0.695
  166    HA   THR  23           HA       THR  23  -3.976  -7.199   1.463
  167    HB   THR  23           HB       THR  23  -4.299  -6.185  -1.349
  168    HG1  THR  23           1HG      THR  23  -6.096  -7.822   0.091
  169   1HG2  THR  23          1HG2      THR  23  -4.094  -8.646  -1.836
  170   2HG2  THR  23          2HG2      THR  23  -3.649  -8.852  -0.142
  171   3HG2  THR  23          3HG2      THR  23  -2.652  -7.855  -1.202
  172    H    LEU  24           H        LEU  24  -4.091  -3.896   0.438
  173    HA   LEU  24           HA       LEU  24  -1.412  -3.511  -0.307
  174   1HB   LEU  24          2HB       LEU  24  -2.971  -1.375   1.092
  175   2HB   LEU  24          1HB       LEU  24  -1.894  -1.240  -0.280
  176    HG   LEU  24           HG       LEU  24  -4.750  -2.158  -0.245
  177   1HD1  LEU  24          1HD1      LEU  24  -3.297  -0.006  -1.772
  178   2HD1  LEU  24          2HD1      LEU  24  -4.367   0.237  -0.391
  179   3HD1  LEU  24          3HD1      LEU  24  -5.012  -0.388  -1.907
  180   1HD2  LEU  24          1HD2      LEU  24  -3.940  -3.734  -1.707
  181   2HD2  LEU  24          2HD2      LEU  24  -2.615  -2.705  -2.252
  182   3HD2  LEU  24          3HD2      LEU  24  -4.261  -2.390  -2.804
  183    H    GLU  25           H        GLU  25  -3.131  -3.204   2.746
  184    HA   GLU  25           HA       GLU  25  -0.920  -2.374   4.294
  185   1HB   GLU  25          2HB       GLU  25  -3.557  -2.503   4.763
  186   2HB   GLU  25          1HB       GLU  25  -3.077  -3.992   5.560
  187   1HG   GLU  25          2HG       GLU  25  -1.393  -1.716   6.252
  188   2HG   GLU  25          1HG       GLU  25  -3.089  -1.491   6.676
  189    H    ALA  26           H        ALA  26  -2.049  -5.446   3.178
  190    HA   ALA  26           HA       ALA  26  -0.469  -7.015   4.920
  191   1HB   ALA  26          1HB       ALA  26  -2.146  -8.352   4.203
  192   2HB   ALA  26          2HB       ALA  26  -1.007  -8.713   2.906
  193   3HB   ALA  26          3HB       ALA  26  -2.279  -7.518   2.654
  194    H    HIS  27           H        HIS  27  -0.170  -5.644   1.739
  195    HA   HIS  27           HA       HIS  27   2.240  -6.990   1.013
  196   1HB   HIS  27          2HB       HIS  27   0.837  -6.112  -0.737
  197   2HB   HIS  27          1HB       HIS  27   0.869  -4.503  -0.032
  198    HD1  HIS  27           1HD      HIS  27   3.027  -6.887  -2.011
  199    HD2  HIS  27           2HD      HIS  27   3.004  -2.935  -0.728
  200    HE1  HIS  27           1HE      HIS  27   4.910  -5.730  -3.240
  201    H    GLN  28           H        GLN  28   1.484  -3.704   2.089
  202    HA   GLN  28           HA       GLN  28   4.154  -2.837   2.358
  203   1HB   GLN  28          2HB       GLN  28   1.531  -1.790   2.806
  204   2HB   GLN  28          1HB       GLN  28   2.503  -1.472   4.234
  205   1HG   GLN  28          2HG       GLN  28   3.603  -0.854   1.535
  206   2HG   GLN  28          1HG       GLN  28   2.430   0.234   2.275
  207   1HE2  GLN  28          1HE2      GLN  28   5.611  -0.254   1.846
  208   2HE2  GLN  28          2HE2      GLN  28   6.238   0.545   3.243
  209    H    ALA  29           H        ALA  29   2.236  -4.950   4.235
  210    HA   ALA  29           HA       ALA  29   3.401  -4.487   6.780
  211   1HB   ALA  29          1HB       ALA  29   1.622  -6.523   5.582
  212   2HB   ALA  29          2HB       ALA  29   1.438  -5.579   7.060
  213   3HB   ALA  29          3HB       ALA  29   2.505  -6.982   7.038
  214    H    TYR  30           H        TYR  30   3.862  -7.233   4.509
  215    HA   TYR  30           HA       TYR  30   6.654  -7.355   5.371
  216   1HB   TYR  30          2HB       TYR  30   4.589  -9.477   5.738
  217   2HB   TYR  30          1HB       TYR  30   6.244  -9.954   5.390
  218    HD1  TYR  30           1HD      TYR  30   4.243  -7.853   7.724
  219    HD2  TYR  30           2HD      TYR  30   7.791 -10.123   7.127
  220    HE1  TYR  30           1HE      TYR  30   4.810  -7.579  10.101
  221    HE2  TYR  30           2HE      TYR  30   8.369  -9.855   9.503
  222    HH   TYR  30           HH       TYR  30   6.721  -7.660  11.560
  223    H    TYR  31           H        TYR  31   4.833  -6.924   2.813
  224    HA   TYR  31           HA       TYR  31   6.244  -8.858   1.107
  225   1HB   TYR  31          2HB       TYR  31   3.598  -8.244   1.144
  226   2HB   TYR  31          1HB       TYR  31   4.172  -7.164  -0.123
  227    HD1  TYR  31           1HD      TYR  31   3.942 -10.700   0.922
  228    HD2  TYR  31           2HD      TYR  31   4.780  -8.007  -2.263
  229    HE1  TYR  31           1HE      TYR  31   3.911 -12.577  -0.664
  230    HE2  TYR  31           2HE      TYR  31   4.751  -9.877  -3.860
  231    HH   TYR  31           HH       TYR  31   3.405 -12.665  -3.404
  232    H    CYS  32           H        CYS  32   5.599  -5.409   1.512
  233    HA   CYS  32           HA       CYS  32   7.152  -4.636  -0.766
  234   1HB   CYS  32          2HB       CYS  32   5.247  -3.348   0.534
  235   2HB   CYS  32          1HB       CYS  32   6.602  -2.745   1.483
  236    H    SER  33           H        SER  33   9.247  -5.206  -0.734
  237    HA   SER  33           HA       SER  33  11.402  -5.494  -0.026
  238   1HB   SER  33          2HB       SER  33  10.632  -2.738   0.227
  239   2HB   SER  33          1HB       SER  33  11.814  -3.129   1.476
  240    HG   SER  33           HG       SER  33  12.492  -2.481  -0.820
  241    H    HIS  34           H        HIS  34  12.837  -4.702   2.169
  242    HA   HIS  34           HA       HIS  34  11.603  -6.328   4.273
  243   1HB   HIS  34          2HB       HIS  34  14.488  -5.452   4.078
  244   2HB   HIS  34          1HB       HIS  34  13.819  -6.707   5.116
  245    HD1  HIS  34           1HD      HIS  34  15.530  -6.270   1.993
  246    HD2  HIS  34           2HD      HIS  34  12.716  -8.947   3.469
  247    HE1  HIS  34           1HE      HIS  34  15.642  -8.268   0.471
  248    HE2  HIS  34           2HE      HIS  34  13.995  -9.912   1.438
  249    H    ARG  35           H        ARG  35  10.258  -4.731   5.162
  250    HA   ARG  35           HA       ARG  35  11.548  -2.363   6.293
  251   1HB   ARG  35          2HB       ARG  35   9.206  -2.545   5.013
  252   2HB   ARG  35          1HB       ARG  35   8.637  -2.856   6.647
  253   1HG   ARG  35          2HG       ARG  35   9.805  -0.736   7.338
  254   2HG   ARG  35          1HG       ARG  35  10.046  -0.410   5.620
  255   1HD   ARG  35          2HD       ARG  35   8.085   0.719   6.003
  256   2HD   ARG  35          1HD       ARG  35   7.468  -0.850   5.491
  257    HE   ARG  35           HE       ARG  35   7.631  -1.104   8.176
  258   1HH1  ARG  35          1HH1      ARG  35   6.168   1.285   6.095
  259   2HH1  ARG  35          2HH1      ARG  35   4.911   1.678   7.220
  260   1HH2  ARG  35          1HH2      ARG  35   5.978  -0.589   9.657
  261   2HH2  ARG  35          2HH2      ARG  35   4.804   0.615   9.243
  262    H    ILE  36           H        ILE  36  11.882  -2.075   8.423
  263    HA   ILE  36           HA       ILE  36  10.810  -4.109  10.266
  264    HB   ILE  36           HB       ILE  36  13.214  -4.467   9.877
  265   1HG1  ILE  36          2HG1      ILE  36  13.775  -3.800  12.485
  266   2HG1  ILE  36          1HG1      ILE  36  12.015  -3.846  12.485
  267   1HG2  ILE  36          1HG2      ILE  36  14.796  -2.749  10.842
  268   2HG2  ILE  36          2HG2      ILE  36  13.436  -1.627  10.839
  269   3HG2  ILE  36          3HG2      ILE  36  14.015  -2.316   9.323
  270   1HD1  ILE  36          1HD1      ILE  36  11.941  -6.089  12.045
  271   2HD1  ILE  36          2HD1      ILE  36  13.412  -5.984  13.012
  272   3HD1  ILE  36          3HD1      ILE  36  13.517  -6.099  11.255
  Start of MODEL   11
    1   1H    GLY   1          1HT       GLY   1  -9.298  12.867   4.405
    2   2H    GLY   1          2HT       GLY   1 -10.798  13.603   4.144
    3   3H    GLY   1          3HT       GLY   1  -9.424  14.554   4.403
    4   1HA   GLY   1          1HA       GLY   1  -9.844  12.762   2.075
    5   2HA   GLY   1          2HA       GLY   1 -10.074  14.504   2.055
    6    H    SER   2           H        SER   2  -8.064  12.288   0.981
    7    HA   SER   2           HA       SER   2  -5.914  12.277   0.248
    8   1HB   SER   2          2HB       SER   2  -6.150  15.220   0.897
    9   2HB   SER   2          1HB       SER   2  -4.733  14.510   0.125
   10    HG   SER   2           HG       SER   2  -6.294  13.693  -1.482
   11    H    LEU   3           H        LEU   3  -5.463  14.784   2.717
   12    HA   LEU   3           HA       LEU   3  -3.256  13.362   3.859
   13   1HB   LEU   3          2HB       LEU   3  -3.316  15.232   5.549
   14   2HB   LEU   3          1HB       LEU   3  -3.087  15.714   3.878
   15    HG   LEU   3           HG       LEU   3  -5.890  15.705   4.790
   16   1HD1  LEU   3          1HD1      LEU   3  -3.790  17.237   6.194
   17   2HD1  LEU   3          2HD1      LEU   3  -5.365  16.685   6.759
   18   3HD1  LEU   3          3HD1      LEU   3  -5.248  18.119   5.740
   19   1HD2  LEU   3          1HD2      LEU   3  -4.643  16.610   2.611
   20   2HD2  LEU   3          2HD2      LEU   3  -4.547  18.062   3.607
   21   3HD2  LEU   3          3HD2      LEU   3  -6.116  17.345   3.242
   22    H    LEU   4           H        LEU   4  -3.090  12.504   5.954
   23    HA   LEU   4           HA       LEU   4  -3.757  11.352   7.797
   24   1HB   LEU   4          2HB       LEU   4  -5.468  13.614   7.680
   25   2HB   LEU   4          1HB       LEU   4  -6.455  12.238   8.136
   26    HG   LEU   4           HG       LEU   4  -5.658  13.360  10.120
   27   1HD1  LEU   4          1HD1      LEU   4  -5.191  11.472  11.260
   28   2HD1  LEU   4          2HD1      LEU   4  -3.883  11.007  10.171
   29   3HD1  LEU   4          3HD1      LEU   4  -5.560  10.705   9.714
   30   1HD2  LEU   4          1HD2      LEU   4  -3.081  13.265   8.675
   31   2HD2  LEU   4          2HD2      LEU   4  -3.019  13.028  10.422
   32   3HD2  LEU   4          3HD2      LEU   4  -3.735  14.496   9.756
   33    H    LYS   5           H        LYS   5  -6.941  11.740   6.268
   34    HA   LYS   5           HA       LYS   5  -7.453   8.926   6.461
   35   1HB   LYS   5          2HB       LYS   5  -8.962  11.337   5.639
   36   2HB   LYS   5          1HB       LYS   5  -9.478   9.818   4.919
   37   1HG   LYS   5          2HG       LYS   5  -9.061   9.576   7.774
   38   2HG   LYS   5          1HG       LYS   5 -10.240  10.826   7.375
   39   1HD   LYS   5          2HD       LYS   5 -11.563   8.931   7.523
   40   2HD   LYS   5          1HD       LYS   5 -11.232   9.020   5.792
   41   1HE   LYS   5          2HE       LYS   5  -9.642   7.295   5.896
   42   2HE   LYS   5          1HE       LYS   5  -9.510   7.410   7.650
   43   1HZ   LYS   5          1HZ       LYS   5 -10.961   5.568   6.411
   44   2HZ   LYS   5          2HZ       LYS   5 -12.144   6.761   6.610
   45   3HZ   LYS   5          3HZ       LYS   5 -11.330   6.145   7.958
   46    HA   PRO   6           HA       PRO   6  -5.463   8.195   2.470
   47   1HB   PRO   6          2HB       PRO   6  -5.629   5.488   2.565
   48   2HB   PRO   6          1HB       PRO   6  -4.397   6.404   3.440
   49   1HG   PRO   6          2HG       PRO   6  -6.974   5.257   4.444
   50   2HG   PRO   6          1HG       PRO   6  -5.371   5.236   5.202
   51   1HD   PRO   6          2HD       PRO   6  -7.299   6.988   5.931
   52   2HD   PRO   6          1HD       PRO   6  -5.572   7.398   5.981
   53    H    ALA   7           H        ALA   7  -6.177   7.570   0.428
   54    HA   ALA   7           HA       ALA   7  -8.764   6.316   0.103
   55   1HB   ALA   7          1HB       ALA   7  -8.611   8.872  -1.357
   56   2HB   ALA   7          2HB       ALA   7  -8.859   8.992   0.384
   57   3HB   ALA   7          3HB       ALA   7  -9.991   8.073  -0.607
   58    H    ARG   8           H        ARG   8  -5.983   5.779  -0.631
   59    HA   ARG   8           HA       ARG   8  -6.415   5.402  -3.500
   60   1HB   ARG   8          2HB       ARG   8  -4.236   6.963  -2.241
   61   2HB   ARG   8          1HB       ARG   8  -3.755   5.862  -3.524
   62   1HG   ARG   8          2HG       ARG   8  -6.042   7.722  -3.968
   63   2HG   ARG   8          1HG       ARG   8  -4.387   8.326  -4.070
   64   1HD   ARG   8          2HD       ARG   8  -3.854   6.819  -5.824
   65   2HD   ARG   8          1HD       ARG   8  -5.346   5.910  -5.586
   66    HE   ARG   8           HE       ARG   8  -6.019   8.549  -6.214
   67   1HH1  ARG   8          1HH1      ARG   8  -4.535   5.771  -7.718
   68   2HH1  ARG   8          2HH1      ARG   8  -5.045   6.207  -9.314
   69   1HH2  ARG   8          1HH2      ARG   8  -6.692   9.123  -8.313
   70   2HH2  ARG   8          2HH2      ARG   8  -6.269   8.110  -9.653
   71    H    PHE   9           H        PHE   9  -4.614   3.909  -4.389
   72    HA   PHE   9           HA       PHE   9  -3.509   2.054  -2.468
   73   1HB   PHE   9          2HB       PHE   9  -4.660   0.083  -3.418
   74   2HB   PHE   9          1HB       PHE   9  -5.784   1.200  -2.655
   75    HD1  PHE   9           1HD      PHE   9  -7.599   2.054  -3.836
   76    HD2  PHE   9           2HD      PHE   9  -4.417   0.174  -5.946
   77    HE1  PHE   9           1HE      PHE   9  -8.928   2.135  -5.906
   78    HE2  PHE   9           2HE      PHE   9  -5.740   0.252  -8.019
   79    HZ   PHE   9           HZ       PHE   9  -7.999   1.232  -8.000
   80    H    MET  10           H        MET  10  -2.841  -0.037  -4.046
   81    HA   MET  10           HA       MET  10  -1.516  -0.777  -5.751
   82   1HB   MET  10          2HB       MET  10  -3.010   1.077  -7.032
   83   2HB   MET  10          1HB       MET  10  -1.419   1.800  -7.203
   84   1HG   MET  10          2HG       MET  10  -0.649  -0.432  -8.104
   85   2HG   MET  10          1HG       MET  10  -2.353  -0.878  -8.181
   86   1HE   MET  10          1HE       MET  10   0.553   0.885  -9.441
   87   2HE   MET  10          2HE       MET  10  -0.174   2.490  -9.514
   88   3HE   MET  10          3HE       MET  10   0.100   1.578 -10.998
   89    H    CYS  11           H        CYS  11   0.635  -0.988  -5.744
   90    HA   CYS  11           HA       CYS  11   2.199   1.104  -4.425
   91   1HB   CYS  11          2HB       CYS  11   2.183  -1.539  -3.949
   92   2HB   CYS  11          1HB       CYS  11   3.446  -1.489  -5.174
   93    H    LEU  12           H        LEU  12   2.423   2.576  -6.124
   94    HA   LEU  12           HA       LEU  12   3.150   2.020  -8.741
   95   1HB   LEU  12          2HB       LEU  12   4.241   4.457  -7.401
   96   2HB   LEU  12          1HB       LEU  12   3.580   4.278  -9.013
   97    HG   LEU  12           HG       LEU  12   1.391   3.744  -7.455
   98   1HD1  LEU  12          1HD1      LEU  12   1.582   5.969  -5.983
   99   2HD1  LEU  12          2HD1      LEU  12   3.264   5.442  -5.928
  100   3HD1  LEU  12          3HD1      LEU  12   1.983   4.368  -5.365
  101   1HD2  LEU  12          1HD2      LEU  12   2.418   6.064  -8.972
  102   2HD2  LEU  12          2HD2      LEU  12   1.045   6.359  -7.904
  103   3HD2  LEU  12          3HD2      LEU  12   0.929   5.142  -9.175
  104    HA   PRO  13           HA       PRO  13   7.760   2.278  -7.523
  105   1HB   PRO  13          2HB       PRO  13   8.498   2.466  -4.959
  106   2HB   PRO  13          1HB       PRO  13   7.969   3.887  -5.867
  107   1HG   PRO  13          2HG       PRO  13   6.463   2.236  -3.882
  108   2HG   PRO  13          1HG       PRO  13   6.481   3.996  -4.092
  109   1HD   PRO  13          2HD       PRO  13   4.513   2.313  -5.059
  110   2HD   PRO  13          1HD       PRO  13   4.861   3.931  -5.694
  111    H    CYS  14           H        CYS  14   6.343  -0.024  -7.836
  112    HA   CYS  14           HA       CYS  14   8.035  -1.952  -6.531
  113   1HB   CYS  14          2HB       CYS  14   5.406  -1.401  -5.503
  114   2HB   CYS  14          1HB       CYS  14   5.463  -3.041  -6.135
  115    H    GLY  15           H        GLY  15   5.127  -1.471  -8.499
  116   1HA   GLY  15          2HA       GLY  15   5.291  -2.128 -10.853
  117   2HA   GLY  15          1HA       GLY  15   6.100  -3.572 -10.283
  118    H    ILE  16           H        ILE  16   4.169  -3.737  -7.987
  119    HA   ILE  16           HA       ILE  16   2.163  -5.279  -9.397
  120    HB   ILE  16           HB       ILE  16   2.395  -4.856  -6.419
  121   1HG1  ILE  16          2HG1      ILE  16   3.372  -7.408  -7.408
  122   2HG1  ILE  16          1HG1      ILE  16   4.294  -6.066  -8.079
  123   1HG2  ILE  16          1HG2      ILE  16   0.839  -6.683  -8.183
  124   2HG2  ILE  16          2HG2      ILE  16   0.338  -5.820  -6.729
  125   3HG2  ILE  16          3HG2      ILE  16   1.353  -7.257  -6.596
  126   1HD1  ILE  16          1HD1      ILE  16   5.491  -6.211  -6.209
  127   2HD1  ILE  16          2HD1      ILE  16   4.250  -7.149  -5.376
  128   3HD1  ILE  16          3HD1      ILE  16   4.133  -5.390  -5.440
  129    H    ALA  17           H        ALA  17  -0.135  -5.085  -8.895
  130    HA   ALA  17           HA       ALA  17  -0.978  -2.427  -7.991
  131   1HB   ALA  17          1HB       ALA  17  -0.757  -2.714 -10.585
  132   2HB   ALA  17          2HB       ALA  17  -2.149  -1.883  -9.892
  133   3HB   ALA  17          3HB       ALA  17  -2.295  -3.561 -10.415
  134    H    PHE  18           H        PHE  18  -2.283  -2.818  -6.327
  135    HA   PHE  18           HA       PHE  18  -3.805  -5.253  -6.139
  136   1HB   PHE  18          2HB       PHE  18  -3.292  -2.895  -4.351
  137   2HB   PHE  18          1HB       PHE  18  -4.498  -4.094  -3.948
  138    HD1  PHE  18           1HD      PHE  18  -3.586  -6.613  -4.190
  139    HD2  PHE  18           2HD      PHE  18  -1.221  -3.159  -3.423
  140    HE1  PHE  18           1HE      PHE  18  -1.837  -8.034  -3.200
  141    HE2  PHE  18           2HE      PHE  18   0.531  -4.574  -2.433
  142    HZ   PHE  18           HZ       PHE  18   0.225  -7.015  -2.320
  143    H    SER  19           H        SER  19  -6.083  -4.526  -4.849
  144    HA   SER  19           HA       SER  19  -7.475  -2.474  -6.330
  145   1HB   SER  19          2HB       SER  19  -7.736  -5.337  -6.990
  146   2HB   SER  19          1HB       SER  19  -9.263  -4.483  -6.772
  147    HG   SER  19           HG       SER  19  -7.151  -3.677  -8.491
  148    H    SER  20           H        SER  20  -6.824  -3.126  -3.531
  149    HA   SER  20           HA       SER  20  -9.370  -2.538  -2.405
  150   1HB   SER  20          2HB       SER  20  -9.234  -5.141  -2.746
  151   2HB   SER  20          1HB       SER  20  -8.217  -5.074  -1.306
  152    HG   SER  20           HG       SER  20 -10.807  -3.928  -1.467
  153    HA   PRO  21           HA       PRO  21  -6.587  -0.831   0.596
  154   1HB   PRO  21          2HB       PRO  21  -8.331   0.037   2.420
  155   2HB   PRO  21          1HB       PRO  21  -8.293   0.730   0.794
  156   1HG   PRO  21          2HG       PRO  21 -10.178  -1.278   1.954
  157   2HG   PRO  21          1HG       PRO  21 -10.520   0.088   0.879
  158   1HD   PRO  21          2HD       PRO  21 -10.242  -2.546   0.062
  159   2HD   PRO  21          1HD       PRO  21 -10.057  -1.130  -0.990
  160    H    SER  22           H        SER  22  -6.687  -3.645   0.773
  161    HA   SER  22           HA       SER  22  -6.335  -3.985   3.659
  162   1HB   SER  22          2HB       SER  22  -8.574  -4.997   2.462
  163   2HB   SER  22          1HB       SER  22  -7.456  -6.349   2.278
  164    HG   SER  22           HG       SER  22  -7.039  -5.992   4.619
  165    H    THR  23           H        THR  23  -5.950  -5.444   0.441
  166    HA   THR  23           HA       THR  23  -3.848  -7.181   1.132
  167    HB   THR  23           HB       THR  23  -3.827  -6.021  -1.594
  168    HG1  THR  23           1HG      THR  23  -5.784  -6.787  -2.156
  169   1HG2  THR  23          1HG2      THR  23  -3.640  -8.246  -2.323
  170   2HG2  THR  23          2HG2      THR  23  -4.204  -8.881  -0.777
  171   3HG2  THR  23          3HG2      THR  23  -2.618  -8.118  -0.892
  172    H    LEU  24           H        LEU  24  -3.989  -3.792   0.368
  173    HA   LEU  24           HA       LEU  24  -1.270  -3.332  -0.162
  174   1HB   LEU  24          2HB       LEU  24  -2.936  -1.309   1.276
  175   2HB   LEU  24          1HB       LEU  24  -1.768  -1.073  -0.004
  176    HG   LEU  24           HG       LEU  24  -4.590  -2.066  -0.266
  177   1HD1  LEU  24          1HD1      LEU  24  -3.453   0.175  -1.835
  178   2HD1  LEU  24          2HD1      LEU  24  -3.797   0.456  -0.128
  179   3HD1  LEU  24          3HD1      LEU  24  -5.087  -0.063  -1.215
  180   1HD2  LEU  24          1HD2      LEU  24  -2.571  -1.811  -2.483
  181   2HD2  LEU  24          2HD2      LEU  24  -4.218  -2.431  -2.589
  182   3HD2  LEU  24          3HD2      LEU  24  -2.989  -3.340  -1.711
  183    H    GLU  25           H        GLU  25  -3.186  -3.271   2.782
  184    HA   GLU  25           HA       GLU  25  -1.100  -2.518   4.524
  185   1HB   GLU  25          2HB       GLU  25  -3.756  -2.767   4.820
  186   2HB   GLU  25          1HB       GLU  25  -3.267  -4.299   5.525
  187   1HG   GLU  25          2HG       GLU  25  -1.739  -1.994   6.481
  188   2HG   GLU  25          1HG       GLU  25  -3.461  -1.935   6.858
  189    H    ALA  26           H        ALA  26  -2.100  -5.533   3.144
  190    HA   ALA  26           HA       ALA  26  -0.517  -7.172   4.824
  191   1HB   ALA  26          1HB       ALA  26  -2.612  -7.694   3.216
  192   2HB   ALA  26          2HB       ALA  26  -1.485  -8.928   3.779
  193   3HB   ALA  26          3HB       ALA  26  -1.282  -8.212   2.179
  194    H    HIS  27           H        HIS  27  -0.193  -5.577   1.758
  195    HA   HIS  27           HA       HIS  27   2.270  -6.808   0.994
  196   1HB   HIS  27          2HB       HIS  27   0.803  -5.862  -0.696
  197   2HB   HIS  27          1HB       HIS  27   0.882  -4.281   0.069
  198    HD1  HIS  27           1HD      HIS  27   2.944  -6.631  -2.041
  199    HD2  HIS  27           2HD      HIS  27   3.048  -2.742  -0.588
  200    HE1  HIS  27           1HE      HIS  27   4.823  -5.465  -3.268
  201    H    GLN  28           H        GLN  28   1.371  -3.642   2.287
  202    HA   GLN  28           HA       GLN  28   4.009  -2.693   2.633
  203   1HB   GLN  28          2HB       GLN  28   1.343  -1.764   3.102
  204   2HB   GLN  28          1HB       GLN  28   2.288  -1.496   4.560
  205   1HG   GLN  28          2HG       GLN  28   3.407  -0.688   1.922
  206   2HG   GLN  28          1HG       GLN  28   2.174   0.311   2.687
  207   1HE2  GLN  28          1HE2      GLN  28   3.162   2.006   3.527
  208   2HE2  GLN  28          2HE2      GLN  28   4.583   1.968   4.509
  209    H    ALA  29           H        ALA  29   2.136  -4.984   4.329
  210    HA   ALA  29           HA       ALA  29   3.228  -4.649   6.925
  211   1HB   ALA  29          1HB       ALA  29   1.620  -6.741   5.553
  212   2HB   ALA  29          2HB       ALA  29   1.261  -5.809   7.006
  213   3HB   ALA  29          3HB       ALA  29   2.412  -7.142   7.077
  214    H    TYR  30           H        TYR  30   3.842  -7.235   4.503
  215    HA   TYR  30           HA       TYR  30   6.634  -7.255   5.325
  216   1HB   TYR  30          2HB       TYR  30   4.689  -9.486   5.758
  217   2HB   TYR  30          1HB       TYR  30   6.378  -9.847   5.442
  218    HD1  TYR  30           1HD      TYR  30   3.989  -8.505   7.838
  219    HD2  TYR  30           2HD      TYR  30   8.114  -9.198   7.062
  220    HE1  TYR  30           1HE      TYR  30   4.491  -8.132  10.215
  221    HE2  TYR  30           2HE      TYR  30   8.629  -8.828   9.438
  222    HH   TYR  30           HH       TYR  30   7.701  -7.762  11.379
  223    H    TYR  31           H        TYR  31   4.848  -6.834   2.813
  224    HA   TYR  31           HA       TYR  31   6.229  -8.792   1.101
  225   1HB   TYR  31          2HB       TYR  31   3.541  -8.134   1.192
  226   2HB   TYR  31          1HB       TYR  31   4.131  -7.250  -0.213
  227    HD1  TYR  31           1HD      TYR  31   4.668 -10.639   1.285
  228    HD2  TYR  31           2HD      TYR  31   3.845  -8.361  -2.212
  229    HE1  TYR  31           1HE      TYR  31   4.574 -12.711  -0.035
  230    HE2  TYR  31           2HE      TYR  31   3.746 -10.427  -3.542
  231    HH   TYR  31           HH       TYR  31   4.899 -13.365  -2.462
  232    H    CYS  32           H        CYS  32   5.583  -5.365   1.568
  233    HA   CYS  32           HA       CYS  32   6.968  -4.546  -0.802
  234   1HB   CYS  32          2HB       CYS  32   5.165  -3.257   0.573
  235   2HB   CYS  32          1HB       CYS  32   6.529  -2.749   1.563
  236    H    SER  33           H        SER  33   9.033  -5.313  -0.845
  237    HA   SER  33           HA       SER  33  11.218  -5.647  -0.258
  238   1HB   SER  33          2HB       SER  33  11.000  -2.863   0.897
  239   2HB   SER  33          1HB       SER  33  12.426  -3.633   0.202
  240    HG   SER  33           HG       SER  33  11.770  -3.070  -1.712
  241    H    HIS  34           H        HIS  34  12.828  -4.794   1.780
  242    HA   HIS  34           HA       HIS  34  11.814  -6.378   3.987
  243   1HB   HIS  34          2HB       HIS  34  14.487  -5.298   3.195
  244   2HB   HIS  34          1HB       HIS  34  14.216  -5.739   4.878
  245    HD1  HIS  34           1HD      HIS  34  15.730  -7.135   2.121
  246    HD2  HIS  34           2HD      HIS  34  12.807  -8.561   4.707
  247    HE1  HIS  34           1HE      HIS  34  15.808  -9.639   1.909
  248    HE2  HIS  34           2HE      HIS  34  13.968 -10.475   3.414
  249    H    ARG  35           H        ARG  35  10.145  -4.793   4.544
  250    HA   ARG  35           HA       ARG  35  10.932  -2.244   5.605
  251   1HB   ARG  35          2HB       ARG  35   8.615  -3.131   4.603
  252   2HB   ARG  35          1HB       ARG  35   8.296  -3.425   6.307
  253   1HG   ARG  35          2HG       ARG  35   9.407  -0.779   5.743
  254   2HG   ARG  35          1HG       ARG  35   7.836  -1.082   4.999
  255   1HD   ARG  35          2HD       ARG  35   6.773  -0.983   6.963
  256   2HD   ARG  35          1HD       ARG  35   7.974  -2.000   7.758
  257    HE   ARG  35           HE       ARG  35   8.972  -0.114   8.572
  258   1HH1  ARG  35          1HH1      ARG  35   6.876   0.786   5.930
  259   2HH1  ARG  35          2HH1      ARG  35   7.081   2.487   6.182
  260   1HH2  ARG  35          1HH2      ARG  35   9.242   2.123   8.906
  261   2HH2  ARG  35          2HH2      ARG  35   8.424   3.247   7.872
  262    H    ILE  36           H        ILE  36  12.001  -2.083   7.459
  263    HA   ILE  36           HA       ILE  36  10.986  -3.498   9.801
  264    HB   ILE  36           HB       ILE  36  12.763  -4.951   8.946
  265   1HG1  ILE  36          2HG1      ILE  36  14.064  -3.692  11.306
  266   2HG1  ILE  36          1HG1      ILE  36  12.396  -4.222  11.500
  267   1HG2  ILE  36          1HG2      ILE  36  15.144  -3.707   9.394
  268   2HG2  ILE  36          2HG2      ILE  36  14.180  -2.400   8.706
  269   3HG2  ILE  36          3HG2      ILE  36  14.389  -3.906   7.812
  270   1HD1  ILE  36          1HD1      ILE  36  12.979  -6.367  11.581
  271   2HD1  ILE  36          2HD1      ILE  36  14.618  -5.771  11.847
  272   3HD1  ILE  36          3HD1      ILE  36  14.092  -6.212  10.222
  Start of MODEL   12
    1   1H    GLY   1          1HT       GLY   1  -9.781  11.469   2.299
    2   2H    GLY   1          2HT       GLY   1 -10.381  12.948   1.741
    3   3H    GLY   1          3HT       GLY   1  -9.079  12.917   2.820
    4   1HA   GLY   1          1HA       GLY   1  -8.205  11.374   0.757
    5   2HA   GLY   1          2HA       GLY   1  -9.097  12.662  -0.037
    6    H    SER   2           H        SER   2  -6.902  13.135  -0.884
    7    HA   SER   2           HA       SER   2  -5.103  14.520  -0.997
    8   1HB   SER   2          2HB       SER   2  -6.784  15.754   1.101
    9   2HB   SER   2          1HB       SER   2  -5.089  16.242   1.098
   10    HG   SER   2           HG       SER   2  -6.584  17.494  -0.265
   11    H    LEU   3           H        LEU   3  -5.370  14.477   2.540
   12    HA   LEU   3           HA       LEU   3  -2.968  12.792   2.666
   13   1HB   LEU   3          2HB       LEU   3  -2.176  14.270   4.561
   14   2HB   LEU   3          1HB       LEU   3  -2.048  14.938   2.945
   15    HG   LEU   3           HG       LEU   3  -4.531  15.597   4.406
   16   1HD1  LEU   3          1HD1      LEU   3  -1.839  16.237   5.444
   17   2HD1  LEU   3          2HD1      LEU   3  -3.379  16.085   6.290
   18   3HD1  LEU   3          3HD1      LEU   3  -3.008  17.558   5.394
   19   1HD2  LEU   3          1HD2      LEU   3  -3.372  16.425   2.101
   20   2HD2  LEU   3          2HD2      LEU   3  -2.825  17.673   3.220
   21   3HD2  LEU   3          3HD2      LEU   3  -4.550  17.364   3.019
   22    H    LEU   4           H        LEU   4  -2.543  12.273   5.122
   23    HA   LEU   4           HA       LEU   4  -3.226  11.195   7.004
   24   1HB   LEU   4          2HB       LEU   4  -5.119  13.335   6.641
   25   2HB   LEU   4          1HB       LEU   4  -5.924  11.938   7.328
   26    HG   LEU   4           HG       LEU   4  -5.085  13.545   9.025
   27   1HD1  LEU   4          1HD1      LEU   4  -4.353  10.685   8.910
   28   2HD1  LEU   4          2HD1      LEU   4  -5.360  11.558  10.067
   29   3HD1  LEU   4          3HD1      LEU   4  -3.602  11.646  10.184
   30   1HD2  LEU   4          1HD2      LEU   4  -2.889  13.780   7.487
   31   2HD2  LEU   4          2HD2      LEU   4  -2.309  12.619   8.679
   32   3HD2  LEU   4          3HD2      LEU   4  -2.930  14.184   9.203
   33    H    LYS   5           H        LYS   5  -6.385  11.380   5.392
   34    HA   LYS   5           HA       LYS   5  -6.712   8.525   5.659
   35   1HB   LYS   5          2HB       LYS   5  -8.435  10.823   4.906
   36   2HB   LYS   5          1HB       LYS   5  -8.883   9.249   4.262
   37   1HG   LYS   5          2HG       LYS   5  -8.748   8.403   6.653
   38   2HG   LYS   5          1HG       LYS   5  -8.689  10.100   7.131
   39   1HD   LYS   5          2HD       LYS   5 -10.831  10.527   6.204
   40   2HD   LYS   5          1HD       LYS   5 -10.856   8.971   5.372
   41   1HE   LYS   5          2HE       LYS   5 -10.465   8.486   8.145
   42   2HE   LYS   5          1HE       LYS   5 -11.810   9.613   7.971
   43   1HZ   LYS   5          1HZ       LYS   5 -11.681   7.187   6.302
   44   2HZ   LYS   5          2HZ       LYS   5 -13.032   8.097   6.756
   45   3HZ   LYS   5          3HZ       LYS   5 -12.268   7.099   7.887
   46    HA   PRO   6           HA       PRO   6  -4.900   7.859   1.589
   47   1HB   PRO   6          2HB       PRO   6  -5.221   5.153   1.578
   48   2HB   PRO   6          1HB       PRO   6  -3.905   5.970   2.429
   49   1HG   PRO   6          2HG       PRO   6  -6.492   4.920   3.506
   50   2HG   PRO   6          1HG       PRO   6  -4.862   4.800   4.194
   51   1HD   PRO   6          2HD       PRO   6  -6.662   6.609   5.071
   52   2HD   PRO   6          1HD       PRO   6  -4.920   6.952   5.032
   53    H    ALA   7           H        ALA   7  -5.654   6.261  -0.289
   54    HA   ALA   7           HA       ALA   7  -8.394   5.675  -0.564
   55   1HB   ALA   7          1HB       ALA   7  -8.629   7.553  -2.442
   56   2HB   ALA   7          2HB       ALA   7  -7.542   8.402  -1.342
   57   3HB   ALA   7          3HB       ALA   7  -9.104   7.820  -0.765
   58    H    ARG   8           H        ARG   8  -5.406   6.603  -2.195
   59    HA   ARG   8           HA       ARG   8  -6.039   5.250  -4.634
   60   1HB   ARG   8          2HB       ARG   8  -4.268   7.172  -4.026
   61   2HB   ARG   8          1HB       ARG   8  -3.205   5.775  -3.922
   62   1HG   ARG   8          2HG       ARG   8  -4.029   5.141  -6.227
   63   2HG   ARG   8          1HG       ARG   8  -4.765   6.743  -6.297
   64   1HD   ARG   8          2HD       ARG   8  -2.137   7.157  -5.423
   65   2HD   ARG   8          1HD       ARG   8  -2.023   5.964  -6.716
   66    HE   ARG   8           HE       ARG   8  -3.703   8.143  -7.445
   67   1HH1  ARG   8          1HH1      ARG   8  -0.361   7.191  -7.120
   68   2HH1  ARG   8          2HH1      ARG   8   0.205   8.318  -8.306
   69   1HH2  ARG   8          1HH2      ARG   8  -2.959   9.626  -9.005
   70   2HH2  ARG   8          2HH2      ARG   8  -1.269   9.701  -9.376
   71    H    PHE   9           H        PHE   9  -5.379   3.267  -5.361
   72    HA   PHE   9           HA       PHE   9  -3.994   1.532  -3.428
   73   1HB   PHE   9          2HB       PHE   9  -5.517  -0.285  -4.682
   74   2HB   PHE   9          1HB       PHE   9  -6.041   0.549  -3.222
   75    HD1  PHE   9           1HD      PHE   9  -8.224   1.213  -3.257
   76    HD2  PHE   9           2HD      PHE   9  -6.010   1.281  -6.890
   77    HE1  PHE   9           1HE      PHE   9 -10.208   2.051  -4.447
   78    HE2  PHE   9           2HE      PHE   9  -7.989   2.121  -8.085
   79    HZ   PHE   9           HZ       PHE   9 -10.091   2.507  -6.864
   80    H    MET  10           H        MET  10  -2.150   2.274  -4.783
   81    HA   MET  10           HA       MET  10  -1.669   0.325  -6.880
   82   1HB   MET  10          2HB       MET  10  -2.623   2.313  -8.038
   83   2HB   MET  10          1HB       MET  10  -1.300   3.281  -7.399
   84   1HG   MET  10          2HG       MET  10   0.161   2.518  -8.912
   85   2HG   MET  10          1HG       MET  10  -0.460   0.870  -8.832
   86   1HE   MET  10          1HE       MET  10   0.011   0.585 -11.296
   87   2HE   MET  10          2HE       MET  10   0.463   2.240 -11.702
   88   3HE   MET  10          3HE       MET  10  -0.805   1.424 -12.616
   89    H    CYS  11           H        CYS  11   0.173  -0.594  -6.308
   90    HA   CYS  11           HA       CYS  11   2.122   0.878  -4.731
   91   1HB   CYS  11          2HB       CYS  11   1.264  -1.683  -4.567
   92   2HB   CYS  11          1HB       CYS  11   2.707  -1.903  -5.551
   93    H    LEU  12           H        LEU  12   2.961   2.305  -6.252
   94    HA   LEU  12           HA       LEU  12   3.985   1.503  -8.770
   95   1HB   LEU  12          2HB       LEU  12   5.000   3.924  -7.343
   96   2HB   LEU  12          1HB       LEU  12   4.671   3.698  -9.050
   97    HG   LEU  12           HG       LEU  12   2.182   3.418  -7.798
   98   1HD1  LEU  12          1HD1      LEU  12   2.288   5.874  -6.765
   99   2HD1  LEU  12          2HD1      LEU  12   3.925   5.342  -6.381
  100   3HD1  LEU  12          3HD1      LEU  12   2.539   4.420  -5.799
  101   1HD2  LEU  12          1HD2      LEU  12   3.545   5.349  -9.570
  102   2HD2  LEU  12          2HD2      LEU  12   2.066   5.903  -8.786
  103   3HD2  LEU  12          3HD2      LEU  12   2.039   4.460  -9.800
  104    HA   PRO  13           HA       PRO  13   8.268   1.993  -6.125
  105   1HB   PRO  13          2HB       PRO  13   7.047   0.224  -4.033
  106   2HB   PRO  13          1HB       PRO  13   8.360   1.398  -3.881
  107   1HG   PRO  13          2HG       PRO  13   5.899   2.022  -3.092
  108   2HG   PRO  13          1HG       PRO  13   6.919   3.216  -3.914
  109   1HD   PRO  13          2HD       PRO  13   4.553   1.740  -4.918
  110   2HD   PRO  13          1HD       PRO  13   5.183   3.326  -5.403
  111    H    CYS  14           H        CYS  14   6.049  -0.753  -6.382
  112    HA   CYS  14           HA       CYS  14   8.295  -2.408  -7.281
  113   1HB   CYS  14          2HB       CYS  14   6.991  -4.332  -6.536
  114   2HB   CYS  14          1HB       CYS  14   7.287  -3.231  -5.204
  115    H    GLY  15           H        GLY  15   5.106  -1.186  -7.935
  116   1HA   GLY  15          2HA       GLY  15   4.170  -0.926 -10.045
  117   2HA   GLY  15          1HA       GLY  15   5.347  -2.064 -10.661
  118    H    ILE  16           H        ILE  16   2.613  -2.016  -8.392
  119    HA   ILE  16           HA       ILE  16   1.408  -4.257  -9.798
  120    HB   ILE  16           HB       ILE  16   1.889  -4.463  -6.828
  121   1HG1  ILE  16          2HG1      ILE  16   3.355  -5.851  -9.085
  122   2HG1  ILE  16          1HG1      ILE  16   4.030  -4.616  -8.027
  123   1HG2  ILE  16          1HG2      ILE  16   0.446  -6.052  -8.853
  124   2HG2  ILE  16          2HG2      ILE  16   0.127  -5.845  -7.130
  125   3HG2  ILE  16          3HG2      ILE  16   1.382  -6.961  -7.666
  126   1HD1  ILE  16          1HD1      ILE  16   4.758  -6.282  -6.765
  127   2HD1  ILE  16          2HD1      ILE  16   3.763  -7.462  -7.619
  128   3HD1  ILE  16          3HD1      ILE  16   3.080  -6.533  -6.283
  129    H    ALA  17           H        ALA  17  -0.645  -3.721 -10.085
  130    HA   ALA  17           HA       ALA  17  -1.910  -1.811  -8.277
  131   1HB   ALA  17          1HB       ALA  17  -1.931  -1.763 -10.894
  132   2HB   ALA  17          2HB       ALA  17  -3.363  -1.287  -9.980
  133   3HB   ALA  17          3HB       ALA  17  -3.271  -2.895 -10.700
  134    H    PHE  18           H        PHE  18  -2.853  -2.674  -6.538
  135    HA   PHE  18           HA       PHE  18  -3.981  -5.331  -6.601
  136   1HB   PHE  18          2HB       PHE  18  -3.306  -3.303  -4.534
  137   2HB   PHE  18          1HB       PHE  18  -4.577  -4.440  -4.148
  138    HD1  PHE  18           1HD      PHE  18  -4.015  -6.450  -3.174
  139    HD2  PHE  18           2HD      PHE  18  -1.113  -4.384  -5.504
  140    HE1  PHE  18           1HE      PHE  18  -2.328  -8.130  -2.554
  141    HE2  PHE  18           2HE      PHE  18   0.579  -6.062  -4.889
  142    HZ   PHE  18           HZ       PHE  18  -0.027  -7.937  -3.413
  143    H    SER  19           H        SER  19  -6.092  -5.025  -4.803
  144    HA   SER  19           HA       SER  19  -7.960  -3.093  -5.860
  145   1HB   SER  19          2HB       SER  19  -8.083  -5.996  -6.547
  146   2HB   SER  19          1HB       SER  19  -9.599  -5.160  -6.216
  147    HG   SER  19           HG       SER  19  -9.430  -4.561  -8.224
  148    H    SER  20           H        SER  20  -6.738  -3.684  -3.311
  149    HA   SER  20           HA       SER  20  -9.090  -3.639  -1.697
  150   1HB   SER  20          2HB       SER  20  -8.942  -6.043  -1.901
  151   2HB   SER  20          1HB       SER  20  -7.229  -6.012  -1.486
  152    HG   SER  20           HG       SER  20  -8.514  -6.576   0.310
  153    HA   PRO  21           HA       PRO  21  -6.084  -0.750   0.081
  154   1HB   PRO  21          2HB       PRO  21  -8.256  -0.814   2.136
  155   2HB   PRO  21          1HB       PRO  21  -7.391   0.571   1.458
  156   1HG   PRO  21          2HG       PRO  21  -9.852  -0.012   0.639
  157   2HG   PRO  21          1HG       PRO  21  -8.621   0.546  -0.510
  158   1HD   PRO  21          2HD       PRO  21  -9.737  -2.181  -0.105
  159   2HD   PRO  21          1HD       PRO  21  -9.128  -1.416  -1.586
  160    H    SER  22           H        SER  22  -7.890  -2.866   2.330
  161    HA   SER  22           HA       SER  22  -5.911  -3.040   4.279
  162   1HB   SER  22          2HB       SER  22  -8.419  -3.901   4.203
  163   2HB   SER  22          1HB       SER  22  -7.643  -5.422   3.764
  164    HG   SER  22           HG       SER  22  -7.941  -4.447   6.168
  165    H    THR  23           H        THR  23  -6.409  -4.985   1.375
  166    HA   THR  23           HA       THR  23  -4.498  -6.966   1.931
  167    HB   THR  23           HB       THR  23  -5.375  -5.894  -0.758
  168    HG1  THR  23           1HG      THR  23  -6.346  -8.107   0.724
  169   1HG2  THR  23          1HG2      THR  23  -4.689  -7.938  -1.728
  170   2HG2  THR  23          2HG2      THR  23  -4.297  -8.630  -0.154
  171   3HG2  THR  23          3HG2      THR  23  -3.317  -7.318  -0.810
  172    H    LEU  24           H        LEU  24  -4.235  -3.795   0.446
  173    HA   LEU  24           HA       LEU  24  -1.606  -3.961  -0.476
  174   1HB   LEU  24          2HB       LEU  24  -2.616  -1.419   0.716
  175   2HB   LEU  24          1HB       LEU  24  -1.690  -1.670  -0.744
  176    HG   LEU  24           HG       LEU  24  -4.643  -2.055  -0.351
  177   1HD1  LEU  24          1HD1      LEU  24  -3.342  -0.496  -2.534
  178   2HD1  LEU  24          2HD1      LEU  24  -3.464   0.200  -0.919
  179   3HD1  LEU  24          3HD1      LEU  24  -4.924  -0.281  -1.784
  180   1HD2  LEU  24          1HD2      LEU  24  -4.090  -3.928  -1.645
  181   2HD2  LEU  24          2HD2      LEU  24  -2.860  -3.047  -2.553
  182   3HD2  LEU  24          3HD2      LEU  24  -4.569  -2.704  -2.821
  183    H    GLU  25           H        GLU  25  -2.933  -2.998   2.636
  184    HA   GLU  25           HA       GLU  25  -0.550  -2.239   3.882
  185   1HB   GLU  25          2HB       GLU  25  -3.124  -2.191   4.627
  186   2HB   GLU  25          1HB       GLU  25  -2.611  -3.614   5.524
  187   1HG   GLU  25          2HG       GLU  25  -0.623  -1.836   6.096
  188   2HG   GLU  25          1HG       GLU  25  -2.037  -0.789   5.981
  189    H    ALA  26           H        ALA  26  -1.916  -5.369   3.275
  190    HA   ALA  26           HA       ALA  26  -0.206  -6.779   5.025
  191   1HB   ALA  26          1HB       ALA  26  -1.991  -8.117   4.676
  192   2HB   ALA  26          2HB       ALA  26  -1.025  -8.692   3.316
  193   3HB   ALA  26          3HB       ALA  26  -2.276  -7.476   3.058
  194    H    HIS  27           H        HIS  27  -0.179  -5.823   1.689
  195    HA   HIS  27           HA       HIS  27   2.075  -7.393   0.895
  196   1HB   HIS  27          2HB       HIS  27   0.616  -6.689  -0.836
  197   2HB   HIS  27          1HB       HIS  27   0.621  -5.027  -0.281
  198    HD1  HIS  27           1HD      HIS  27   2.978  -7.508  -1.958
  199    HD2  HIS  27           2HD      HIS  27   2.398  -3.421  -1.492
  200    HE1  HIS  27           1HE      HIS  27   4.655  -6.374  -3.476
  201    H    GLN  28           H        GLN  28   1.556  -4.012   1.732
  202    HA   GLN  28           HA       GLN  28   4.265  -3.226   1.536
  203   1HB   GLN  28          2HB       GLN  28   1.760  -2.012   2.143
  204   2HB   GLN  28          1HB       GLN  28   2.890  -1.579   3.415
  205   1HG   GLN  28          2HG       GLN  28   3.779  -1.335   0.594
  206   2HG   GLN  28          1HG       GLN  28   2.645  -0.144   1.227
  207   1HE2  GLN  28          1HE2      GLN  28   5.697  -0.401   0.541
  208   2HE2  GLN  28          2HE2      GLN  28   6.435   0.470   1.838
  209    H    ALA  29           H        ALA  29   2.324  -4.550   4.149
  210    HA   ALA  29           HA       ALA  29   4.378  -4.071   6.128
  211   1HB   ALA  29          1HB       ALA  29   1.768  -5.556   6.335
  212   2HB   ALA  29          2HB       ALA  29   2.055  -3.871   6.771
  213   3HB   ALA  29          3HB       ALA  29   2.836  -5.164   7.683
  214    H    TYR  30           H        TYR  30   4.418  -6.232   3.721
  215    HA   TYR  30           HA       TYR  30   6.010  -8.079   5.293
  216   1HB   TYR  30          2HB       TYR  30   3.307  -8.718   4.458
  217   2HB   TYR  30          1HB       TYR  30   4.474  -9.866   3.812
  218    HD1  TYR  30           1HD      TYR  30   2.594  -8.869   6.682
  219    HD2  TYR  30           2HD      TYR  30   6.082 -10.978   5.462
  220    HE1  TYR  30           1HE      TYR  30   2.652 -10.020   8.854
  221    HE2  TYR  30           2HE      TYR  30   6.149 -12.135   7.630
  222    HH   TYR  30           HH       TYR  30   3.758 -12.468   9.613
  223    H    TYR  31           H        TYR  31   4.774  -7.158   2.117
  224    HA   TYR  31           HA       TYR  31   6.918  -8.648   0.819
  225   1HB   TYR  31          2HB       TYR  31   4.579  -7.103  -0.312
  226   2HB   TYR  31          1HB       TYR  31   5.784  -7.930  -1.292
  227    HD1  TYR  31           1HD      TYR  31   3.521  -8.675   1.591
  228    HD2  TYR  31           2HD      TYR  31   5.239 -10.034  -2.056
  229    HE1  TYR  31           1HE      TYR  31   2.215 -10.752   1.757
  230    HE2  TYR  31           2HE      TYR  31   3.937 -12.115  -1.901
  231    HH   TYR  31           HH       TYR  31   1.337 -12.510   0.132
  232    H    CYS  32           H        CYS  32   5.625  -5.470  -0.101
  233    HA   CYS  32           HA       CYS  32   8.010  -4.477  -1.095
  234   1HB   CYS  32          2HB       CYS  32   5.384  -3.467  -0.593
  235   2HB   CYS  32          1HB       CYS  32   6.555  -2.273  -0.044
  236    H    SER  33           H        SER  33   9.873  -4.258  -0.066
  237    HA   SER  33           HA       SER  33  11.428  -3.469   1.406
  238   1HB   SER  33          2HB       SER  33   9.555  -1.579   1.646
  239   2HB   SER  33          1HB       SER  33   9.424  -2.279   3.260
  240    HG   SER  33           HG       SER  33  11.691  -1.935   3.481
  241    H    HIS  34           H        HIS  34  12.453  -4.631   2.905
  242    HA   HIS  34           HA       HIS  34  10.884  -6.534   4.475
  243   1HB   HIS  34          2HB       HIS  34  13.803  -6.376   3.740
  244   2HB   HIS  34          1HB       HIS  34  13.211  -7.496   4.961
  245    HD1  HIS  34           1HD      HIS  34  13.362  -6.944   1.297
  246    HD2  HIS  34           2HD      HIS  34  11.600  -9.605   3.957
  247    HE1  HIS  34           1HE      HIS  34  12.581  -8.880  -0.107
  248    HE2  HIS  34           2HE      HIS  34  11.601 -10.519   1.536
  249    H    ARG  35           H        ARG  35  10.272  -4.427   5.690
  250    HA   ARG  35           HA       ARG  35  12.224  -3.409   7.531
  251   1HB   ARG  35          2HB       ARG  35   9.424  -2.851   6.833
  252   2HB   ARG  35          1HB       ARG  35   9.803  -2.608   8.533
  253   1HG   ARG  35          2HG       ARG  35  11.595  -1.080   7.934
  254   2HG   ARG  35          1HG       ARG  35  11.265  -1.348   6.222
  255   1HD   ARG  35          2HD       ARG  35   9.320  -0.188   8.213
  256   2HD   ARG  35          1HD       ARG  35  10.272   0.745   7.059
  257    HE   ARG  35           HE       ARG  35   8.659  -1.296   5.840
  258   1HH1  ARG  35          1HH1      ARG  35   8.708   1.995   7.000
  259   2HH1  ARG  35          2HH1      ARG  35   7.403   2.504   5.982
  260   1HH2  ARG  35          1HH2      ARG  35   6.944  -0.627   4.499
  261   2HH2  ARG  35          2HH2      ARG  35   6.401   1.016   4.563
  262    H    ILE  36           H        ILE  36  12.065  -3.546   9.851
  263    HA   ILE  36           HA       ILE  36  11.036  -6.159  10.725
  264    HB   ILE  36           HB       ILE  36  13.458  -5.880  10.973
  265   1HG1  ILE  36          2HG1      ILE  36  12.592  -5.741  13.799
  266   2HG1  ILE  36          1HG1      ILE  36  11.750  -6.921  12.800
  267   1HG2  ILE  36          1HG2      ILE  36  13.900  -4.192  13.058
  268   2HG2  ILE  36          2HG2      ILE  36  12.636  -3.337  12.174
  269   3HG2  ILE  36          3HG2      ILE  36  14.137  -3.780  11.361
  270   1HD1  ILE  36          1HD1      ILE  36  13.440  -8.251  13.430
  271   2HD1  ILE  36          2HD1      ILE  36  14.516  -6.898  13.782
  272   3HD1  ILE  36          3HD1      ILE  36  14.301  -7.445  12.118
  Start of MODEL   13
    1   1H    GLY   1          1HT       GLY   1  -8.436  10.232  -0.189
    2   2H    GLY   1          2HT       GLY   1 -10.046  10.746  -0.118
    3   3H    GLY   1          3HT       GLY   1  -8.894  11.433   0.911
    4   1HA   GLY   1          1HA       GLY   1  -8.287  11.635  -1.913
    5   2HA   GLY   1          2HA       GLY   1  -9.700  12.539  -1.388
    6    H    SER   2           H        SER   2  -7.234  13.620  -2.381
    7    HA   SER   2           HA       SER   2  -5.832  15.359  -1.960
    8   1HB   SER   2          2HB       SER   2  -7.893  15.615   0.145
    9   2HB   SER   2          1HB       SER   2  -6.374  16.452   0.464
   10    HG   SER   2           HG       SER   2  -6.841  17.847  -1.040
   11    H    LEU   3           H        LEU   3  -6.294  14.365   1.415
   12    HA   LEU   3           HA       LEU   3  -3.840  12.896   1.520
   13   1HB   LEU   3          2HB       LEU   3  -2.644  14.381   3.038
   14   2HB   LEU   3          1HB       LEU   3  -2.925  15.152   1.489
   15    HG   LEU   3           HG       LEU   3  -4.952  15.695   3.568
   16   1HD1  LEU   3          1HD1      LEU   3  -2.082  16.257   3.956
   17   2HD1  LEU   3          2HD1      LEU   3  -3.379  16.079   5.139
   18   3HD1  LEU   3          3HD1      LEU   3  -3.188  17.596   4.259
   19   1HD2  LEU   3          1HD2      LEU   3  -3.948  16.845   1.133
   20   2HD2  LEU   3          2HD2      LEU   3  -3.907  18.036   2.434
   21   3HD2  LEU   3          3HD2      LEU   3  -5.420  17.226   2.029
   22    H    LEU   4           H        LEU   4  -3.260  12.487   3.941
   23    HA   LEU   4           HA       LEU   4  -3.867  11.542   5.915
   24   1HB   LEU   4          2HB       LEU   4  -5.227  13.985   5.766
   25   2HB   LEU   4          1HB       LEU   4  -6.429  12.827   6.301
   26    HG   LEU   4           HG       LEU   4  -5.444  13.819   8.239
   27   1HD1  LEU   4          1HD1      LEU   4  -5.655  11.165   7.892
   28   2HD1  LEU   4          2HD1      LEU   4  -5.153  11.913   9.408
   29   3HD1  LEU   4          3HD1      LEU   4  -3.942  11.282   8.291
   30   1HD2  LEU   4          1HD2      LEU   4  -2.933  13.407   6.733
   31   2HD2  LEU   4          2HD2      LEU   4  -2.851  13.203   8.483
   32   3HD2  LEU   4          3HD2      LEU   4  -3.416  14.726   7.798
   33    H    LYS   5           H        LYS   5  -4.791  10.407   3.373
   34    HA   LYS   5           HA       LYS   5  -6.367   8.314   4.363
   35   1HB   LYS   5          2HB       LYS   5  -7.853  10.634   3.503
   36   2HB   LYS   5          1HB       LYS   5  -8.236   9.255   2.482
   37   1HG   LYS   5          2HG       LYS   5  -8.368   8.111   4.924
   38   2HG   LYS   5          1HG       LYS   5  -8.874   9.757   5.304
   39   1HD   LYS   5          2HD       LYS   5 -10.821   9.551   4.185
   40   2HD   LYS   5          1HD       LYS   5 -10.091   8.603   2.888
   41   1HE   LYS   5          2HE       LYS   5 -11.269   6.911   3.785
   42   2HE   LYS   5          1HE       LYS   5  -9.945   6.850   4.947
   43   1HZ   LYS   5          1HZ       LYS   5 -12.477   7.056   5.666
   44   2HZ   LYS   5          2HZ       LYS   5 -12.113   8.702   5.537
   45   3HZ   LYS   5          3HZ       LYS   5 -11.216   7.718   6.580
   46    HA   PRO   6           HA       PRO   6  -4.515   6.439   0.805
   47   1HB   PRO   6          2HB       PRO   6  -6.932   4.703   0.814
   48   2HB   PRO   6          1HB       PRO   6  -5.223   4.254   0.829
   49   1HG   PRO   6          2HG       PRO   6  -6.701   4.052   3.034
   50   2HG   PRO   6          1HG       PRO   6  -5.016   4.598   3.112
   51   1HD   PRO   6          2HD       PRO   6  -7.537   6.187   3.312
   52   2HD   PRO   6          1HD       PRO   6  -5.997   6.397   4.171
   53    H    ALA   7           H        ALA   7  -4.572   7.045  -1.265
   54    HA   ALA   7           HA       ALA   7  -6.985   8.241  -2.344
   55   1HB   ALA   7          1HB       ALA   7  -5.286   9.574  -3.019
   56   2HB   ALA   7          2HB       ALA   7  -5.244   8.442  -4.371
   57   3HB   ALA   7          3HB       ALA   7  -4.111   8.258  -3.031
   58    H    ARG   8           H        ARG   8  -4.641   5.850  -3.584
   59    HA   ARG   8           HA       ARG   8  -6.885   4.329  -4.708
   60   1HB   ARG   8          2HB       ARG   8  -4.349   4.849  -6.258
   61   2HB   ARG   8          1HB       ARG   8  -5.825   4.085  -6.834
   62   1HG   ARG   8          2HG       ARG   8  -6.951   6.087  -7.018
   63   2HG   ARG   8          1HG       ARG   8  -5.905   6.902  -5.853
   64   1HD   ARG   8          2HD       ARG   8  -4.593   5.905  -8.300
   65   2HD   ARG   8          1HD       ARG   8  -5.726   7.236  -8.522
   66    HE   ARG   8           HE       ARG   8  -4.067   7.902  -6.392
   67   1HH1  ARG   8          1HH1      ARG   8  -3.791   7.314  -9.820
   68   2HH1  ARG   8          2HH1      ARG   8  -2.436   8.374 -10.020
   69   1HH2  ARG   8          1HH2      ARG   8  -2.285   9.297  -6.652
   70   2HH2  ARG   8          2HH2      ARG   8  -1.581   9.499  -8.221
   71    H    PHE   9           H        PHE   9  -6.132   2.128  -5.482
   72    HA   PHE   9           HA       PHE   9  -4.249   1.054  -3.502
   73   1HB   PHE   9          2HB       PHE   9  -5.329  -1.171  -4.223
   74   2HB   PHE   9          1HB       PHE   9  -6.298  -0.063  -3.259
   75    HD1  PHE   9           1HD      PHE   9  -8.137   1.184  -4.271
   76    HD2  PHE   9           2HD      PHE   9  -5.887  -1.660  -6.499
   77    HE1  PHE   9           1HE      PHE   9  -9.897   1.145  -5.991
   78    HE2  PHE   9           2HE      PHE   9  -7.641  -1.703  -8.223
   79    HZ   PHE   9           HZ       PHE   9  -9.649  -0.299  -7.970
   80    H    MET  10           H        MET  10  -2.346   1.565  -4.641
   81    HA   MET  10           HA       MET  10  -1.511  -0.449  -6.484
   82   1HB   MET  10          2HB       MET  10  -2.779   1.628  -7.711
   83   2HB   MET  10          1HB       MET  10  -1.115   2.196  -7.727
   84   1HG   MET  10          2HG       MET  10  -0.898  -0.420  -8.555
   85   2HG   MET  10          1HG       MET  10  -2.398   0.123  -9.303
   86   1HE   MET  10          1HE       MET  10   0.190  -0.938 -10.558
   87   2HE   MET  10          2HE       MET  10   0.895   0.188 -11.717
   88   3HE   MET  10          3HE       MET  10  -0.788  -0.309 -11.883
   89    H    CYS  11           H        CYS  11   0.529  -0.866  -5.945
   90    HA   CYS  11           HA       CYS  11   2.041   1.088  -4.431
   91   1HB   CYS  11          2HB       CYS  11   1.913  -1.493  -4.026
   92   2HB   CYS  11          1HB       CYS  11   3.153  -1.566  -5.271
   93    H    LEU  12           H        LEU  12   2.470   2.671  -5.946
   94    HA   LEU  12           HA       LEU  12   3.428   2.430  -8.506
   95   1HB   LEU  12          2HB       LEU  12   4.555   4.562  -6.744
   96   2HB   LEU  12          1HB       LEU  12   4.031   4.663  -8.413
   97    HG   LEU  12           HG       LEU  12   1.673   4.104  -7.175
   98   1HD1  LEU  12          1HD1      LEU  12   2.702   6.168  -5.341
   99   2HD1  LEU  12          2HD1      LEU  12   3.230   4.515  -5.023
  100   3HD1  LEU  12          3HD1      LEU  12   1.509   4.896  -5.073
  101   1HD2  LEU  12          1HD2      LEU  12   2.639   6.066  -8.725
  102   2HD2  LEU  12          2HD2      LEU  12   2.434   6.956  -7.217
  103   3HD2  LEU  12          3HD2      LEU  12   1.056   6.136  -7.951
  104    HA   PRO  13           HA       PRO  13   7.988   2.446  -6.814
  105   1HB   PRO  13          2HB       PRO  13   8.295   1.400  -4.300
  106   2HB   PRO  13          1HB       PRO  13   8.184   3.129  -4.649
  107   1HG   PRO  13          2HG       PRO  13   6.074   1.250  -3.674
  108   2HG   PRO  13          1HG       PRO  13   6.402   2.922  -3.184
  109   1HD   PRO  13          2HD       PRO  13   4.399   2.277  -4.866
  110   2HD   PRO  13          1HD       PRO  13   5.287   3.806  -5.002
  111    H    CYS  14           H        CYS  14   5.594   0.057  -6.621
  112    HA   CYS  14           HA       CYS  14   7.603  -2.068  -6.926
  113   1HB   CYS  14          2HB       CYS  14   4.922  -2.025  -5.603
  114   2HB   CYS  14          1HB       CYS  14   5.512  -3.525  -6.299
  115    H    GLY  15           H        GLY  15   4.757  -0.520  -8.201
  116   1HA   GLY  15          2HA       GLY  15   3.917  -0.553 -10.338
  117   2HA   GLY  15          1HA       GLY  15   5.200  -1.668 -10.765
  118    H    ILE  16           H        ILE  16   3.000  -2.269  -8.129
  119    HA   ILE  16           HA       ILE  16   1.614  -4.296  -9.754
  120    HB   ILE  16           HB       ILE  16   2.368  -4.703  -6.864
  121   1HG1  ILE  16          2HG1      ILE  16   3.707  -6.044  -9.206
  122   2HG1  ILE  16          1HG1      ILE  16   4.333  -4.551  -8.514
  123   1HG2  ILE  16          1HG2      ILE  16   1.384  -6.741  -6.998
  124   2HG2  ILE  16          2HG2      ILE  16   1.770  -6.938  -8.708
  125   3HG2  ILE  16          3HG2      ILE  16   0.418  -5.913  -8.221
  126   1HD1  ILE  16          1HD1      ILE  16   4.985  -7.091  -7.729
  127   2HD1  ILE  16          2HD1      ILE  16   3.808  -6.591  -6.513
  128   3HD1  ILE  16          3HD1      ILE  16   5.252  -5.618  -6.796
  129    H    ALA  17           H        ALA  17  -0.443  -3.668  -9.897
  130    HA   ALA  17           HA       ALA  17  -1.673  -2.086  -7.802
  131   1HB   ALA  17          1HB       ALA  17  -2.013  -1.685 -10.275
  132   2HB   ALA  17          2HB       ALA  17  -3.479  -1.756  -9.298
  133   3HB   ALA  17          3HB       ALA  17  -3.010  -3.139 -10.285
  134    H    PHE  18           H        PHE  18  -2.782  -2.917  -6.155
  135    HA   PHE  18           HA       PHE  18  -3.396  -5.743  -6.136
  136   1HB   PHE  18          2HB       PHE  18  -3.141  -3.573  -4.138
  137   2HB   PHE  18          1HB       PHE  18  -4.205  -4.907  -3.737
  138    HD1  PHE  18           1HD      PHE  18  -3.266  -6.624  -2.527
  139    HD2  PHE  18           2HD      PHE  18  -0.821  -4.407  -5.213
  140    HE1  PHE  18           1HE      PHE  18  -1.314  -7.962  -1.851
  141    HE2  PHE  18           2HE      PHE  18   1.134  -5.740  -4.544
  142    HZ   PHE  18           HZ       PHE  18   0.889  -7.521  -2.862
  143    H    SER  19           H        SER  19  -5.533  -6.074  -4.627
  144    HA   SER  19           HA       SER  19  -7.690  -5.280  -6.380
  145   1HB   SER  19          2HB       SER  19  -7.174  -7.582  -5.040
  146   2HB   SER  19          1HB       SER  19  -8.336  -6.826  -3.950
  147    HG   SER  19           HG       SER  19  -9.606  -6.500  -5.982
  148    H    SER  20           H        SER  20  -6.538  -4.406  -3.196
  149    HA   SER  20           HA       SER  20  -8.349  -2.205  -3.096
  150   1HB   SER  20          2HB       SER  20  -9.177  -4.675  -1.893
  151   2HB   SER  20          1HB       SER  20  -8.939  -3.465  -0.632
  152    HG   SER  20           HG       SER  20 -10.657  -3.369  -2.872
  153    HA   PRO  21           HA       PRO  21  -5.466  -0.383  -0.310
  154   1HB   PRO  21          2HB       PRO  21  -6.918   0.454   1.857
  155   2HB   PRO  21          1HB       PRO  21  -6.897   1.287   0.298
  156   1HG   PRO  21          2HG       PRO  21  -8.913  -0.630   1.398
  157   2HG   PRO  21          1HG       PRO  21  -9.173   0.876   0.499
  158   1HD   PRO  21          2HD       PRO  21  -9.375  -1.527  -0.679
  159   2HD   PRO  21          1HD       PRO  21  -8.729  -0.119  -1.543
  160    H    SER  22           H        SER  22  -7.747  -2.309   1.659
  161    HA   SER  22           HA       SER  22  -6.094  -2.817   3.823
  162   1HB   SER  22          2HB       SER  22  -8.213  -4.590   2.585
  163   2HB   SER  22          1HB       SER  22  -7.476  -4.881   4.160
  164    HG   SER  22           HG       SER  22  -9.561  -3.430   3.712
  165    H    THR  23           H        THR  23  -6.268  -4.496   0.716
  166    HA   THR  23           HA       THR  23  -4.562  -6.630   1.380
  167    HB   THR  23           HB       THR  23  -4.400  -7.066  -0.952
  168    HG1  THR  23           1HG      THR  23  -5.326  -4.449  -1.488
  169   1HG2  THR  23          1HG2      THR  23  -6.876  -6.002  -1.621
  170   2HG2  THR  23          2HG2      THR  23  -6.952  -6.287   0.118
  171   3HG2  THR  23          3HG2      THR  23  -6.542  -7.609  -0.975
  172    H    LEU  24           H        LEU  24  -3.937  -3.361   0.263
  173    HA   LEU  24           HA       LEU  24  -1.207  -3.611  -0.302
  174   1HB   LEU  24          2HB       LEU  24  -2.291  -1.132   0.969
  175   2HB   LEU  24          1HB       LEU  24  -1.129  -1.295  -0.325
  176    HG   LEU  24           HG       LEU  24  -4.102  -1.691  -0.545
  177   1HD1  LEU  24          1HD1      LEU  24  -2.477   0.325  -2.034
  178   2HD1  LEU  24          2HD1      LEU  24  -3.020   0.660  -0.389
  179   3HD1  LEU  24          3HD1      LEU  24  -4.200   0.332  -1.656
  180   1HD2  LEU  24          1HD2      LEU  24  -3.450  -3.143  -2.154
  181   2HD2  LEU  24          2HD2      LEU  24  -1.857  -2.406  -2.327
  182   3HD2  LEU  24          3HD2      LEU  24  -3.263  -1.652  -3.078
  183    H    GLU  25           H        GLU  25  -2.954  -2.842   2.650
  184    HA   GLU  25           HA       GLU  25  -0.840  -2.294   4.346
  185   1HB   GLU  25          2HB       GLU  25  -3.495  -2.400   4.673
  186   2HB   GLU  25          1HB       GLU  25  -3.078  -3.924   5.437
  187   1HG   GLU  25          2HG       GLU  25  -1.304  -2.365   6.662
  188   2HG   GLU  25          1HG       GLU  25  -2.524  -1.147   6.292
  189    H    ALA  26           H        ALA  26  -2.031  -5.362   3.209
  190    HA   ALA  26           HA       ALA  26  -0.455  -6.931   4.955
  191   1HB   ALA  26          1HB       ALA  26  -2.628  -7.586   3.694
  192   2HB   ALA  26          2HB       ALA  26  -1.364  -8.794   3.924
  193   3HB   ALA  26          3HB       ALA  26  -1.527  -7.973   2.372
  194    H    HIS  27           H        HIS  27  -0.133  -5.569   1.781
  195    HA   HIS  27           HA       HIS  27   2.235  -7.002   1.047
  196   1HB   HIS  27          2HB       HIS  27   0.872  -6.146  -0.723
  197   2HB   HIS  27          1HB       HIS  27   0.854  -4.536  -0.024
  198    HD1  HIS  27           1HD      HIS  27   3.110  -6.868  -1.963
  199    HD2  HIS  27           2HD      HIS  27   2.921  -2.903  -0.741
  200    HE1  HIS  27           1HE      HIS  27   4.945  -5.652  -3.210
  201    H    GLN  28           H        GLN  28   1.557  -3.681   2.057
  202    HA   GLN  28           HA       GLN  28   4.222  -2.832   2.295
  203   1HB   GLN  28          2HB       GLN  28   1.617  -1.784   2.808
  204   2HB   GLN  28          1HB       GLN  28   2.606  -1.494   4.232
  205   1HG   GLN  28          2HG       GLN  28   3.669  -0.823   1.530
  206   2HG   GLN  28          1HG       GLN  28   2.513   0.251   2.312
  207   1HE2  GLN  28          1HE2      GLN  28   5.525   0.263   1.665
  208   2HE2  GLN  28          2HE2      GLN  28   6.239   0.836   3.130
  209    H    ALA  29           H        ALA  29   2.287  -4.898   4.240
  210    HA   ALA  29           HA       ALA  29   3.471  -4.494   6.757
  211   1HB   ALA  29          1HB       ALA  29   1.696  -6.457   5.519
  212   2HB   ALA  29          2HB       ALA  29   1.653  -5.741   7.130
  213   3HB   ALA  29          3HB       ALA  29   2.710  -7.115   6.805
  214    H    TYR  30           H        TYR  30   4.063  -7.186   4.455
  215    HA   TYR  30           HA       TYR  30   6.863  -7.167   5.300
  216   1HB   TYR  30          2HB       TYR  30   4.918  -9.407   5.649
  217   2HB   TYR  30          1HB       TYR  30   6.607  -9.774   5.329
  218    HD1  TYR  30           1HD      TYR  30   4.226  -8.425   7.741
  219    HD2  TYR  30           2HD      TYR  30   8.333  -9.223   6.973
  220    HE1  TYR  30           1HE      TYR  30   4.725  -8.111  10.127
  221    HE2  TYR  30           2HE      TYR  30   8.845  -8.913   9.357
  222    HH   TYR  30           HH       TYR  30   6.516  -8.869  11.748
  223    H    TYR  31           H        TYR  31   4.905  -6.944   2.749
  224    HA   TYR  31           HA       TYR  31   6.442  -8.761   1.041
  225   1HB   TYR  31          2HB       TYR  31   3.738  -8.005   1.076
  226   2HB   TYR  31          1HB       TYR  31   4.417  -7.275  -0.374
  227    HD1  TYR  31           1HD      TYR  31   4.064 -10.503   1.429
  228    HD2  TYR  31           2HD      TYR  31   4.808  -8.577  -2.291
  229    HE1  TYR  31           1HE      TYR  31   3.905 -12.672   0.282
  230    HE2  TYR  31           2HE      TYR  31   4.650 -10.740  -3.449
  231    HH   TYR  31           HH       TYR  31   3.290 -13.398  -2.206
  232    H    CYS  32           H        CYS  32   5.654  -5.341   1.450
  233    HA   CYS  32           HA       CYS  32   7.175  -4.494  -0.826
  234   1HB   CYS  32          2HB       CYS  32   5.217  -3.294   0.481
  235   2HB   CYS  32          1HB       CYS  32   6.546  -2.639   1.432
  236    H    SER  33           H        SER  33   9.088  -5.827  -0.130
  237    HA   SER  33           HA       SER  33  11.306  -5.792   0.408
  238   1HB   SER  33          2HB       SER  33  10.851  -3.169   0.106
  239   2HB   SER  33          1HB       SER  33  11.181  -3.184   1.838
  240    HG   SER  33           HG       SER  33  13.035  -2.917   0.353
  241    H    HIS  34           H        HIS  34  12.724  -5.951   2.321
  242    HA   HIS  34           HA       HIS  34  11.297  -7.128   4.507
  243   1HB   HIS  34          2HB       HIS  34  14.246  -6.600   4.100
  244   2HB   HIS  34          1HB       HIS  34  13.577  -7.503   5.455
  245    HD1  HIS  34           1HD      HIS  34  13.733  -7.695   1.668
  246    HD2  HIS  34           2HD      HIS  34  13.253 -10.162   4.977
  247    HE1  HIS  34           1HE      HIS  34  13.746 -10.041   0.764
  248    HE2  HIS  34           2HE      HIS  34  13.540 -11.520   2.795
  249    H    ARG  35           H        ARG  35  10.102  -5.170   5.111
  250    HA   ARG  35           HA       ARG  35  11.562  -3.006   6.336
  251   1HB   ARG  35          2HB       ARG  35   8.805  -3.550   5.554
  252   2HB   ARG  35          1HB       ARG  35   8.913  -2.745   7.114
  253   1HG   ARG  35          2HG       ARG  35  10.445  -1.071   5.965
  254   2HG   ARG  35          1HG       ARG  35   9.893  -1.783   4.447
  255   1HD   ARG  35          2HD       ARG  35   8.556   0.160   4.960
  256   2HD   ARG  35          1HD       ARG  35   7.566  -1.292   5.099
  257    HE   ARG  35           HE       ARG  35   8.448  -0.876   7.630
  258   1HH1  ARG  35          1HH1      ARG  35   6.804   1.126   5.291
  259   2HH1  ARG  35          2HH1      ARG  35   5.976   2.062   6.489
  260   1HH2  ARG  35          1HH2      ARG  35   7.360   0.355   9.207
  261   2HH2  ARG  35          2HH2      ARG  35   6.293   1.626   8.713
  262    H    ILE  36           H        ILE  36  11.050  -2.316   8.586
  263    HA   ILE  36           HA       ILE  36  10.336  -4.466  10.416
  264    HB   ILE  36           HB       ILE  36  12.761  -4.728  10.126
  265   1HG1  ILE  36          2HG1      ILE  36  12.145  -3.534  12.834
  266   2HG1  ILE  36          1HG1      ILE  36  11.616  -5.137  12.333
  267   1HG2  ILE  36          1HG2      ILE  36  14.263  -2.936  10.998
  268   2HG2  ILE  36          2HG2      ILE  36  12.865  -1.863  11.045
  269   3HG2  ILE  36          3HG2      ILE  36  13.421  -2.519   9.506
  270   1HD1  ILE  36          1HD1      ILE  36  13.529  -5.936  13.092
  271   2HD1  ILE  36          2HD1      ILE  36  14.132  -4.308  13.409
  272   3HD1  ILE  36          3HD1      ILE  36  14.365  -5.043  11.822
  Start of MODEL   14
    1   1H    GLY   1          1HT       GLY   1 -10.049  12.612   1.959
    2   2H    GLY   1          2HT       GLY   1  -9.431  14.186   1.930
    3   3H    GLY   1          3HT       GLY   1  -8.446  12.901   2.417
    4   1HA   GLY   1          1HA       GLY   1  -8.450  11.961   0.228
    5   2HA   GLY   1          2HA       GLY   1  -9.603  13.176  -0.301
    6    H    SER   2           H        SER   2  -6.690  13.528   1.697
    7    HA   SER   2           HA       SER   2  -5.146  14.684  -0.410
    8   1HB   SER   2          2HB       SER   2  -6.640  16.578   0.000
    9   2HB   SER   2          1HB       SER   2  -6.243  16.539   1.718
   10    HG   SER   2           HG       SER   2  -4.946  17.769  -0.261
   11    H    LEU   3           H        LEU   3  -5.465  15.127   3.119
   12    HA   LEU   3           HA       LEU   3  -2.836  13.864   3.444
   13   1HB   LEU   3          2HB       LEU   3  -2.384  15.620   5.241
   14   2HB   LEU   3          1HB       LEU   3  -2.219  16.114   3.567
   15    HG   LEU   3           HG       LEU   3  -4.870  16.584   4.791
   16   1HD1  LEU   3          1HD1      LEU   3  -2.357  17.803   5.815
   17   2HD1  LEU   3          2HD1      LEU   3  -3.838  17.377   6.672
   18   3HD1  LEU   3          3HD1      LEU   3  -3.790  18.818   5.656
   19   1HD2  LEU   3          1HD2      LEU   3  -3.089  17.765   2.750
   20   2HD2  LEU   3          2HD2      LEU   3  -4.142  18.878   3.623
   21   3HD2  LEU   3          3HD2      LEU   3  -4.836  17.522   2.732
   22    H    LEU   4           H        LEU   4  -2.510  12.806   5.411
   23    HA   LEU   4           HA       LEU   4  -3.096  11.573   7.229
   24   1HB   LEU   4          2HB       LEU   4  -4.223  14.179   7.624
   25   2HB   LEU   4          1HB       LEU   4  -5.311  12.978   8.292
   26    HG   LEU   4           HG       LEU   4  -3.748  13.826   9.976
   27   1HD1  LEU   4          1HD1      LEU   4  -3.833  10.985   9.168
   28   2HD1  LEU   4          2HD1      LEU   4  -4.339  11.755  10.671
   29   3HD1  LEU   4          3HD1      LEU   4  -2.630  11.432  10.377
   30   1HD2  LEU   4          1HD2      LEU   4  -1.776  13.096   7.897
   31   2HD2  LEU   4          2HD2      LEU   4  -1.326  12.770   9.571
   32   3HD2  LEU   4          3HD2      LEU   4  -1.753  14.408   9.075
   33    H    LYS   5           H        LYS   5  -4.395  11.100   4.660
   34    HA   LYS   5           HA       LYS   5  -6.333   9.209   5.510
   35   1HB   LYS   5          2HB       LYS   5  -7.329  11.806   5.078
   36   2HB   LYS   5          1HB       LYS   5  -7.808  10.868   3.670
   37   1HG   LYS   5          2HG       LYS   5  -8.319  10.026   6.513
   38   2HG   LYS   5          1HG       LYS   5  -9.480  10.890   5.503
   39   1HD   LYS   5          2HD       LYS   5  -9.912   9.070   4.206
   40   2HD   LYS   5          1HD       LYS   5  -8.276   8.429   4.372
   41   1HE   LYS   5          2HE       LYS   5  -9.364   6.908   5.660
   42   2HE   LYS   5          1HE       LYS   5  -9.076   8.136   6.893
   43   1HZ   LYS   5          1HZ       LYS   5 -11.566   7.322   5.628
   44   2HZ   LYS   5          2HZ       LYS   5 -11.391   8.979   5.918
   45   3HZ   LYS   5          3HZ       LYS   5 -11.280   7.882   7.200
   46    HA   PRO   6           HA       PRO   6  -4.334   8.001   1.601
   47   1HB   PRO   6          2HB       PRO   6  -4.779   5.336   1.918
   48   2HB   PRO   6          1HB       PRO   6  -3.430   6.187   2.677
   49   1HG   PRO   6          2HG       PRO   6  -6.068   5.396   3.848
   50   2HG   PRO   6          1HG       PRO   6  -4.449   5.283   4.561
   51   1HD   PRO   6          2HD       PRO   6  -6.169   7.267   5.191
   52   2HD   PRO   6          1HD       PRO   6  -4.412   7.517   5.143
   53    H    ALA   7           H        ALA   7  -5.149   7.381  -0.383
   54    HA   ALA   7           HA       ALA   7  -7.843   6.331  -0.596
   55   1HB   ALA   7          1HB       ALA   7  -8.202   8.342  -2.329
   56   2HB   ALA   7          2HB       ALA   7  -7.178   9.156  -1.146
   57   3HB   ALA   7          3HB       ALA   7  -8.699   8.424  -0.639
   58    H    ARG   8           H        ARG   8  -5.157   5.463  -1.323
   59    HA   ARG   8           HA       ARG   8  -5.586   5.145  -4.217
   60   1HB   ARG   8          2HB       ARG   8  -3.624   6.692  -3.436
   61   2HB   ARG   8          1HB       ARG   8  -2.817   5.174  -3.070
   62   1HG   ARG   8          2HG       ARG   8  -2.287   4.873  -5.199
   63   2HG   ARG   8          1HG       ARG   8  -3.969   5.069  -5.697
   64   1HD   ARG   8          2HD       ARG   8  -2.798   6.763  -6.824
   65   2HD   ARG   8          1HD       ARG   8  -3.578   7.573  -5.466
   66    HE   ARG   8           HE       ARG   8  -1.139   6.958  -4.485
   67   1HH1  ARG   8          1HH1      ARG   8  -2.189   8.579  -7.392
   68   2HH1  ARG   8          2HH1      ARG   8  -0.781   9.581  -7.491
   69   1HH2  ARG   8          1HH2      ARG   8   0.714   8.274  -4.614
   70   2HH2  ARG   8          2HH2      ARG   8   0.868   9.408  -5.915
   71    H    PHE   9           H        PHE   9  -4.400   3.208  -5.096
   72    HA   PHE   9           HA       PHE   9  -3.808   1.109  -3.193
   73   1HB   PHE   9          2HB       PHE   9  -5.497  -0.402  -4.536
   74   2HB   PHE   9          1HB       PHE   9  -6.049   0.568  -3.175
   75    HD1  PHE   9           1HD      PHE   9  -8.245   1.104  -3.647
   76    HD2  PHE   9           2HD      PHE   9  -5.295   1.580  -6.676
   77    HE1  PHE   9           1HE      PHE   9  -9.911   2.191  -5.093
   78    HE2  PHE   9           2HE      PHE   9  -6.954   2.669  -8.128
   79    HZ   PHE   9           HZ       PHE   9  -9.267   2.975  -7.338
   80    H    MET  10           H        MET  10  -1.889   1.965  -4.632
   81    HA   MET  10           HA       MET  10  -1.300  -0.159  -6.469
   82   1HB   MET  10          2HB       MET  10  -1.688   2.657  -7.470
   83   2HB   MET  10          1HB       MET  10  -0.683   1.494  -8.323
   84   1HG   MET  10          2HG       MET  10  -2.712  -0.024  -8.344
   85   2HG   MET  10          1HG       MET  10  -3.637   1.383  -7.825
   86   1HE   MET  10          1HE       MET  10  -5.161   1.255  -9.461
   87   2HE   MET  10          2HE       MET  10  -4.982   1.503 -11.198
   88   3HE   MET  10          3HE       MET  10  -4.894   2.878 -10.099
   89    H    CYS  11           H        CYS  11   0.706  -0.709  -5.941
   90    HA   CYS  11           HA       CYS  11   2.476   1.229  -4.705
   91   1HB   CYS  11          2HB       CYS  11   2.122  -1.298  -4.065
   92   2HB   CYS  11          1HB       CYS  11   3.313  -1.577  -5.331
   93    H    LEU  12           H        LEU  12   2.895   2.600  -6.484
   94    HA   LEU  12           HA       LEU  12   3.758   1.878  -9.006
   95   1HB   LEU  12          2HB       LEU  12   5.006   4.237  -7.661
   96   2HB   LEU  12          1HB       LEU  12   4.446   4.069  -9.313
   97    HG   LEU  12           HG       LEU  12   2.104   3.825  -7.925
   98   1HD1  LEU  12          1HD1      LEU  12   2.465   6.073  -6.484
   99   2HD1  LEU  12          2HD1      LEU  12   4.031   5.296  -6.254
  100   3HD1  LEU  12          3HD1      LEU  12   2.551   4.446  -5.807
  101   1HD2  LEU  12          1HD2      LEU  12   3.061   5.396  -9.872
  102   2HD2  LEU  12          2HD2      LEU  12   2.950   6.581  -8.570
  103   3HD2  LEU  12          3HD2      LEU  12   1.517   5.684  -9.071
  104    HA   PRO  13           HA       PRO  13   8.342   2.017  -7.201
  105   1HB   PRO  13          2HB       PRO  13   7.741   0.915  -4.513
  106   2HB   PRO  13          1HB       PRO  13   8.899   2.163  -4.986
  107   1HG   PRO  13          2HG       PRO  13   6.639   2.802  -3.723
  108   2HG   PRO  13          1HG       PRO  13   7.290   3.831  -5.013
  109   1HD   PRO  13          2HD       PRO  13   5.022   1.883  -5.104
  110   2HD   PRO  13          1HD       PRO  13   5.168   3.480  -5.866
  111    H    CYS  14           H        CYS  14   5.816  -0.287  -6.864
  112    HA   CYS  14           HA       CYS  14   7.725  -2.495  -7.172
  113   1HB   CYS  14          2HB       CYS  14   5.038  -2.324  -5.843
  114   2HB   CYS  14          1HB       CYS  14   5.652  -3.864  -6.420
  115    H    GLY  15           H        GLY  15   4.894  -0.878  -8.398
  116   1HA   GLY  15          2HA       GLY  15   4.260  -0.866 -10.646
  117   2HA   GLY  15          1HA       GLY  15   5.171  -2.343 -10.863
  118    H    ILE  16           H        ILE  16   3.753  -3.354  -8.324
  119    HA   ILE  16           HA       ILE  16   1.600  -4.644  -9.730
  120    HB   ILE  16           HB       ILE  16   2.235  -4.818  -6.784
  121   1HG1  ILE  16          2HG1      ILE  16   3.120  -7.031  -8.482
  122   2HG1  ILE  16          1HG1      ILE  16   3.942  -5.517  -8.848
  123   1HG2  ILE  16          1HG2      ILE  16   0.041  -5.720  -8.048
  124   2HG2  ILE  16          2HG2      ILE  16   0.757  -6.518  -6.648
  125   3HG2  ILE  16          3HG2      ILE  16   1.113  -7.101  -8.274
  126   1HD1  ILE  16          1HD1      ILE  16   5.322  -6.386  -7.256
  127   2HD1  ILE  16          2HD1      ILE  16   4.004  -7.162  -6.377
  128   3HD1  ILE  16          3HD1      ILE  16   4.244  -5.419  -6.249
  129    H    ALA  17           H        ALA  17  -0.468  -4.045  -9.785
  130    HA   ALA  17           HA       ALA  17  -1.348  -1.924  -7.941
  131   1HB   ALA  17          1HB       ALA  17  -1.873  -2.467 -10.797
  132   2HB   ALA  17          2HB       ALA  17  -1.727  -0.933  -9.938
  133   3HB   ALA  17          3HB       ALA  17  -3.228  -1.855  -9.849
  134    H    PHE  18           H        PHE  18  -2.621  -2.593  -6.347
  135    HA   PHE  18           HA       PHE  18  -4.008  -5.111  -6.494
  136   1HB   PHE  18          2HB       PHE  18  -3.547  -3.030  -4.378
  137   2HB   PHE  18          1HB       PHE  18  -4.675  -4.341  -4.128
  138    HD1  PHE  18           1HD      PHE  18  -3.628  -6.736  -4.830
  139    HD2  PHE  18           2HD      PHE  18  -1.449  -3.323  -3.524
  140    HE1  PHE  18           1HE      PHE  18  -1.772  -8.193  -4.130
  141    HE2  PHE  18           2HE      PHE  18   0.411  -4.773  -2.822
  142    HZ   PHE  18           HZ       PHE  18   0.252  -7.211  -3.124
  143    H    SER  19           H        SER  19  -6.269  -4.694  -5.019
  144    HA   SER  19           HA       SER  19  -7.816  -2.534  -6.156
  145   1HB   SER  19          2HB       SER  19  -7.783  -4.466  -7.854
  146   2HB   SER  19          1HB       SER  19  -8.788  -5.335  -6.695
  147    HG   SER  19           HG       SER  19  -9.749  -3.870  -8.467
  148    H    SER  20           H        SER  20  -7.060  -3.314  -3.500
  149    HA   SER  20           HA       SER  20  -9.618  -3.170  -2.259
  150   1HB   SER  20          2HB       SER  20  -9.691  -5.546  -2.567
  151   2HB   SER  20          1HB       SER  20  -8.033  -5.728  -1.994
  152    HG   SER  20           HG       SER  20 -10.374  -5.471  -0.573
  153    HA   PRO  21           HA       PRO  21  -6.892  -1.230   0.670
  154   1HB   PRO  21          2HB       PRO  21  -8.690  -0.473   2.501
  155   2HB   PRO  21          1HB       PRO  21  -8.663   0.249   0.887
  156   1HG   PRO  21          2HG       PRO  21 -10.463  -1.874   1.983
  157   2HG   PRO  21          1HG       PRO  21 -10.863  -0.493   0.947
  158   1HD   PRO  21          2HD       PRO  21 -10.482  -3.068   0.037
  159   2HD   PRO  21          1HD       PRO  21 -10.290  -1.613  -0.960
  160    H    SER  22           H        SER  22  -6.659  -3.962   0.847
  161    HA   SER  22           HA       SER  22  -6.373  -4.324   3.728
  162   1HB   SER  22          2HB       SER  22  -8.568  -5.393   2.902
  163   2HB   SER  22          1HB       SER  22  -7.542  -6.554   2.061
  164    HG   SER  22           HG       SER  22  -8.186  -7.240   4.178
  165    H    THR  23           H        THR  23  -5.876  -5.767   0.515
  166    HA   THR  23           HA       THR  23  -3.646  -7.331   1.245
  167    HB   THR  23           HB       THR  23  -4.245  -6.155  -1.479
  168    HG1  THR  23           1HG      THR  23  -5.221  -8.489  -0.212
  169   1HG2  THR  23          1HG2      THR  23  -3.202  -8.260  -2.294
  170   2HG2  THR  23          2HG2      THR  23  -2.670  -8.572  -0.642
  171   3HG2  THR  23          3HG2      THR  23  -2.085  -7.149  -1.501
  172    H    LEU  24           H        LEU  24  -4.058  -3.990   0.388
  173    HA   LEU  24           HA       LEU  24  -1.390  -3.332  -0.188
  174   1HB   LEU  24          2HB       LEU  24  -3.197  -1.407   1.214
  175   2HB   LEU  24          1HB       LEU  24  -2.066  -1.116  -0.088
  176    HG   LEU  24           HG       LEU  24  -4.805  -2.336  -0.281
  177   1HD1  LEU  24          1HD1      LEU  24  -4.646  -0.355  -2.122
  178   2HD1  LEU  24          2HD1      LEU  24  -3.613   0.283  -0.845
  179   3HD1  LEU  24          3HD1      LEU  24  -5.283  -0.157  -0.490
  180   1HD2  LEU  24          1HD2      LEU  24  -2.846  -1.992  -2.541
  181   2HD2  LEU  24          2HD2      LEU  24  -4.433  -2.758  -2.592
  182   3HD2  LEU  24          3HD2      LEU  24  -3.113  -3.524  -1.708
  183    H    GLU  25           H        GLU  25  -3.274  -3.337   2.777
  184    HA   GLU  25           HA       GLU  25  -1.219  -2.386   4.468
  185   1HB   GLU  25          2HB       GLU  25  -3.852  -2.770   4.808
  186   2HB   GLU  25          1HB       GLU  25  -3.273  -4.249   5.559
  187   1HG   GLU  25          2HG       GLU  25  -1.894  -2.935   7.085
  188   2HG   GLU  25          1HG       GLU  25  -2.453  -1.450   6.315
  189    H    ALA  26           H        ALA  26  -2.030  -5.493   3.181
  190    HA   ALA  26           HA       ALA  26  -0.375  -6.989   4.919
  191   1HB   ALA  26          1HB       ALA  26  -2.276  -8.062   3.872
  192   2HB   ALA  26          2HB       ALA  26  -0.786  -8.851   3.354
  193   3HB   ALA  26          3HB       ALA  26  -1.610  -7.726   2.275
  194    H    HIS  27           H        HIS  27  -0.100  -5.462   1.808
  195    HA   HIS  27           HA       HIS  27   2.453  -6.566   1.138
  196   1HB   HIS  27          2HB       HIS  27   0.885  -5.763  -0.586
  197   2HB   HIS  27          1HB       HIS  27   1.005  -4.133   0.061
  198    HD1  HIS  27           1HD      HIS  27   3.085  -6.703  -1.791
  199    HD2  HIS  27           2HD      HIS  27   3.099  -2.657  -0.845
  200    HE1  HIS  27           1HE      HIS  27   4.953  -5.664  -3.143
  201    H    GLN  28           H        GLN  28   1.293  -3.465   2.359
  202    HA   GLN  28           HA       GLN  28   3.883  -2.324   2.682
  203   1HB   GLN  28          2HB       GLN  28   1.145  -1.525   3.054
  204   2HB   GLN  28          1HB       GLN  28   2.073  -1.097   4.484
  205   1HG   GLN  28          2HG       GLN  28   3.200  -0.427   1.820
  206   2HG   GLN  28          1HG       GLN  28   1.852   0.532   2.430
  207   1HE2  GLN  28          1HE2      GLN  28   4.749  -0.919   3.888
  208   2HE2  GLN  28          2HE2      GLN  28   5.305   0.534   4.639
  209    H    ALA  29           H        ALA  29   2.149  -4.682   4.380
  210    HA   ALA  29           HA       ALA  29   3.100  -4.146   7.011
  211   1HB   ALA  29          1HB       ALA  29   1.579  -6.305   5.684
  212   2HB   ALA  29          2HB       ALA  29   1.235  -5.419   7.170
  213   3HB   ALA  29          3HB       ALA  29   2.426  -6.720   7.174
  214    H    TYR  30           H        TYR  30   3.931  -6.791   4.721
  215    HA   TYR  30           HA       TYR  30   6.694  -6.626   5.592
  216   1HB   TYR  30          2HB       TYR  30   4.860  -8.908   6.210
  217   2HB   TYR  30          1HB       TYR  30   6.570  -9.200   5.950
  218    HD1  TYR  30           1HD      TYR  30   4.067  -7.780   8.178
  219    HD2  TYR  30           2HD      TYR  30   8.238  -8.317   7.531
  220    HE1  TYR  30           1HE      TYR  30   4.502  -7.167  10.518
  221    HE2  TYR  30           2HE      TYR  30   8.684  -7.707   9.871
  222    HH   TYR  30           HH       TYR  30   6.444  -7.692  12.230
  223    H    TYR  31           H        TYR  31   4.969  -6.474   3.040
  224    HA   TYR  31           HA       TYR  31   6.365  -8.574   1.523
  225   1HB   TYR  31          2HB       TYR  31   3.699  -7.877   1.496
  226   2HB   TYR  31          1HB       TYR  31   4.328  -7.065   0.065
  227    HD1  TYR  31           1HD      TYR  31   4.394 -10.390   1.759
  228    HD2  TYR  31           2HD      TYR  31   4.468  -8.258  -1.921
  229    HE1  TYR  31           1HE      TYR  31   4.299 -12.518   0.532
  230    HE2  TYR  31           2HE      TYR  31   4.373 -10.381  -3.160
  231    HH   TYR  31           HH       TYR  31   3.693 -13.378  -1.622
  232    H    CYS  32           H        CYS  32   5.662  -5.103   1.553
  233    HA   CYS  32           HA       CYS  32   7.257  -4.561  -0.765
  234   1HB   CYS  32          2HB       CYS  32   5.305  -3.162   0.267
  235   2HB   CYS  32          1HB       CYS  32   6.571  -2.473   1.277
  236    H    SER  33           H        SER  33   9.300  -5.403  -0.401
  237    HA   SER  33           HA       SER  33  11.511  -5.209   0.134
  238   1HB   SER  33          2HB       SER  33  10.838  -2.677   0.303
  239   2HB   SER  33          1HB       SER  33  10.982  -2.953   2.038
  240    HG   SER  33           HG       SER  33  12.921  -2.492   0.310
  241    H    HIS  34           H        HIS  34  12.965  -5.171   2.219
  242    HA   HIS  34           HA       HIS  34  11.626  -6.931   4.149
  243   1HB   HIS  34          2HB       HIS  34  14.384  -6.735   3.078
  244   2HB   HIS  34          1HB       HIS  34  14.234  -7.200   4.769
  245    HD1  HIS  34           1HD      HIS  34  13.656  -8.430   1.310
  246    HD2  HIS  34           2HD      HIS  34  13.008  -9.711   5.208
  247    HE1  HIS  34           1HE      HIS  34  13.100 -10.876   1.130
  248    HE2  HIS  34           2HE      HIS  34  12.808 -11.650   3.509
  249    H    ARG  35           H        ARG  35  10.663  -5.214   5.345
  250    HA   ARG  35           HA       ARG  35  12.529  -3.492   6.817
  251   1HB   ARG  35          2HB       ARG  35  10.264  -2.784   5.546
  252   2HB   ARG  35          1HB       ARG  35   9.603  -3.140   7.135
  253   1HG   ARG  35          2HG       ARG  35  11.287  -1.579   8.107
  254   2HG   ARG  35          1HG       ARG  35  11.744  -1.138   6.460
  255   1HD   ARG  35          2HD       ARG  35  10.205   0.491   6.836
  256   2HD   ARG  35          1HD       ARG  35   9.118  -0.769   6.254
  257    HE   ARG  35           HE       ARG  35   9.178  -1.186   8.926
  258   1HH1  ARG  35          1HH1      ARG  35   8.557   1.629   6.960
  259   2HH1  ARG  35          2HH1      ARG  35   7.480   2.349   8.109
  260   1HH2  ARG  35          1HH2      ARG  35   7.761  -0.240  10.440
  261   2HH2  ARG  35          2HH2      ARG  35   7.029   1.289  10.085
  262    H    ILE  36           H        ILE  36  12.861  -3.719   8.947
  263    HA   ILE  36           HA       ILE  36  11.383  -5.855  10.322
  264    HB   ILE  36           HB       ILE  36  13.816  -6.161  10.193
  265   1HG1  ILE  36          2HG1      ILE  36  12.956  -5.526  13.023
  266   2HG1  ILE  36          1HG1      ILE  36  12.480  -6.980  12.153
  267   1HG2  ILE  36          1HG2      ILE  36  15.329  -4.677  11.399
  268   2HG2  ILE  36          2HG2      ILE  36  13.977  -3.624  11.814
  269   3HG2  ILE  36          3HG2      ILE  36  14.466  -3.808  10.129
  270   1HD1  ILE  36          1HD1      ILE  36  14.265  -7.858  13.182
  271   2HD1  ILE  36          2HD1      ILE  36  15.028  -6.287  13.429
  272   3HD1  ILE  36          3HD1      ILE  36  15.157  -7.093  11.867
  Start of MODEL   15
    1   1H    GLY   1          1HT       GLY   1 -10.974   9.507  -0.702
    2   2H    GLY   1          2HT       GLY   1 -11.727  10.869  -0.038
    3   3H    GLY   1          3HT       GLY   1 -10.289  10.286   0.635
    4   1HA   GLY   1          1HA       GLY   1  -9.477  10.689  -1.861
    5   2HA   GLY   1          2HA       GLY   1 -10.708  11.935  -1.721
    6    H    SER   2           H        SER   2  -8.205  12.774  -2.142
    7    HA   SER   2           HA       SER   2  -6.600  14.187  -1.369
    8   1HB   SER   2          2HB       SER   2  -8.850  14.549   0.523
    9   2HB   SER   2          1HB       SER   2  -7.279  15.133   1.072
   10    HG   SER   2           HG       SER   2  -8.181  16.799  -0.038
   11    H    LEU   3           H        LEU   3  -5.347  14.675   0.912
   12    HA   LEU   3           HA       LEU   3  -3.883  12.316   1.411
   13   1HB   LEU   3          2HB       LEU   3  -2.685  13.623   3.078
   14   2HB   LEU   3          1HB       LEU   3  -2.897  14.540   1.599
   15    HG   LEU   3           HG       LEU   3  -4.949  14.951   3.693
   16   1HD1  LEU   3          1HD1      LEU   3  -2.065  15.673   4.030
   17   2HD1  LEU   3          2HD1      LEU   3  -3.200  15.020   5.212
   18   3HD1  LEU   3          3HD1      LEU   3  -3.334  16.701   4.695
   19   1HD2  LEU   3          1HD2      LEU   3  -3.638  16.446   1.501
   20   2HD2  LEU   3          2HD2      LEU   3  -4.196  17.380   2.889
   21   3HD2  LEU   3          3HD2      LEU   3  -5.335  16.386   1.980
   22    H    LEU   4           H        LEU   4  -3.395  12.059   4.033
   23    HA   LEU   4           HA       LEU   4  -4.131  11.196   6.006
   24   1HB   LEU   4          2HB       LEU   4  -6.040  13.163   5.372
   25   2HB   LEU   4          1HB       LEU   4  -6.955  11.747   5.852
   26    HG   LEU   4           HG       LEU   4  -6.626  13.106   7.789
   27   1HD1  LEU   4          1HD1      LEU   4  -6.017  11.453   9.202
   28   2HD1  LEU   4          2HD1      LEU   4  -4.523  11.108   8.332
   29   3HD1  LEU   4          3HD1      LEU   4  -6.060  10.491   7.725
   30   1HD2  LEU   4          1HD2      LEU   4  -4.385  14.021   6.622
   31   2HD2  LEU   4          2HD2      LEU   4  -3.683  12.906   7.794
   32   3HD2  LEU   4          3HD2      LEU   4  -4.736  14.212   8.339
   33    H    LYS   5           H        LYS   5  -6.911  10.840   3.791
   34    HA   LYS   5           HA       LYS   5  -7.011   7.996   4.465
   35   1HB   LYS   5          2HB       LYS   5  -8.963  10.016   3.640
   36   2HB   LYS   5          1HB       LYS   5  -9.149   8.485   2.795
   37   1HG   LYS   5          2HG       LYS   5  -9.070   7.409   5.116
   38   2HG   LYS   5          1HG       LYS   5  -9.343   9.041   5.732
   39   1HD   LYS   5          2HD       LYS   5 -11.363   9.177   4.276
   40   2HD   LYS   5          1HD       LYS   5 -11.118   7.480   3.859
   41   1HE   LYS   5          2HE       LYS   5 -11.111   7.129   6.437
   42   2HE   LYS   5          1HE       LYS   5 -11.920   8.696   6.470
   43   1HZ   LYS   5          1HZ       LYS   5 -13.381   7.502   4.640
   44   2HZ   LYS   5          2HZ       LYS   5 -13.721   7.360   6.291
   45   3HZ   LYS   5          3HZ       LYS   5 -12.889   6.124   5.490
   46    HA   PRO   6           HA       PRO   6  -4.700   7.333   0.621
   47   1HB   PRO   6          2HB       PRO   6  -5.349   4.523   1.343
   48   2HB   PRO   6          1HB       PRO   6  -3.792   5.248   0.924
   49   1HG   PRO   6          2HG       PRO   6  -4.361   4.610   3.447
   50   2HG   PRO   6          1HG       PRO   6  -3.458   6.086   3.060
   51   1HD   PRO   6          2HD       PRO   6  -6.326   5.766   3.841
   52   2HD   PRO   6          1HD       PRO   6  -5.171   7.039   4.283
   53    H    ALA   7           H        ALA   7  -6.324   8.150  -0.762
   54    HA   ALA   7           HA       ALA   7  -8.708   6.695  -1.344
   55   1HB   ALA   7          1HB       ALA   7  -9.262   8.426  -2.743
   56   2HB   ALA   7          2HB       ALA   7  -7.595   8.690  -3.257
   57   3HB   ALA   7          3HB       ALA   7  -8.124   9.235  -1.665
   58    H    ARG   8           H        ARG   8  -5.651   7.184  -3.099
   59    HA   ARG   8           HA       ARG   8  -6.413   5.282  -5.140
   60   1HB   ARG   8          2HB       ARG   8  -4.850   7.443  -5.258
   61   2HB   ARG   8          1HB       ARG   8  -3.610   6.250  -4.898
   62   1HG   ARG   8          2HG       ARG   8  -4.156   4.998  -6.865
   63   2HG   ARG   8          1HG       ARG   8  -5.554   6.025  -7.183
   64   1HD   ARG   8          2HD       ARG   8  -4.307   7.572  -8.199
   65   2HD   ARG   8          1HD       ARG   8  -3.103   7.557  -6.912
   66    HE   ARG   8           HE       ARG   8  -2.594   5.271  -8.272
   67   1HH1  ARG   8          1HH1      ARG   8  -2.927   8.608  -9.236
   68   2HH1  ARG   8          2HH1      ARG   8  -1.830   8.462 -10.569
   69   1HH2  ARG   8          1HH2      ARG   8  -1.152   5.077 -10.023
   70   2HH2  ARG   8          2HH2      ARG   8  -0.822   6.458 -11.016
   71    H    PHE   9           H        PHE   9  -5.598   3.243  -5.441
   72    HA   PHE   9           HA       PHE   9  -3.877   2.182  -3.299
   73   1HB   PHE   9          2HB       PHE   9  -5.150  -0.008  -3.686
   74   2HB   PHE   9          1HB       PHE   9  -5.994   1.268  -2.815
   75    HD1  PHE   9           1HD      PHE   9  -7.789   2.534  -3.903
   76    HD2  PHE   9           2HD      PHE   9  -5.884  -0.745  -5.832
   77    HE1  PHE   9           1HE      PHE   9  -9.640   2.415  -5.519
   78    HE2  PHE   9           2HE      PHE   9  -7.731  -0.871  -7.452
   79    HZ   PHE   9           HZ       PHE   9  -9.612   0.710  -7.297
   80    H    MET  10           H        MET  10  -1.984   2.225  -4.454
   81    HA   MET  10           HA       MET  10  -1.565   0.092  -6.305
   82   1HB   MET  10          2HB       MET  10  -1.957   2.844  -7.313
   83   2HB   MET  10          1HB       MET  10  -0.560   1.993  -7.956
   84   1HG   MET  10          2HG       MET  10  -1.827   0.788  -9.308
   85   2HG   MET  10          1HG       MET  10  -2.864   0.281  -7.977
   86   1HE   MET  10          1HE       MET  10  -2.091   2.230 -10.822
   87   2HE   MET  10          2HE       MET  10  -2.866   3.800 -10.605
   88   3HE   MET  10          3HE       MET  10  -3.704   2.516 -11.477
   89    H    CYS  11           H        CYS  11   0.388  -0.661  -5.860
   90    HA   CYS  11           HA       CYS  11   2.275   0.979  -4.393
   91   1HB   CYS  11          2HB       CYS  11   1.658  -1.550  -4.018
   92   2HB   CYS  11          1HB       CYS  11   2.871  -1.821  -5.265
   93    H    LEU  12           H        LEU  12   2.942   2.456  -5.951
   94    HA   LEU  12           HA       LEU  12   3.900   1.791  -8.511
   95   1HB   LEU  12          2HB       LEU  12   4.955   4.161  -7.029
   96   2HB   LEU  12          1HB       LEU  12   4.537   4.008  -8.725
   97    HG   LEU  12           HG       LEU  12   2.652   4.328  -6.395
   98   1HD1  LEU  12          1HD1      LEU  12   2.614   6.019  -8.830
   99   2HD1  LEU  12          2HD1      LEU  12   3.932   6.255  -7.682
  100   3HD1  LEU  12          3HD1      LEU  12   2.259   6.434  -7.154
  101   1HD2  LEU  12          1HD2      LEU  12   2.056   3.636  -9.265
  102   2HD2  LEU  12          2HD2      LEU  12   0.858   4.269  -8.138
  103   3HD2  LEU  12          3HD2      LEU  12   1.627   2.714  -7.824
  104    HA   PRO  13           HA       PRO  13   8.313   2.252  -6.068
  105   1HB   PRO  13          2HB       PRO  13   7.231   0.330  -4.036
  106   2HB   PRO  13          1HB       PRO  13   8.534   1.515  -3.875
  107   1HG   PRO  13          2HG       PRO  13   6.107   2.049  -2.930
  108   2HG   PRO  13          1HG       PRO  13   7.069   3.308  -3.726
  109   1HD   PRO  13          2HD       PRO  13   4.672   1.865  -4.698
  110   2HD   PRO  13          1HD       PRO  13   5.267   3.481  -5.125
  111    H    CYS  14           H        CYS  14   6.204  -0.616  -6.210
  112    HA   CYS  14           HA       CYS  14   8.420  -2.092  -7.434
  113   1HB   CYS  14          2HB       CYS  14   7.381  -4.108  -6.601
  114   2HB   CYS  14          1HB       CYS  14   7.636  -3.000  -5.266
  115    H    GLY  15           H        GLY  15   5.066  -1.143  -7.633
  116   1HA   GLY  15          2HA       GLY  15   3.897  -0.821  -9.627
  117   2HA   GLY  15          1HA       GLY  15   5.067  -1.847 -10.426
  118    H    ILE  16           H        ILE  16   2.567  -2.058  -7.909
  119    HA   ILE  16           HA       ILE  16   1.417  -4.362  -9.270
  120    HB   ILE  16           HB       ILE  16   2.117  -4.530  -6.338
  121   1HG1  ILE  16          2HG1      ILE  16   3.446  -5.918  -8.677
  122   2HG1  ILE  16          1HG1      ILE  16   4.146  -4.586  -7.763
  123   1HG2  ILE  16          1HG2      ILE  16   0.627  -6.231  -8.249
  124   2HG2  ILE  16          2HG2      ILE  16   0.373  -5.971  -6.524
  125   3HG2  ILE  16          3HG2      ILE  16   1.657  -7.047  -7.073
  126   1HD1  ILE  16          1HD1      ILE  16   5.150  -6.479  -6.873
  127   2HD1  ILE  16          2HD1      ILE  16   3.648  -7.403  -6.895
  128   3HD1  ILE  16          3HD1      ILE  16   3.868  -6.106  -5.721
  129    H    ALA  17           H        ALA  17  -0.561  -3.537  -9.605
  130    HA   ALA  17           HA       ALA  17  -1.869  -1.907  -7.600
  131   1HB   ALA  17          1HB       ALA  17  -1.947  -1.788 -10.263
  132   2HB   ALA  17          2HB       ALA  17  -3.275  -1.226  -9.246
  133   3HB   ALA  17          3HB       ALA  17  -3.353  -2.820  -9.995
  134    H    PHE  18           H        PHE  18  -2.796  -2.883  -5.919
  135    HA   PHE  18           HA       PHE  18  -3.891  -5.557  -6.174
  136   1HB   PHE  18          2HB       PHE  18  -3.082  -3.752  -3.966
  137   2HB   PHE  18          1HB       PHE  18  -4.359  -4.902  -3.620
  138    HD1  PHE  18           1HD      PHE  18  -3.883  -7.375  -4.134
  139    HD2  PHE  18           2HD      PHE  18  -0.862  -4.388  -3.882
  140    HE1  PHE  18           1HE      PHE  18  -2.188  -9.122  -3.773
  141    HE2  PHE  18           2HE      PHE  18   0.837  -6.129  -3.521
  142    HZ   PHE  18           HZ       PHE  18   0.175  -8.498  -3.466
  143    H    SER  19           H        SER  19  -6.040  -6.086  -5.844
  144    HA   SER  19           HA       SER  19  -7.931  -3.967  -6.403
  145   1HB   SER  19          2HB       SER  19  -9.520  -6.097  -6.258
  146   2HB   SER  19          1HB       SER  19  -8.518  -5.783  -7.675
  147    HG   SER  19           HG       SER  19  -7.141  -7.344  -7.071
  148    H    SER  20           H        SER  20  -6.692  -3.988  -3.729
  149    HA   SER  20           HA       SER  20  -9.069  -3.590  -2.220
  150   1HB   SER  20          2HB       SER  20  -7.829  -6.184  -2.085
  151   2HB   SER  20          1HB       SER  20  -7.727  -5.391  -0.513
  152    HG   SER  20           HG       SER  20 -10.057  -4.937  -0.871
  153    HA   PRO  21           HA       PRO  21  -6.246  -0.850  -0.187
  154   1HB   PRO  21          2HB       PRO  21  -7.729  -0.151   1.954
  155   2HB   PRO  21          1HB       PRO  21  -8.123   0.392   0.319
  156   1HG   PRO  21          2HG       PRO  21  -9.324  -1.832   1.918
  157   2HG   PRO  21          1HG       PRO  21 -10.129  -0.629   0.894
  158   1HD   PRO  21          2HD       PRO  21  -9.603  -3.183   0.086
  159   2HD   PRO  21          1HD       PRO  21  -9.710  -1.808  -1.030
  160    H    SER  22           H        SER  22  -7.885  -3.190   1.950
  161    HA   SER  22           HA       SER  22  -5.972  -3.115   4.016
  162   1HB   SER  22          2HB       SER  22  -7.823  -5.382   3.220
  163   2HB   SER  22          1HB       SER  22  -6.976  -5.242   4.761
  164    HG   SER  22           HG       SER  22  -8.133  -3.144   4.920
  165    H    THR  23           H        THR  23  -6.141  -4.878   1.003
  166    HA   THR  23           HA       THR  23  -4.124  -6.774   1.556
  167    HB   THR  23           HB       THR  23  -4.756  -5.638  -1.168
  168    HG1  THR  23           1HG      THR  23  -6.379  -7.267  -1.243
  169   1HG2  THR  23          1HG2      THR  23  -4.483  -8.153  -1.712
  170   2HG2  THR  23          2HG2      THR  23  -3.588  -8.201  -0.193
  171   3HG2  THR  23          3HG2      THR  23  -3.051  -7.144  -1.499
  172    H    LEU  24           H        LEU  24  -4.076  -3.471   0.407
  173    HA   LEU  24           HA       LEU  24  -1.417  -3.342  -0.455
  174   1HB   LEU  24          2HB       LEU  24  -2.697  -1.026   0.935
  175   2HB   LEU  24          1HB       LEU  24  -1.672  -1.037  -0.480
  176    HG   LEU  24           HG       LEU  24  -4.564  -1.865  -0.377
  177   1HD1  LEU  24          1HD1      LEU  24  -3.401   0.396  -1.956
  178   2HD1  LEU  24          2HD1      LEU  24  -3.888   0.613  -0.274
  179   3HD1  LEU  24          3HD1      LEU  24  -5.075   0.115  -1.479
  180   1HD2  LEU  24          1HD2      LEU  24  -3.555  -3.251  -1.992
  181   2HD2  LEU  24          2HD2      LEU  24  -2.533  -1.943  -2.589
  182   3HD2  LEU  24          3HD2      LEU  24  -4.270  -1.915  -2.894
  183    H    GLU  25           H        GLU  25  -2.919  -2.795   2.670
  184    HA   GLU  25           HA       GLU  25  -0.553  -2.090   4.045
  185   1HB   GLU  25          2HB       GLU  25  -3.156  -1.984   4.687
  186   2HB   GLU  25          1HB       GLU  25  -2.736  -3.474   5.519
  187   1HG   GLU  25          2HG       GLU  25  -1.580  -2.404   7.112
  188   2HG   GLU  25          1HG       GLU  25  -0.871  -1.261   5.972
  189    H    ALA  26           H        ALA  26  -1.984  -5.109   3.147
  190    HA   ALA  26           HA       ALA  26  -0.427  -6.712   4.880
  191   1HB   ALA  26          1HB       ALA  26  -2.386  -7.780   4.285
  192   2HB   ALA  26          2HB       ALA  26  -1.217  -8.545   3.208
  193   3HB   ALA  26          3HB       ALA  26  -2.268  -7.265   2.602
  194    H    HIS  27           H        HIS  27  -0.206  -5.532   1.624
  195    HA   HIS  27           HA       HIS  27   2.059  -7.110   0.865
  196   1HB   HIS  27          2HB       HIS  27   0.602  -6.303  -0.866
  197   2HB   HIS  27          1HB       HIS  27   0.746  -4.649  -0.300
  198    HD1  HIS  27           1HD      HIS  27   2.798  -7.309  -2.071
  199    HD2  HIS  27           2HD      HIS  27   2.757  -3.211  -1.391
  200    HE1  HIS  27           1HE      HIS  27   4.587  -6.323  -3.564
  201    H    GLN  28           H        GLN  28   1.536  -3.740   1.770
  202    HA   GLN  28           HA       GLN  28   4.283  -3.028   1.803
  203   1HB   GLN  28          2HB       GLN  28   1.749  -1.756   2.282
  204   2HB   GLN  28          1HB       GLN  28   2.867  -1.334   3.571
  205   1HG   GLN  28          2HG       GLN  28   3.748  -1.140   0.731
  206   2HG   GLN  28          1HG       GLN  28   2.721   0.117   1.420
  207   1HE2  GLN  28          1HE2      GLN  28   4.842   1.225   0.729
  208   2HE2  GLN  28          2HE2      GLN  28   6.022   1.411   1.978
  209    H    ALA  29           H        ALA  29   2.381  -4.892   3.906
  210    HA   ALA  29           HA       ALA  29   3.690  -4.215   6.356
  211   1HB   ALA  29          1HB       ALA  29   1.664  -6.185   5.484
  212   2HB   ALA  29          2HB       ALA  29   1.658  -5.078   6.857
  213   3HB   ALA  29          3HB       ALA  29   2.590  -6.573   6.935
  214    H    TYR  30           H        TYR  30   3.828  -7.133   4.270
  215    HA   TYR  30           HA       TYR  30   6.589  -7.508   5.188
  216   1HB   TYR  30          2HB       TYR  30   4.308  -9.377   5.541
  217   2HB   TYR  30          1HB       TYR  30   5.868 -10.074   5.124
  218    HD1  TYR  30           1HD      TYR  30   4.268  -7.756   7.563
  219    HD2  TYR  30           2HD      TYR  30   7.430 -10.496   6.798
  220    HE1  TYR  30           1HE      TYR  30   4.953  -7.614   9.920
  221    HE2  TYR  30           2HE      TYR  30   8.124 -10.363   9.153
  222    HH   TYR  30           HH       TYR  30   6.901  -7.994  11.299
  223    H    TYR  31           H        TYR  31   4.789  -7.010   2.545
  224    HA   TYR  31           HA       TYR  31   6.053  -9.070   0.904
  225   1HB   TYR  31          2HB       TYR  31   3.577  -7.896   0.783
  226   2HB   TYR  31          1HB       TYR  31   4.454  -7.050  -0.485
  227    HD1  TYR  31           1HD      TYR  31   3.224 -10.321   0.656
  228    HD2  TYR  31           2HD      TYR  31   5.124  -8.190  -2.498
  229    HE1  TYR  31           1HE      TYR  31   2.862 -12.233  -0.844
  230    HE2  TYR  31           2HE      TYR  31   4.767 -10.097  -4.009
  231    HH   TYR  31           HH       TYR  31   4.212 -13.050  -3.145
  232    H    CYS  32           H        CYS  32   5.522  -5.591   0.332
  233    HA   CYS  32           HA       CYS  32   7.723  -5.314  -1.383
  234   1HB   CYS  32          2HB       CYS  32   5.632  -3.696  -0.577
  235   2HB   CYS  32          1HB       CYS  32   7.044  -2.871   0.073
  236    H    SER  33           H        SER  33   9.813  -5.402  -0.951
  237    HA   SER  33           HA       SER  33  11.768  -5.523   0.229
  238   1HB   SER  33          2HB       SER  33  11.281  -3.020  -0.136
  239   2HB   SER  33          1HB       SER  33  10.859  -2.987   1.576
  240    HG   SER  33           HG       SER  33  13.105  -2.481   1.034
  241    H    HIS  34           H        HIS  34  12.571  -4.707   2.720
  242    HA   HIS  34           HA       HIS  34  10.872  -6.315   4.513
  243   1HB   HIS  34          2HB       HIS  34  13.878  -6.018   4.658
  244   2HB   HIS  34          1HB       HIS  34  12.873  -7.066   5.653
  245    HD1  HIS  34           1HD      HIS  34  14.815  -7.026   2.588
  246    HD2  HIS  34           2HD      HIS  34  11.617  -9.212   4.087
  247    HE1  HIS  34           1HE      HIS  34  14.695  -9.099   1.169
  248    HE2  HIS  34           2HE      HIS  34  12.813 -10.450   2.157
  249    H    ARG  35           H        ARG  35   9.749  -4.467   5.240
  250    HA   ARG  35           HA       ARG  35  11.208  -2.287   6.450
  251   1HB   ARG  35          2HB       ARG  35   8.957  -2.131   5.216
  252   2HB   ARG  35          1HB       ARG  35   8.246  -2.772   6.691
  253   1HG   ARG  35          2HG       ARG  35   9.074  -0.879   7.951
  254   2HG   ARG  35          1HG       ARG  35   9.884  -0.251   6.514
  255   1HD   ARG  35          2HD       ARG  35   7.977   0.570   5.642
  256   2HD   ARG  35          1HD       ARG  35   7.017  -0.804   6.187
  257    HE   ARG  35           HE       ARG  35   7.835   0.949   8.312
  258   1HH1  ARG  35          1HH1      ARG  35   5.420   0.353   5.865
  259   2HH1  ARG  35          2HH1      ARG  35   4.183   1.241   6.691
  260   1HH2  ARG  35          1HH2      ARG  35   6.211   2.116   9.400
  261   2HH2  ARG  35          2HH2      ARG  35   4.633   2.242   8.698
  262    H    ILE  36           H        ILE  36  11.077  -1.688   8.661
  263    HA   ILE  36           HA       ILE  36   9.980  -3.545  10.581
  264    HB   ILE  36           HB       ILE  36  12.145  -4.592  10.077
  265   1HG1  ILE  36          2HG1      ILE  36  12.575  -3.403  12.776
  266   2HG1  ILE  36          1HG1      ILE  36  11.062  -4.261  12.494
  267   1HG2  ILE  36          1HG2      ILE  36  13.707  -2.433  11.336
  268   2HG2  ILE  36          2HG2      ILE  36  13.107  -2.105   9.710
  269   3HG2  ILE  36          3HG2      ILE  36  14.124  -3.514  10.006
  270   1HD1  ILE  36          1HD1      ILE  36  12.059  -6.259  12.517
  271   2HD1  ILE  36          2HD1      ILE  36  13.372  -5.407  13.328
  272   3HD1  ILE  36          3HD1      ILE  36  13.447  -5.692  11.589
  Start of MODEL   16
    1   1H    GLY   1          1HT       GLY   1 -10.274  14.181   1.786
    2   2H    GLY   1          2HT       GLY   1  -8.757  13.480   2.043
    3   3H    GLY   1          3HT       GLY   1  -9.310  13.743   0.468
    4   1HA   GLY   1          1HA       GLY   1  -9.110  16.068   0.647
    5   2HA   GLY   1          2HA       GLY   1  -8.885  15.955   2.387
    6    H    SER   2           H        SER   2  -7.350  13.829   0.052
    7    HA   SER   2           HA       SER   2  -5.178  13.480  -0.516
    8   1HB   SER   2          2HB       SER   2  -5.328  16.412  -0.151
    9   2HB   SER   2          1HB       SER   2  -3.709  15.720  -0.084
   10    HG   SER   2           HG       SER   2  -4.953  16.325  -2.230
   11    H    LEU   3           H        LEU   3  -4.563  15.859   2.044
   12    HA   LEU   3           HA       LEU   3  -2.626  14.231   3.308
   13   1HB   LEU   3          2HB       LEU   3  -2.886  15.926   5.193
   14   2HB   LEU   3          1HB       LEU   3  -2.363  16.530   3.632
   15    HG   LEU   3           HG       LEU   3  -5.274  16.612   4.056
   16   1HD1  LEU   3          1HD1      LEU   3  -3.395  17.866   5.959
   17   2HD1  LEU   3          2HD1      LEU   3  -5.071  17.364   6.179
   18   3HD1  LEU   3          3HD1      LEU   3  -4.705  18.880   5.354
   19   1HD2  LEU   3          1HD2      LEU   3  -3.659  17.633   2.217
   20   2HD2  LEU   3          2HD2      LEU   3  -3.606  18.967   3.370
   21   3HD2  LEU   3          3HD2      LEU   3  -5.151  18.439   2.704
   22    H    LEU   4           H        LEU   4  -2.714  12.965   5.121
   23    HA   LEU   4           HA       LEU   4  -3.592  11.564   6.679
   24   1HB   LEU   4          2HB       LEU   4  -4.978  14.051   6.991
   25   2HB   LEU   4          1HB       LEU   4  -6.094  12.735   7.300
   26    HG   LEU   4           HG       LEU   4  -5.006  13.535   9.353
   27   1HD1  LEU   4          1HD1      LEU   4  -5.532  10.995   8.682
   28   2HD1  LEU   4          2HD1      LEU   4  -4.906  11.471  10.261
   29   3HD1  LEU   4          3HD1      LEU   4  -3.808  10.859   9.023
   30   1HD2  LEU   4          1HD2      LEU   4  -2.579  13.050   7.737
   31   2HD2  LEU   4          2HD2      LEU   4  -2.499  12.607   9.441
   32   3HD2  LEU   4          3HD2      LEU   4  -2.895  14.261   8.979
   33    H    LYS   5           H        LYS   5  -5.061   9.845   6.906
   34    HA   LYS   5           HA       LYS   5  -6.490   8.236   6.190
   35   1HB   LYS   5          2HB       LYS   5  -7.849  10.668   5.045
   36   2HB   LYS   5          1HB       LYS   5  -8.509   9.052   4.842
   37   1HG   LYS   5          2HG       LYS   5  -8.048   9.149   7.534
   38   2HG   LYS   5          1HG       LYS   5  -8.527  10.808   7.170
   39   1HD   LYS   5          2HD       LYS   5 -10.593   9.908   7.500
   40   2HD   LYS   5          1HD       LYS   5 -10.411   9.546   5.782
   41   1HE   LYS   5          2HE       LYS   5  -9.447   7.316   6.493
   42   2HE   LYS   5          1HE       LYS   5  -9.998   7.700   8.123
   43   1HZ   LYS   5          1HZ       LYS   5 -11.534   6.941   5.776
   44   2HZ   LYS   5          2HZ       LYS   5 -12.221   8.145   6.745
   45   3HZ   LYS   5          3HZ       LYS   5 -11.836   6.640   7.414
   46    HA   PRO   6           HA       PRO   6  -4.643   7.231   2.257
   47   1HB   PRO   6          2HB       PRO   6  -5.593   4.712   2.026
   48   2HB   PRO   6          1HB       PRO   6  -4.300   5.136   3.154
   49   1HG   PRO   6          2HG       PRO   6  -7.222   4.752   3.680
   50   2HG   PRO   6          1HG       PRO   6  -5.831   4.186   4.624
   51   1HD   PRO   6          2HD       PRO   6  -7.273   6.394   5.287
   52   2HD   PRO   6          1HD       PRO   6  -5.545   6.222   5.655
   53    H    ALA   7           H        ALA   7  -5.255   6.946   0.092
   54    HA   ALA   7           HA       ALA   7  -8.053   6.648  -0.590
   55   1HB   ALA   7          1HB       ALA   7  -7.778   8.815  -2.055
   56   2HB   ALA   7          2HB       ALA   7  -6.618   9.248  -0.799
   57   3HB   ALA   7          3HB       ALA   7  -8.297   8.915  -0.371
   58    H    ARG   8           H        ARG   8  -5.507   5.254  -1.079
   59    HA   ARG   8           HA       ARG   8  -5.751   5.074  -3.981
   60   1HB   ARG   8          2HB       ARG   8  -3.115   5.472  -2.556
   61   2HB   ARG   8          1HB       ARG   8  -3.281   5.030  -4.249
   62   1HG   ARG   8          2HG       ARG   8  -4.837   7.257  -4.118
   63   2HG   ARG   8          1HG       ARG   8  -3.576   7.630  -2.940
   64   1HD   ARG   8          2HD       ARG   8  -2.715   8.446  -4.945
   65   2HD   ARG   8          1HD       ARG   8  -1.933   6.876  -4.766
   66    HE   ARG   8           HE       ARG   8  -4.143   6.332  -6.247
   67   1HH1  ARG   8          1HH1      ARG   8  -1.511   8.599  -6.577
   68   2HH1  ARG   8          2HH1      ARG   8  -1.566   8.603  -8.308
   69   1HH2  ARG   8          1HH2      ARG   8  -4.219   6.336  -8.523
   70   2HH2  ARG   8          2HH2      ARG   8  -3.104   7.319  -9.413
   71    H    PHE   9           H        PHE   9  -4.552   3.127  -4.827
   72    HA   PHE   9           HA       PHE   9  -3.973   1.049  -2.915
   73   1HB   PHE   9          2HB       PHE   9  -5.682  -0.494  -3.562
   74   2HB   PHE   9          1HB       PHE   9  -6.469   1.014  -3.124
   75    HD1  PHE   9           1HD      PHE   9  -5.357   2.066  -6.063
   76    HD2  PHE   9           2HD      PHE   9  -7.921  -0.997  -4.592
   77    HE1  PHE   9           1HE      PHE   9  -6.559   2.051  -8.204
   78    HE2  PHE   9           2HE      PHE   9  -9.125  -1.018  -6.736
   79    HZ   PHE   9           HZ       PHE   9  -8.445   0.506  -8.545
   80    H    MET  10           H        MET  10  -2.100   1.942  -4.441
   81    HA   MET  10           HA       MET  10  -1.474  -0.250  -6.174
   82   1HB   MET  10          2HB       MET  10  -2.840   1.095  -7.703
   83   2HB   MET  10          1HB       MET  10  -1.822   2.494  -7.394
   84   1HG   MET  10          2HG       MET  10   0.027   0.690  -8.194
   85   2HG   MET  10          1HG       MET  10  -1.374   0.173  -9.131
   86   1HE   MET  10          1HE       MET  10   0.686   0.529 -10.604
   87   2HE   MET  10          2HE       MET  10   1.353   2.090 -11.082
   88   3HE   MET  10          3HE       MET  10  -0.061   1.443 -11.914
   89    H    CYS  11           H        CYS  11   0.595  -0.656  -5.818
   90    HA   CYS  11           HA       CYS  11   2.309   1.377  -4.671
   91   1HB   CYS  11          2HB       CYS  11   2.136  -1.241  -4.153
   92   2HB   CYS  11          1HB       CYS  11   3.373  -1.307  -5.402
   93    H    LEU  12           H        LEU  12   2.540   2.806  -6.431
   94    HA   LEU  12           HA       LEU  12   3.257   2.202  -9.025
   95   1HB   LEU  12          2HB       LEU  12   4.500   4.577  -7.703
   96   2HB   LEU  12          1HB       LEU  12   3.820   4.429  -9.310
   97    HG   LEU  12           HG       LEU  12   1.617   4.033  -7.718
   98   1HD1  LEU  12          1HD1      LEU  12   2.179   6.407  -6.385
   99   2HD1  LEU  12          2HD1      LEU  12   3.610   5.405  -6.139
  100   3HD1  LEU  12          3HD1      LEU  12   2.020   4.801  -5.674
  101   1HD2  LEU  12          1HD2      LEU  12   2.403   6.791  -8.562
  102   2HD2  LEU  12          2HD2      LEU  12   0.833   5.993  -8.658
  103   3HD2  LEU  12          3HD2      LEU  12   2.122   5.540  -9.773
  104    HA   PRO  13           HA       PRO  13   7.886   2.220  -7.795
  105   1HB   PRO  13          2HB       PRO  13   8.165   2.160  -4.929
  106   2HB   PRO  13          1HB       PRO  13   8.656   3.432  -6.048
  107   1HG   PRO  13          2HG       PRO  13   6.643   3.693  -4.196
  108   2HG   PRO  13          1HG       PRO  13   6.764   4.650  -5.682
  109   1HD   PRO  13          2HD       PRO  13   5.078   2.242  -5.106
  110   2HD   PRO  13          1HD       PRO  13   4.667   3.717  -6.008
  111    H    CYS  14           H        CYS  14   6.268   0.011  -8.129
  112    HA   CYS  14           HA       CYS  14   7.879  -2.049  -6.931
  113   1HB   CYS  14          2HB       CYS  14   5.295  -1.368  -5.838
  114   2HB   CYS  14          1HB       CYS  14   5.285  -3.011  -6.465
  115    H    GLY  15           H        GLY  15   4.897  -1.403  -8.742
  116   1HA   GLY  15          2HA       GLY  15   4.912  -1.978 -11.122
  117   2HA   GLY  15          1HA       GLY  15   5.730  -3.453 -10.653
  118    H    ILE  16           H        ILE  16   3.835  -3.509  -8.235
  119    HA   ILE  16           HA       ILE  16   1.682  -4.902  -9.655
  120    HB   ILE  16           HB       ILE  16   1.153  -5.815  -7.348
  121   1HG1  ILE  16          2HG1      ILE  16   3.918  -4.779  -6.702
  122   2HG1  ILE  16          1HG1      ILE  16   2.435  -4.006  -6.151
  123   1HG2  ILE  16          1HG2      ILE  16   2.377  -7.046  -9.116
  124   2HG2  ILE  16          2HG2      ILE  16   2.845  -7.517  -7.483
  125   3HG2  ILE  16          3HG2      ILE  16   3.891  -6.458  -8.429
  126   1HD1  ILE  16          1HD1      ILE  16   3.809  -6.363  -5.142
  127   2HD1  ILE  16          2HD1      ILE  16   2.075  -6.599  -5.364
  128   3HD1  ILE  16          3HD1      ILE  16   2.662  -5.285  -4.345
  129    H    ALA  17           H        ALA  17  -0.512  -4.774  -8.718
  130    HA   ALA  17           HA       ALA  17  -1.117  -2.298  -7.294
  131   1HB   ALA  17          1HB       ALA  17  -1.171  -1.929  -9.826
  132   2HB   ALA  17          2HB       ALA  17  -2.582  -1.426  -8.897
  133   3HB   ALA  17          3HB       ALA  17  -2.621  -2.931  -9.813
  134    H    PHE  18           H        PHE  18  -2.219  -3.037  -5.587
  135    HA   PHE  18           HA       PHE  18  -3.856  -5.395  -5.756
  136   1HB   PHE  18          2HB       PHE  18  -3.062  -3.514  -3.544
  137   2HB   PHE  18          1HB       PHE  18  -4.200  -4.820  -3.303
  138    HD1  PHE  18           1HD      PHE  18  -3.432  -7.194  -3.768
  139    HD2  PHE  18           2HD      PHE  18  -0.764  -3.892  -3.475
  140    HE1  PHE  18           1HE      PHE  18  -1.559  -8.745  -3.386
  141    HE2  PHE  18           2HE      PHE  18   1.113  -5.436  -3.094
  142    HZ   PHE  18           HZ       PHE  18   0.718  -7.866  -3.050
  143    H    SER  19           H        SER  19  -5.983  -5.409  -6.106
  144    HA   SER  19           HA       SER  19  -7.411  -2.901  -6.352
  145   1HB   SER  19          2HB       SER  19  -7.544  -5.081  -7.856
  146   2HB   SER  19          1HB       SER  19  -8.778  -5.534  -6.680
  147    HG   SER  19           HG       SER  19  -9.379  -4.239  -8.663
  148    H    SER  20           H        SER  20  -6.677  -3.413  -3.688
  149    HA   SER  20           HA       SER  20  -9.204  -3.167  -2.418
  150   1HB   SER  20          2HB       SER  20  -9.523  -5.403  -2.140
  151   2HB   SER  20          1HB       SER  20  -7.815  -5.777  -2.351
  152    HG   SER  20           HG       SER  20  -8.480  -6.176  -0.215
  153    HA   PRO  21           HA       PRO  21  -6.658  -0.826   0.319
  154   1HB   PRO  21          2HB       PRO  21  -8.244  -0.712   2.515
  155   2HB   PRO  21          1HB       PRO  21  -8.586   0.197   1.038
  156   1HG   PRO  21          2HG       PRO  21  -9.758  -2.390   1.985
  157   2HG   PRO  21          1HG       PRO  21 -10.572  -0.995   1.252
  158   1HD   PRO  21          2HD       PRO  21  -9.945  -3.229  -0.151
  159   2HD   PRO  21          1HD       PRO  21  -9.973  -1.612  -0.886
  160    H    SER  22           H        SER  22  -8.202  -3.643   1.870
  161    HA   SER  22           HA       SER  22  -6.412  -3.894   4.002
  162   1HB   SER  22          2HB       SER  22  -8.256  -5.811   2.606
  163   2HB   SER  22          1HB       SER  22  -7.161  -6.394   3.861
  164    HG   SER  22           HG       SER  22  -8.096  -4.729   5.225
  165    H    THR  23           H        THR  23  -6.261  -5.141   0.706
  166    HA   THR  23           HA       THR  23  -4.078  -6.868   1.062
  167    HB   THR  23           HB       THR  23  -3.907  -5.757  -1.543
  168    HG1  THR  23           1HG      THR  23  -6.591  -6.320  -0.854
  169   1HG2  THR  23          1HG2      THR  23  -5.414  -8.226  -0.734
  170   2HG2  THR  23          2HG2      THR  23  -3.662  -8.147  -0.911
  171   3HG2  THR  23          3HG2      THR  23  -4.703  -7.863  -2.306
  172    H    LEU  24           H        LEU  24  -4.265  -3.424   0.405
  173    HA   LEU  24           HA       LEU  24  -1.583  -2.934  -0.174
  174   1HB   LEU  24          2HB       LEU  24  -3.143  -0.987   1.465
  175   2HB   LEU  24          1HB       LEU  24  -2.054  -0.693   0.130
  176    HG   LEU  24           HG       LEU  24  -4.886  -1.698  -0.038
  177   1HD1  LEU  24          1HD1      LEU  24  -5.166   0.382  -1.385
  178   2HD1  LEU  24          2HD1      LEU  24  -3.538   0.852  -0.896
  179   3HD1  LEU  24          3HD1      LEU  24  -4.802   0.658   0.318
  180   1HD2  LEU  24          1HD2      LEU  24  -3.463  -2.843  -1.680
  181   2HD2  LEU  24          2HD2      LEU  24  -2.901  -1.278  -2.270
  182   3HD2  LEU  24          3HD2      LEU  24  -4.596  -1.731  -2.451
  183    H    GLU  25           H        GLU  25  -3.320  -3.036   2.882
  184    HA   GLU  25           HA       GLU  25  -1.117  -2.366   4.523
  185   1HB   GLU  25          2HB       GLU  25  -3.752  -2.596   4.983
  186   2HB   GLU  25          1HB       GLU  25  -3.231  -4.156   5.603
  187   1HG   GLU  25          2HG       GLU  25  -1.435  -2.348   6.695
  188   2HG   GLU  25          1HG       GLU  25  -2.991  -1.523   6.767
  189    H    ALA  26           H        ALA  26  -2.177  -5.301   3.036
  190    HA   ALA  26           HA       ALA  26  -0.608  -7.040   4.616
  191   1HB   ALA  26          1HB       ALA  26  -2.527  -7.990   3.590
  192   2HB   ALA  26          2HB       ALA  26  -1.124  -8.702   2.793
  193   3HB   ALA  26          3HB       ALA  26  -2.032  -7.416   1.998
  194    H    HIS  27           H        HIS  27  -0.238  -5.299   1.626
  195    HA   HIS  27           HA       HIS  27   2.225  -6.546   0.866
  196   1HB   HIS  27          2HB       HIS  27   0.772  -5.526  -0.819
  197   2HB   HIS  27          1HB       HIS  27   0.927  -3.960  -0.035
  198    HD1  HIS  27           1HD      HIS  27   3.107  -6.486  -1.876
  199    HD2  HIS  27           2HD      HIS  27   2.960  -2.442  -0.933
  200    HE1  HIS  27           1HE      HIS  27   5.000  -5.392  -3.145
  201    H    GLN  28           H        GLN  28   1.307  -3.422   2.248
  202    HA   GLN  28           HA       GLN  28   3.930  -2.463   2.646
  203   1HB   GLN  28          2HB       GLN  28   1.240  -1.626   3.254
  204   2HB   GLN  28          1HB       GLN  28   2.269  -1.375   4.658
  205   1HG   GLN  28          2HG       GLN  28   3.521  -0.490   2.198
  206   2HG   GLN  28          1HG       GLN  28   1.984   0.317   2.505
  207   1HE2  GLN  28          1HE2      GLN  28   5.127   0.737   2.852
  208   2HE2  GLN  28          2HE2      GLN  28   5.185   1.647   4.320
  209    H    ALA  29           H        ALA  29   2.085  -4.864   4.231
  210    HA   ALA  29           HA       ALA  29   3.157  -4.693   6.831
  211   1HB   ALA  29          1HB       ALA  29   1.475  -6.528   5.331
  212   2HB   ALA  29          2HB       ALA  29   1.419  -6.071   7.033
  213   3HB   ALA  29          3HB       ALA  29   2.516  -7.344   6.498
  214    H    TYR  30           H        TYR  30   3.939  -7.093   4.270
  215    HA   TYR  30           HA       TYR  30   6.714  -7.017   5.170
  216   1HB   TYR  30          2HB       TYR  30   4.883  -9.373   5.334
  217   2HB   TYR  30          1HB       TYR  30   6.597  -9.620   5.046
  218    HD1  TYR  30           1HD      TYR  30   4.154  -8.175   7.417
  219    HD2  TYR  30           2HD      TYR  30   8.164  -9.464   6.820
  220    HE1  TYR  30           1HE      TYR  30   4.568  -7.980   9.831
  221    HE2  TYR  30           2HE      TYR  30   8.590  -9.275   9.235
  222    HH   TYR  30           HH       TYR  30   6.509  -7.665  11.348
  223    H    TYR  31           H        TYR  31   4.893  -6.596   2.595
  224    HA   TYR  31           HA       TYR  31   6.365  -8.368   0.796
  225   1HB   TYR  31          2HB       TYR  31   3.927  -6.677   0.526
  226   2HB   TYR  31          1HB       TYR  31   4.849  -7.051  -0.921
  227    HD1  TYR  31           1HD      TYR  31   4.251  -9.231   2.033
  228    HD2  TYR  31           2HD      TYR  31   3.435  -8.511  -2.081
  229    HE1  TYR  31           1HE      TYR  31   3.129 -11.414   1.879
  230    HE2  TYR  31           2HE      TYR  31   2.312 -10.691  -2.245
  231    HH   TYR  31           HH       TYR  31   2.292 -12.845  -1.095
  232    H    CYS  32           H        CYS  32   5.609  -4.888   0.968
  233    HA   CYS  32           HA       CYS  32   7.511  -4.106  -0.948
  234   1HB   CYS  32          2HB       CYS  32   5.512  -2.830   0.374
  235   2HB   CYS  32          1HB       CYS  32   6.917  -2.167   1.201
  236    H    SER  33           H        SER  33   9.418  -5.263  -0.417
  237    HA   SER  33           HA       SER  33  11.580  -5.290   0.313
  238   1HB   SER  33          2HB       SER  33  10.855  -2.660   0.773
  239   2HB   SER  33          1HB       SER  33  11.417  -3.199   2.355
  240    HG   SER  33           HG       SER  33  13.294  -4.051   1.104
  241    H    HIS  34           H        HIS  34  12.799  -5.248   2.638
  242    HA   HIS  34           HA       HIS  34  11.145  -6.969   4.364
  243   1HB   HIS  34          2HB       HIS  34  14.140  -6.948   3.937
  244   2HB   HIS  34          1HB       HIS  34  13.310  -7.951   5.123
  245    HD1  HIS  34           1HD      HIS  34  13.320  -7.410   1.359
  246    HD2  HIS  34           2HD      HIS  34  12.563 -10.376   4.168
  247    HE1  HIS  34           1HE      HIS  34  12.893  -9.502   0.030
  248    HE2  HIS  34           2HE      HIS  34  12.344 -11.260   1.748
  249    H    ARG  35           H        ARG  35  10.321  -5.187   5.551
  250    HA   ARG  35           HA       ARG  35  12.146  -3.449   6.963
  251   1HB   ARG  35          2HB       ARG  35   9.152  -3.735   6.894
  252   2HB   ARG  35          1HB       ARG  35   9.943  -2.701   8.076
  253   1HG   ARG  35          2HG       ARG  35  11.107  -1.919   5.718
  254   2HG   ARG  35          1HG       ARG  35   9.443  -2.265   5.243
  255   1HD   ARG  35          2HD       ARG  35   9.647  -0.774   7.744
  256   2HD   ARG  35          1HD       ARG  35  10.348   0.076   6.368
  257    HE   ARG  35           HE       ARG  35   8.244   0.330   5.480
  258   1HH1  ARG  35          1HH1      ARG  35   8.110  -1.948   8.124
  259   2HH1  ARG  35          2HH1      ARG  35   6.380  -1.989   8.163
  260   1HH2  ARG  35          1HH2      ARG  35   5.970   0.276   5.533
  261   2HH2  ARG  35          2HH2      ARG  35   5.165  -0.728   6.694
  262    H    ILE  36           H        ILE  36  11.404  -3.120   9.424
  263    HA   ILE  36           HA       ILE  36  11.242  -5.757  10.709
  264    HB   ILE  36           HB       ILE  36  13.607  -5.101  10.665
  265   1HG1  ILE  36          2HG1      ILE  36  13.098  -4.649  13.512
  266   2HG1  ILE  36          1HG1      ILE  36  12.149  -5.975  12.846
  267   1HG2  ILE  36          1HG2      ILE  36  14.400  -3.142  11.853
  268   2HG2  ILE  36          2HG2      ILE  36  12.744  -2.698  12.267
  269   3HG2  ILE  36          3HG2      ILE  36  13.269  -2.671  10.584
  270   1HD1  ILE  36          1HD1      ILE  36  13.926  -7.253  13.172
  271   2HD1  ILE  36          2HD1      ILE  36  14.953  -5.858  13.505
  272   3HD1  ILE  36          3HD1      ILE  36  14.696  -6.387  11.842
  Start of MODEL   17
    1   1H    GLY   1          1HT       GLY   1  -8.843  10.510   1.572
    2   2H    GLY   1          2HT       GLY   1 -10.235  11.257   2.176
    3   3H    GLY   1          3HT       GLY   1  -8.712  11.710   2.758
    4   1HA   GLY   1          1HA       GLY   1  -9.050  11.960  -0.107
    5   2HA   GLY   1          2HA       GLY   1 -10.047  13.038   0.857
    6    H    SER   2           H        SER   2  -7.438  13.165  -0.871
    7    HA   SER   2           HA       SER   2  -5.615  14.516  -0.967
    8   1HB   SER   2          2HB       SER   2  -6.974  15.812   1.404
    9   2HB   SER   2          1HB       SER   2  -5.533  16.463   0.625
   10    HG   SER   2           HG       SER   2  -6.788  17.285  -0.829
   11    H    LEU   3           H        LEU   3  -5.978  14.540   2.565
   12    HA   LEU   3           HA       LEU   3  -3.584  12.854   2.781
   13   1HB   LEU   3          2HB       LEU   3  -2.803  14.344   4.646
   14   2HB   LEU   3          1HB       LEU   3  -2.703  15.038   3.039
   15    HG   LEU   3           HG       LEU   3  -5.148  15.617   4.629
   16   1HD1  LEU   3          1HD1      LEU   3  -2.409  16.410   5.400
   17   2HD1  LEU   3          2HD1      LEU   3  -3.860  16.228   6.384
   18   3HD1  LEU   3          3HD1      LEU   3  -3.634  17.678   5.407
   19   1HD2  LEU   3          1HD2      LEU   3  -3.517  16.888   2.488
   20   2HD2  LEU   3          2HD2      LEU   3  -4.487  17.918   3.541
   21   3HD2  LEU   3          3HD2      LEU   3  -5.261  16.651   2.590
   22    H    LEU   4           H        LEU   4  -3.229  12.454   5.306
   23    HA   LEU   4           HA       LEU   4  -3.969  11.408   7.184
   24   1HB   LEU   4          2HB       LEU   4  -6.013  13.411   6.609
   25   2HB   LEU   4          1HB       LEU   4  -6.644  12.037   7.495
   26    HG   LEU   4           HG       LEU   4  -5.915  13.912   8.948
   27   1HD1  LEU   4          1HD1      LEU   4  -6.009  11.655   9.832
   28   2HD1  LEU   4          2HD1      LEU   4  -4.644  12.531  10.526
   29   3HD1  LEU   4          3HD1      LEU   4  -4.373  11.340   9.253
   30   1HD2  LEU   4          1HD2      LEU   4  -3.823  14.193   7.290
   31   2HD2  LEU   4          2HD2      LEU   4  -3.071  13.231   8.563
   32   3HD2  LEU   4          3HD2      LEU   4  -3.829  14.774   8.954
   33    H    LYS   5           H        LYS   5  -7.078  11.454   5.474
   34    HA   LYS   5           HA       LYS   5  -7.314   8.594   5.788
   35   1HB   LYS   5          2HB       LYS   5  -9.116  10.753   4.735
   36   2HB   LYS   5          1HB       LYS   5  -9.513   9.056   4.498
   37   1HG   LYS   5          2HG       LYS   5  -9.012   9.045   7.137
   38   2HG   LYS   5          1HG       LYS   5  -9.594  10.699   6.939
   39   1HD   LYS   5          2HD       LYS   5 -11.705  10.024   6.634
   40   2HD   LYS   5          1HD       LYS   5 -11.222   8.758   5.504
   41   1HE   LYS   5          2HE       LYS   5 -10.336   7.725   7.848
   42   2HE   LYS   5          1HE       LYS   5 -11.755   8.618   8.393
   43   1HZ   LYS   5          1HZ       LYS   5 -12.031   6.917   6.028
   44   2HZ   LYS   5          2HZ       LYS   5 -13.160   7.279   7.234
   45   3HZ   LYS   5          3HZ       LYS   5 -11.930   6.158   7.537
   46    HA   PRO   6           HA       PRO   6  -5.437   7.967   1.740
   47   1HB   PRO   6          2HB       PRO   6  -5.433   5.260   1.823
   48   2HB   PRO   6          1HB       PRO   6  -4.250   6.241   2.696
   49   1HG   PRO   6          2HG       PRO   6  -6.741   4.931   3.713
   50   2HG   PRO   6          1HG       PRO   6  -5.133   5.003   4.456
   51   1HD   PRO   6          2HD       PRO   6  -7.164   6.631   5.210
   52   2HD   PRO   6          1HD       PRO   6  -5.462   7.134   5.267
   53    H    ALA   7           H        ALA   7  -6.024   6.612  -0.205
   54    HA   ALA   7           HA       ALA   7  -8.570   5.442  -0.483
   55   1HB   ALA   7          1HB       ALA   7  -8.442   8.194  -1.693
   56   2HB   ALA   7          2HB       ALA   7  -9.209   7.859  -0.140
   57   3HB   ALA   7          3HB       ALA   7  -9.827   7.104  -1.610
   58    H    ARG   8           H        ARG   8  -5.943   4.825  -1.261
   59    HA   ARG   8           HA       ARG   8  -6.292   4.713  -4.175
   60   1HB   ARG   8          2HB       ARG   8  -4.581   6.453  -3.473
   61   2HB   ARG   8          1HB       ARG   8  -3.601   5.121  -2.874
   62   1HG   ARG   8          2HG       ARG   8  -3.083   4.374  -4.965
   63   2HG   ARG   8          1HG       ARG   8  -4.577   4.987  -5.674
   64   1HD   ARG   8          2HD       ARG   8  -2.987   7.159  -4.663
   65   2HD   ARG   8          1HD       ARG   8  -2.030   6.160  -5.756
   66    HE   ARG   8           HE       ARG   8  -4.102   7.944  -6.482
   67   1HH1  ARG   8          1HH1      ARG   8  -2.765   4.827  -7.301
   68   2HH1  ARG   8          2HH1      ARG   8  -3.293   4.893  -8.949
   69   1HH2  ARG   8          1HH2      ARG   8  -4.798   8.033  -8.649
   70   2HH2  ARG   8          2HH2      ARG   8  -4.447   6.713  -9.714
   71    H    PHE   9           H        PHE   9  -5.147   2.936  -5.199
   72    HA   PHE   9           HA       PHE   9  -4.229   0.807  -3.432
   73   1HB   PHE   9          2HB       PHE   9  -5.743  -0.698  -5.100
   74   2HB   PHE   9          1HB       PHE   9  -6.283  -0.153  -3.517
   75    HD1  PHE   9           1HD      PHE   9  -8.203   1.134  -3.312
   76    HD2  PHE   9           2HD      PHE   9  -6.330   0.768  -7.116
   77    HE1  PHE   9           1HE      PHE   9 -10.111   2.284  -4.357
   78    HE2  PHE   9           2HE      PHE   9  -8.234   1.919  -8.167
   79    HZ   PHE   9           HZ       PHE   9 -10.127   2.678  -6.787
   80    H    MET  10           H        MET  10  -2.257   1.613  -4.509
   81    HA   MET  10           HA       MET  10  -1.546  -0.109  -6.670
   82   1HB   MET  10          2HB       MET  10  -2.313   2.667  -7.237
   83   2HB   MET  10          1HB       MET  10  -0.739   2.218  -7.879
   84   1HG   MET  10          2HG       MET  10  -1.894   0.196  -8.885
   85   2HG   MET  10          1HG       MET  10  -3.411   0.996  -8.479
   86   1HE   MET  10          1HE       MET  10  -3.526   0.225 -10.953
   87   2HE   MET  10          2HE       MET  10  -2.023   0.390 -11.861
   88   3HE   MET  10          3HE       MET  10  -3.394   1.439 -12.226
   89    H    CYS  11           H        CYS  11   0.467  -0.714  -6.245
   90    HA   CYS  11           HA       CYS  11   2.147   1.011  -4.588
   91   1HB   CYS  11          2HB       CYS  11   1.671  -1.470  -4.068
   92   2HB   CYS  11          1HB       CYS  11   2.796  -1.819  -5.376
   93    H    LEU  12           H        LEU  12   2.924   2.480  -6.047
   94    HA   LEU  12           HA       LEU  12   3.936   1.897  -8.599
   95   1HB   LEU  12          2HB       LEU  12   5.013   4.180  -7.001
   96   2HB   LEU  12          1HB       LEU  12   4.627   4.106  -8.708
   97    HG   LEU  12           HG       LEU  12   2.701   4.376  -6.405
   98   1HD1  LEU  12          1HD1      LEU  12   2.726   6.168  -8.761
   99   2HD1  LEU  12          2HD1      LEU  12   4.056   6.318  -7.613
  100   3HD1  LEU  12          3HD1      LEU  12   2.392   6.523  -7.066
  101   1HD2  LEU  12          1HD2      LEU  12   1.112   4.596  -8.537
  102   2HD2  LEU  12          2HD2      LEU  12   1.378   3.065  -7.701
  103   3HD2  LEU  12          3HD2      LEU  12   2.272   3.432  -9.177
  104    HA   PRO  13           HA       PRO  13   8.308   2.155  -6.049
  105   1HB   PRO  13          2HB       PRO  13   7.137   0.165  -4.133
  106   2HB   PRO  13          1HB       PRO  13   8.465   1.307  -3.888
  107   1HG   PRO  13          2HG       PRO  13   6.030   1.858  -2.971
  108   2HG   PRO  13          1HG       PRO  13   7.041   3.127  -3.685
  109   1HD   PRO  13          2HD       PRO  13   4.630   1.797  -4.775
  110   2HD   PRO  13          1HD       PRO  13   5.279   3.413  -5.116
  111    H    CYS  14           H        CYS  14   6.165  -0.689  -6.309
  112    HA   CYS  14           HA       CYS  14   8.367  -2.125  -7.606
  113   1HB   CYS  14          2HB       CYS  14   7.293  -4.171  -6.857
  114   2HB   CYS  14          1HB       CYS  14   7.622  -3.133  -5.482
  115    H    GLY  15           H        GLY  15   5.017  -1.154  -7.745
  116   1HA   GLY  15          2HA       GLY  15   3.848  -0.749  -9.726
  117   2HA   GLY  15          1HA       GLY  15   4.992  -1.777 -10.558
  118    H    ILE  16           H        ILE  16   2.464  -1.970  -8.072
  119    HA   ILE  16           HA       ILE  16   1.287  -4.238  -9.465
  120    HB   ILE  16           HB       ILE  16   1.976  -4.466  -6.535
  121   1HG1  ILE  16          2HG1      ILE  16   3.292  -5.805  -8.909
  122   2HG1  ILE  16          1HG1      ILE  16   4.016  -4.542  -7.919
  123   1HG2  ILE  16          1HG2      ILE  16   0.414  -6.069  -8.453
  124   2HG2  ILE  16          2HG2      ILE  16   0.246  -5.904  -6.705
  125   3HG2  ILE  16          3HG2      ILE  16   1.480  -6.970  -7.376
  126   1HD1  ILE  16          1HD1      ILE  16   3.903  -7.387  -7.485
  127   2HD1  ILE  16          2HD1      ILE  16   3.259  -6.497  -6.104
  128   3HD1  ILE  16          3HD1      ILE  16   4.889  -6.161  -6.690
  129    H    ALA  17           H        ALA  17  -0.711  -3.480  -9.761
  130    HA   ALA  17           HA       ALA  17  -1.988  -1.792  -7.785
  131   1HB   ALA  17          1HB       ALA  17  -2.122  -1.571 -10.357
  132   2HB   ALA  17          2HB       ALA  17  -3.578  -1.298  -9.400
  133   3HB   ALA  17          3HB       ALA  17  -3.349  -2.833 -10.239
  134    H    PHE  18           H        PHE  18  -2.853  -2.735  -6.048
  135    HA   PHE  18           HA       PHE  18  -3.943  -5.416  -6.193
  136   1HB   PHE  18          2HB       PHE  18  -3.130  -3.521  -4.066
  137   2HB   PHE  18          1HB       PHE  18  -4.404  -4.655  -3.664
  138    HD1  PHE  18           1HD      PHE  18  -3.876  -7.163  -4.372
  139    HD2  PHE  18           2HD      PHE  18  -0.966  -4.140  -3.668
  140    HE1  PHE  18           1HE      PHE  18  -2.183  -8.897  -3.942
  141    HE2  PHE  18           2HE      PHE  18   0.732  -5.867  -3.237
  142    HZ   PHE  18           HZ       PHE  18   0.124  -8.248  -3.374
  143    H    SER  19           H        SER  19  -6.080  -5.954  -5.899
  144    HA   SER  19           HA       SER  19  -7.997  -3.857  -6.455
  145   1HB   SER  19          2HB       SER  19  -7.863  -6.342  -7.391
  146   2HB   SER  19          1HB       SER  19  -8.859  -6.668  -5.973
  147    HG   SER  19           HG       SER  19 -10.310  -5.058  -6.736
  148    H    SER  20           H        SER  20  -6.736  -3.904  -3.772
  149    HA   SER  20           HA       SER  20  -9.114  -3.517  -2.259
  150   1HB   SER  20          2HB       SER  20  -7.617  -6.052  -1.974
  151   2HB   SER  20          1HB       SER  20  -8.069  -5.252  -0.470
  152    HG   SER  20           HG       SER  20  -9.929  -6.166  -0.807
  153    HA   PRO  21           HA       PRO  21  -6.297  -0.840  -0.145
  154   1HB   PRO  21          2HB       PRO  21  -7.773  -0.184   2.007
  155   2HB   PRO  21          1HB       PRO  21  -8.192   0.370   0.381
  156   1HG   PRO  21          2HG       PRO  21  -9.350  -1.883   1.971
  157   2HG   PRO  21          1HG       PRO  21 -10.178  -0.684   0.962
  158   1HD   PRO  21          2HD       PRO  21  -9.606  -3.233   0.139
  159   2HD   PRO  21          1HD       PRO  21  -9.781  -1.856  -0.965
  160    H    SER  22           H        SER  22  -7.919  -3.235   1.948
  161    HA   SER  22           HA       SER  22  -6.016  -3.186   4.018
  162   1HB   SER  22          2HB       SER  22  -8.345  -4.215   4.086
  163   2HB   SER  22          1HB       SER  22  -7.660  -5.599   3.234
  164    HG   SER  22           HG       SER  22  -6.628  -6.191   4.994
  165    H    THR  23           H        THR  23  -6.164  -4.931   0.983
  166    HA   THR  23           HA       THR  23  -4.117  -6.792   1.498
  167    HB   THR  23           HB       THR  23  -4.931  -5.570  -1.148
  168    HG1  THR  23           1HG      THR  23  -6.621  -6.640   0.061
  169   1HG2  THR  23          1HG2      THR  23  -4.147  -7.675  -2.131
  170   2HG2  THR  23          2HG2      THR  23  -3.509  -8.154  -0.558
  171   3HG2  THR  23          3HG2      THR  23  -2.843  -6.747  -1.390
  172    H    LEU  24           H        LEU  24  -4.102  -3.463   0.440
  173    HA   LEU  24           HA       LEU  24  -1.432  -3.279  -0.388
  174   1HB   LEU  24          2HB       LEU  24  -2.770  -1.009   1.022
  175   2HB   LEU  24          1HB       LEU  24  -1.725  -0.980  -0.379
  176    HG   LEU  24           HG       LEU  24  -4.603  -1.863  -0.336
  177   1HD1  LEU  24          1HD1      LEU  24  -5.035   0.115  -1.632
  178   2HD1  LEU  24          2HD1      LEU  24  -3.320   0.525  -1.647
  179   3HD1  LEU  24          3HD1      LEU  24  -4.225   0.572  -0.134
  180   1HD2  LEU  24          1HD2      LEU  24  -3.292  -3.165  -1.931
  181   2HD2  LEU  24          2HD2      LEU  24  -2.667  -1.674  -2.639
  182   3HD2  LEU  24          3HD2      LEU  24  -4.386  -2.055  -2.757
  183    H    GLU  25           H        GLU  25  -2.994  -2.813   2.722
  184    HA   GLU  25           HA       GLU  25  -0.700  -2.053   4.163
  185   1HB   GLU  25          2HB       GLU  25  -3.315  -2.132   4.760
  186   2HB   GLU  25          1HB       GLU  25  -2.814  -3.617   5.553
  187   1HG   GLU  25          2HG       GLU  25  -1.034  -1.412   6.151
  188   2HG   GLU  25          1HG       GLU  25  -2.703  -1.060   6.594
  189    H    ALA  26           H        ALA  26  -1.947  -5.127   3.169
  190    HA   ALA  26           HA       ALA  26  -0.308  -6.680   4.870
  191   1HB   ALA  26          1HB       ALA  26  -2.252  -7.207   2.729
  192   2HB   ALA  26          2HB       ALA  26  -2.038  -8.008   4.286
  193   3HB   ALA  26          3HB       ALA  26  -0.987  -8.420   2.930
  194    H    HIS  27           H        HIS  27  -0.134  -5.399   1.648
  195    HA   HIS  27           HA       HIS  27   2.227  -6.827   0.875
  196   1HB   HIS  27          2HB       HIS  27   0.655  -6.033  -0.810
  197   2HB   HIS  27          1HB       HIS  27   0.867  -4.377  -0.271
  198    HD1  HIS  27           1HD      HIS  27   2.856  -7.138  -1.973
  199    HD2  HIS  27           2HD      HIS  27   2.829  -3.010  -1.504
  200    HE1  HIS  27           1HE      HIS  27   4.617  -6.232  -3.547
  201    H    GLN  28           H        GLN  28   1.489  -3.529   1.891
  202    HA   GLN  28           HA       GLN  28   4.197  -2.655   1.943
  203   1HB   GLN  28          2HB       GLN  28   1.588  -1.540   2.426
  204   2HB   GLN  28          1HB       GLN  28   2.669  -1.088   3.736
  205   1HG   GLN  28          2HG       GLN  28   3.578  -0.775   0.919
  206   2HG   GLN  28          1HG       GLN  28   2.455   0.396   1.604
  207   1HE2  GLN  28          1HE2      GLN  28   5.420   0.349   0.810
  208   2HE2  GLN  28          2HE2      GLN  28   6.204   1.098   2.155
  209    H    ALA  29           H        ALA  29   2.397  -4.689   3.961
  210    HA   ALA  29           HA       ALA  29   3.622  -4.004   6.452
  211   1HB   ALA  29          1HB       ALA  29   1.735  -6.066   5.489
  212   2HB   ALA  29          2HB       ALA  29   1.640  -5.004   6.894
  213   3HB   ALA  29          3HB       ALA  29   2.662  -6.442   6.942
  214    H    TYR  30           H        TYR  30   3.964  -6.857   4.297
  215    HA   TYR  30           HA       TYR  30   6.741  -7.062   5.195
  216   1HB   TYR  30          2HB       TYR  30   4.590  -9.071   5.608
  217   2HB   TYR  30          1HB       TYR  30   6.199  -9.660   5.211
  218    HD1  TYR  30           1HD      TYR  30   4.061  -8.393   7.789
  219    HD2  TYR  30           2HD      TYR  30   8.137  -8.936   6.698
  220    HE1  TYR  30           1HE      TYR  30   4.717  -8.142  10.145
  221    HE2  TYR  30           2HE      TYR  30   8.805  -8.688   9.052
  222    HH   TYR  30           HH       TYR  30   7.464  -9.107  11.402
  223    H    TYR  31           H        TYR  31   4.950  -6.645   2.575
  224    HA   TYR  31           HA       TYR  31   6.218  -8.709   0.943
  225   1HB   TYR  31          2HB       TYR  31   3.740  -7.513   0.821
  226   2HB   TYR  31          1HB       TYR  31   4.621  -6.722  -0.479
  227    HD1  TYR  31           1HD      TYR  31   3.280  -9.903   0.752
  228    HD2  TYR  31           2HD      TYR  31   5.336  -7.971  -2.432
  229    HE1  TYR  31           1HE      TYR  31   2.881 -11.859  -0.684
  230    HE2  TYR  31           2HE      TYR  31   4.943  -9.922  -3.878
  231    HH   TYR  31           HH       TYR  31   2.724 -12.271  -3.233
  232    H    CYS  32           H        CYS  32   5.661  -5.242   0.331
  233    HA   CYS  32           HA       CYS  32   7.943  -5.011  -1.326
  234   1HB   CYS  32          2HB       CYS  32   5.727  -3.422  -0.720
  235   2HB   CYS  32          1HB       CYS  32   7.110  -2.480  -0.174
  236    H    SER  33           H        SER  33   9.927  -5.338  -0.541
  237    HA   SER  33           HA       SER  33  11.865  -4.890   0.578
  238   1HB   SER  33          2HB       SER  33  10.432  -2.837   2.257
  239   2HB   SER  33          1HB       SER  33  12.140  -2.899   1.820
  240    HG   SER  33           HG       SER  33   9.929  -2.133   0.262
  241    H    HIS  34           H        HIS  34  12.785  -4.994   2.860
  242    HA   HIS  34           HA       HIS  34  11.161  -6.898   4.394
  243   1HB   HIS  34          2HB       HIS  34  14.083  -6.542   3.953
  244   2HB   HIS  34          1HB       HIS  34  13.571  -7.179   5.512
  245    HD1  HIS  34           1HD      HIS  34  12.795  -7.939   1.856
  246    HD2  HIS  34           2HD      HIS  34  13.445  -9.870   5.478
  247    HE1  HIS  34           1HE      HIS  34  12.665 -10.398   1.341
  248    HE2  HIS  34           2HE      HIS  34  12.966 -11.543   3.565
  249    H    ARG  35           H        ARG  35   9.915  -5.399   5.544
  250    HA   ARG  35           HA       ARG  35  11.033  -3.246   7.017
  251   1HB   ARG  35          2HB       ARG  35   8.399  -4.450   6.638
  252   2HB   ARG  35          1HB       ARG  35   8.643  -3.857   8.274
  253   1HG   ARG  35          2HG       ARG  35   9.460  -2.030   6.112
  254   2HG   ARG  35          1HG       ARG  35   7.729  -2.346   6.255
  255   1HD   ARG  35          2HD       ARG  35   8.128  -1.882   8.783
  256   2HD   ARG  35          1HD       ARG  35   9.598  -1.086   8.221
  257    HE   ARG  35           HE       ARG  35   8.319   0.631   7.410
  258   1HH1  ARG  35          1HH1      ARG  35   6.250  -2.094   8.096
  259   2HH1  ARG  35          2HH1      ARG  35   4.785  -1.206   7.838
  260   1HH2  ARG  35          1HH2      ARG  35   6.393   1.800   7.069
  261   2HH2  ARG  35          2HH2      ARG  35   4.866   1.003   7.254
  262    H    ILE  36           H        ILE  36  10.781  -3.073   9.434
  263    HA   ILE  36           HA       ILE  36  10.895  -5.480  10.986
  264    HB   ILE  36           HB       ILE  36  13.167  -5.499  10.065
  265   1HG1  ILE  36          2HG1      ILE  36  13.698  -4.662  12.854
  266   2HG1  ILE  36          1HG1      ILE  36  12.457  -5.893  12.649
  267   1HG2  ILE  36          1HG2      ILE  36  14.566  -3.493  11.262
  268   2HG2  ILE  36          2HG2      ILE  36  13.066  -2.673  10.828
  269   3HG2  ILE  36          3HG2      ILE  36  14.019  -3.484   9.585
  270   1HD1  ILE  36          1HD1      ILE  36  13.974  -7.463  12.292
  271   2HD1  ILE  36          2HD1      ILE  36  15.194  -6.285  12.776
  272   3HD1  ILE  36          3HD1      ILE  36  14.794  -6.491  11.070
  Start of MODEL   18
    1   1H    GLY   1          1HT       GLY   1  -8.010  10.682   0.612
    2   2H    GLY   1          2HT       GLY   1  -9.523  10.627   1.368
    3   3H    GLY   1          3HT       GLY   1  -8.199  11.299   2.177
    4   1HA   GLY   1          1HA       GLY   1  -9.290  12.404  -0.347
    5   2HA   GLY   1          2HA       GLY   1  -9.812  12.948   1.241
    6    H    SER   2           H        SER   2  -7.229  12.930  -1.088
    7    HA   SER   2           HA       SER   2  -5.455  14.320  -1.401
    8   1HB   SER   2          2HB       SER   2  -7.260  15.871   0.295
    9   2HB   SER   2          1HB       SER   2  -5.567  16.312   0.524
   10    HG   SER   2           HG       SER   2  -7.181  16.965  -1.481
   11    H    LEU   3           H        LEU   3  -5.923  14.597   2.123
   12    HA   LEU   3           HA       LEU   3  -3.395  13.154   2.510
   13   1HB   LEU   3          2HB       LEU   3  -2.805  14.790   4.302
   14   2HB   LEU   3          1HB       LEU   3  -2.752  15.438   2.674
   15    HG   LEU   3           HG       LEU   3  -5.313  15.830   4.077
   16   1HD1  LEU   3          1HD1      LEU   3  -3.177  17.710   4.895
   17   2HD1  LEU   3          2HD1      LEU   3  -3.255  16.156   5.725
   18   3HD1  LEU   3          3HD1      LEU   3  -4.653  17.232   5.734
   19   1HD2  LEU   3          1HD2      LEU   3  -4.140  16.804   1.824
   20   2HD2  LEU   3          2HD2      LEU   3  -3.817  18.097   2.979
   21   3HD2  LEU   3          3HD2      LEU   3  -5.475  17.577   2.680
   22    H    LEU   4           H        LEU   4  -3.127  13.004   5.110
   23    HA   LEU   4           HA       LEU   4  -3.860  12.033   7.031
   24   1HB   LEU   4          2HB       LEU   4  -5.953  13.789   6.255
   25   2HB   LEU   4          1HB       LEU   4  -6.696  12.310   6.830
   26    HG   LEU   4           HG       LEU   4  -6.509  13.875   8.654
   27   1HD1  LEU   4          1HD1      LEU   4  -5.782  11.295   8.781
   28   2HD1  LEU   4          2HD1      LEU   4  -5.841  12.359  10.186
   29   3HD1  LEU   4          3HD1      LEU   4  -4.305  12.052   9.376
   30   1HD2  LEU   4          1HD2      LEU   4  -4.310  14.837   7.451
   31   2HD2  LEU   4          2HD2      LEU   4  -3.558  13.843   8.699
   32   3HD2  LEU   4          3HD2      LEU   4  -4.690  15.119   9.150
   33    H    LYS   5           H        LYS   5  -6.730  11.438   5.022
   34    HA   LYS   5           HA       LYS   5  -6.385   8.572   5.492
   35   1HB   LYS   5          2HB       LYS   5  -8.748  10.012   4.278
   36   2HB   LYS   5          1HB       LYS   5  -8.697   8.338   4.813
   37   1HG   LYS   5          2HG       LYS   5  -8.230   9.218   7.129
   38   2HG   LYS   5          1HG       LYS   5  -8.620  10.821   6.500
   39   1HD   LYS   5          2HD       LYS   5 -10.711  10.280   7.155
   40   2HD   LYS   5          1HD       LYS   5 -10.751   9.417   5.616
   41   1HE   LYS   5          2HE       LYS   5  -9.791   8.109   8.142
   42   2HE   LYS   5          1HE       LYS   5 -11.501   8.156   7.714
   43   1HZ   LYS   5          1HZ       LYS   5  -9.304   6.902   6.164
   44   2HZ   LYS   5          2HZ       LYS   5 -10.878   7.091   5.576
   45   3HZ   LYS   5          3HZ       LYS   5 -10.593   6.119   6.930
   46    HA   PRO   6           HA       PRO   6  -5.029   7.821   1.355
   47   1HB   PRO   6          2HB       PRO   6  -5.804   5.246   1.040
   48   2HB   PRO   6          1HB       PRO   6  -4.454   5.713   2.080
   49   1HG   PRO   6          2HG       PRO   6  -7.280   5.063   2.824
   50   2HG   PRO   6          1HG       PRO   6  -5.772   4.567   3.615
   51   1HD   PRO   6          2HD       PRO   6  -7.311   6.603   4.534
   52   2HD   PRO   6          1HD       PRO   6  -5.547   6.571   4.725
   53    H    ALA   7           H        ALA   7  -6.051   6.362  -0.623
   54    HA   ALA   7           HA       ALA   7  -8.847   6.565  -1.014
   55   1HB   ALA   7          1HB       ALA   7  -8.717   8.339  -2.824
   56   2HB   ALA   7          2HB       ALA   7  -7.148   8.773  -2.145
   57   3HB   ALA   7          3HB       ALA   7  -8.604   8.905  -1.157
   58    H    ARG   8           H        ARG   8  -5.687   6.641  -2.620
   59    HA   ARG   8           HA       ARG   8  -6.733   4.931  -4.753
   60   1HB   ARG   8          2HB       ARG   8  -5.116   7.085  -4.924
   61   2HB   ARG   8          1HB       ARG   8  -3.907   5.813  -4.810
   62   1HG   ARG   8          2HG       ARG   8  -4.791   4.720  -6.755
   63   2HG   ARG   8          1HG       ARG   8  -6.142   5.853  -6.825
   64   1HD   ARG   8          2HD       ARG   8  -4.671   6.683  -8.420
   65   2HD   ARG   8          1HD       ARG   8  -4.325   7.670  -7.002
   66    HE   ARG   8           HE       ARG   8  -2.651   5.349  -7.205
   67   1HH1  ARG   8          1HH1      ARG   8  -3.067   8.657  -8.235
   68   2HH1  ARG   8          2HH1      ARG   8  -1.382   8.903  -8.547
   69   1HH2  ARG   8          1HH2      ARG   8  -0.435   5.670  -7.615
   70   2HH2  ARG   8          2HH2      ARG   8   0.114   7.207  -8.196
   71    H    PHE   9           H        PHE   9  -5.761   2.952  -5.295
   72    HA   PHE   9           HA       PHE   9  -4.018   1.803  -3.216
   73   1HB   PHE   9          2HB       PHE   9  -5.221  -0.400  -3.791
   74   2HB   PHE   9          1HB       PHE   9  -6.082   0.768  -2.795
   75    HD1  PHE   9           1HD      PHE   9  -7.962   2.024  -3.694
   76    HD2  PHE   9           2HD      PHE   9  -5.940  -0.905  -6.025
   77    HE1  PHE   9           1HE      PHE   9  -9.840   1.999  -5.283
   78    HE2  PHE   9           2HE      PHE   9  -7.813  -0.935  -7.621
   79    HZ   PHE   9           HZ       PHE   9  -9.766   0.519  -7.251
   80    H    MET  10           H        MET  10  -2.138   2.055  -4.395
   81    HA   MET  10           HA       MET  10  -1.630   0.049  -6.375
   82   1HB   MET  10          2HB       MET  10  -1.870   2.933  -7.171
   83   2HB   MET  10          1HB       MET  10  -0.748   1.874  -8.014
   84   1HG   MET  10          2HG       MET  10  -2.784   0.321  -8.306
   85   2HG   MET  10          1HG       MET  10  -3.732   1.752  -7.902
   86   1HE   MET  10          1HE       MET  10  -4.998   2.203  -9.618
   87   2HE   MET  10          2HE       MET  10  -4.582   2.574 -11.291
   88   3HE   MET  10          3HE       MET  10  -4.247   3.747 -10.018
   89    H    CYS  11           H        CYS  11   0.334  -0.676  -5.916
   90    HA   CYS  11           HA       CYS  11   2.180   1.009  -4.427
   91   1HB   CYS  11          2HB       CYS  11   1.593  -1.512  -3.983
   92   2HB   CYS  11          1HB       CYS  11   2.803  -1.808  -5.227
   93    H    LEU  12           H        LEU  12   2.856   2.455  -6.003
   94    HA   LEU  12           HA       LEU  12   3.832   1.734  -8.545
   95   1HB   LEU  12          2HB       LEU  12   4.823   4.166  -7.122
   96   2HB   LEU  12          1HB       LEU  12   4.424   3.957  -8.815
   97    HG   LEU  12           HG       LEU  12   2.013   3.563  -7.430
   98   1HD1  LEU  12          1HD1      LEU  12   2.887   6.231  -6.557
   99   2HD1  LEU  12          2HD1      LEU  12   3.568   4.874  -5.660
  100   3HD1  LEU  12          3HD1      LEU  12   1.819   5.069  -5.771
  101   1HD2  LEU  12          1HD2      LEU  12   3.194   5.558  -9.269
  102   2HD2  LEU  12          2HD2      LEU  12   1.720   6.023  -8.419
  103   3HD2  LEU  12          3HD2      LEU  12   1.734   4.582  -9.435
  104    HA   PRO  13           HA       PRO  13   8.215   2.358  -6.078
  105   1HB   PRO  13          2HB       PRO  13   7.148   0.458  -4.015
  106   2HB   PRO  13          1HB       PRO  13   8.430   1.669  -3.866
  107   1HG   PRO  13          2HG       PRO  13   5.981   2.179  -2.958
  108   2HG   PRO  13          1HG       PRO  13   6.931   3.438  -3.769
  109   1HD   PRO  13          2HD       PRO  13   4.567   1.940  -4.736
  110   2HD   PRO  13          1HD       PRO  13   5.148   3.553  -5.197
  111    H    CYS  14           H        CYS  14   6.167  -0.555  -6.180
  112    HA   CYS  14           HA       CYS  14   8.426  -2.013  -7.345
  113   1HB   CYS  14          2HB       CYS  14   7.403  -4.031  -6.495
  114   2HB   CYS  14          1HB       CYS  14   7.628  -2.900  -5.176
  115    H    GLY  15           H        GLY  15   5.066  -1.108  -7.619
  116   1HA   GLY  15          2HA       GLY  15   3.925  -0.845  -9.635
  117   2HA   GLY  15          1HA       GLY  15   5.123  -1.865 -10.397
  118    H    ILE  16           H        ILE  16   2.498  -2.014  -8.016
  119    HA   ILE  16           HA       ILE  16   1.414  -4.353  -9.339
  120    HB   ILE  16           HB       ILE  16   2.070  -4.548  -6.400
  121   1HG1  ILE  16          2HG1      ILE  16   3.518  -5.777  -8.758
  122   2HG1  ILE  16          1HG1      ILE  16   4.157  -4.543  -7.679
  123   1HG2  ILE  16          1HG2      ILE  16   1.348  -6.777  -8.273
  124   2HG2  ILE  16          2HG2      ILE  16   0.115  -5.818  -7.454
  125   3HG2  ILE  16          3HG2      ILE  16   1.282  -6.745  -6.511
  126   1HD1  ILE  16          1HD1      ILE  16   4.552  -7.228  -7.433
  127   2HD1  ILE  16          2HD1      ILE  16   3.239  -6.934  -6.293
  128   3HD1  ILE  16          3HD1      ILE  16   4.752  -6.041  -6.144
  129    H    ALA  17           H        ALA  17  -0.584  -3.588  -9.660
  130    HA   ALA  17           HA       ALA  17  -1.902  -1.947  -7.672
  131   1HB   ALA  17          1HB       ALA  17  -2.003  -1.864 -10.330
  132   2HB   ALA  17          2HB       ALA  17  -3.340  -1.322  -9.316
  133   3HB   ALA  17          3HB       ALA  17  -3.381  -2.927 -10.045
  134    H    PHE  18           H        PHE  18  -2.887  -2.856  -5.992
  135    HA   PHE  18           HA       PHE  18  -3.845  -5.584  -6.135
  136   1HB   PHE  18          2HB       PHE  18  -3.234  -3.611  -4.015
  137   2HB   PHE  18          1HB       PHE  18  -4.480  -4.790  -3.651
  138    HD1  PHE  18           1HD      PHE  18  -3.876  -7.272  -4.011
  139    HD2  PHE  18           2HD      PHE  18  -1.002  -4.142  -3.760
  140    HE1  PHE  18           1HE      PHE  18  -2.132  -8.921  -3.469
  141    HE2  PHE  18           2HE      PHE  18   0.746  -5.786  -3.220
  142    HZ   PHE  18           HZ       PHE  18   0.184  -8.177  -3.074
  143    H    SER  19           H        SER  19  -6.000  -6.180  -5.503
  144    HA   SER  19           HA       SER  19  -7.975  -4.363  -6.581
  145   1HB   SER  19          2HB       SER  19  -7.913  -7.255  -5.854
  146   2HB   SER  19          1HB       SER  19  -9.477  -6.447  -5.944
  147    HG   SER  19           HG       SER  19  -9.211  -7.013  -7.986
  148    H    SER  20           H        SER  20  -6.676  -4.151  -3.721
  149    HA   SER  20           HA       SER  20  -9.017  -3.084  -2.508
  150   1HB   SER  20          2HB       SER  20  -8.031  -5.762  -1.663
  151   2HB   SER  20          1HB       SER  20  -8.579  -4.654  -0.405
  152    HG   SER  20           HG       SER  20 -10.519  -4.428  -1.806
  153    HA   PRO  21           HA       PRO  21  -5.984  -0.732  -0.327
  154   1HB   PRO  21          2HB       PRO  21  -7.369   0.130   1.808
  155   2HB   PRO  21          1HB       PRO  21  -7.752   0.674   0.169
  156   1HG   PRO  21          2HG       PRO  21  -9.099  -1.416   1.836
  157   2HG   PRO  21          1HG       PRO  21  -9.823  -0.166   0.809
  158   1HD   PRO  21          2HD       PRO  21  -9.514  -2.775   0.039
  159   2HD   PRO  21          1HD       PRO  21  -9.565  -1.413  -1.097
  160    H    SER  22           H        SER  22  -7.822  -2.935   1.789
  161    HA   SER  22           HA       SER  22  -5.980  -3.022   3.900
  162   1HB   SER  22          2HB       SER  22  -8.044  -5.005   2.936
  163   2HB   SER  22          1HB       SER  22  -7.062  -5.291   4.373
  164    HG   SER  22           HG       SER  22  -7.881  -3.204   5.119
  165    H    THR  23           H        THR  23  -6.084  -4.683   0.830
  166    HA   THR  23           HA       THR  23  -4.172  -6.680   1.415
  167    HB   THR  23           HB       THR  23  -4.450  -5.525  -1.335
  168    HG1  THR  23           1HG      THR  23  -6.401  -7.120  -0.035
  169   1HG2  THR  23          1HG2      THR  23  -4.406  -7.837  -2.036
  170   2HG2  THR  23          2HG2      THR  23  -4.378  -8.368  -0.355
  171   3HG2  THR  23          3HG2      THR  23  -3.010  -7.476  -1.021
  172    H    LEU  24           H        LEU  24  -3.945  -3.354   0.351
  173    HA   LEU  24           HA       LEU  24  -1.243  -3.319  -0.382
  174   1HB   LEU  24          2HB       LEU  24  -2.505  -0.979   0.984
  175   2HB   LEU  24          1HB       LEU  24  -1.402  -1.005  -0.371
  176    HG   LEU  24           HG       LEU  24  -4.322  -1.726  -0.449
  177   1HD1  LEU  24          1HD1      LEU  24  -3.064   0.498  -1.982
  178   2HD1  LEU  24          2HD1      LEU  24  -3.461   0.738  -0.281
  179   3HD1  LEU  24          3HD1      LEU  24  -4.728   0.310  -1.430
  180   1HD2  LEU  24          1HD2      LEU  24  -3.555  -3.056  -2.126
  181   2HD2  LEU  24          2HD2      LEU  24  -2.107  -2.084  -2.384
  182   3HD2  LEU  24          3HD2      LEU  24  -3.661  -1.536  -3.013
  183    H    GLU  25           H        GLU  25  -2.876  -2.768   2.676
  184    HA   GLU  25           HA       GLU  25  -0.583  -2.144   4.186
  185   1HB   GLU  25          2HB       GLU  25  -3.213  -2.067   4.710
  186   2HB   GLU  25          1HB       GLU  25  -2.826  -3.584   5.509
  187   1HG   GLU  25          2HG       GLU  25  -0.858  -1.717   6.281
  188   2HG   GLU  25          1HG       GLU  25  -2.420  -0.911   6.412
  189    H    ALA  26           H        ALA  26  -1.998  -5.138   3.163
  190    HA   ALA  26           HA       ALA  26  -0.473  -6.788   4.885
  191   1HB   ALA  26          1HB       ALA  26  -2.728  -7.250   3.567
  192   2HB   ALA  26          2HB       ALA  26  -1.625  -8.551   4.013
  193   3HB   ALA  26          3HB       ALA  26  -1.596  -7.892   2.378
  194    H    HIS  27           H        HIS  27  -0.204  -5.517   1.673
  195    HA   HIS  27           HA       HIS  27   2.062  -7.077   0.883
  196   1HB   HIS  27          2HB       HIS  27   0.596  -6.198  -0.815
  197   2HB   HIS  27          1HB       HIS  27   0.777  -4.564  -0.203
  198    HD1  HIS  27           1HD      HIS  27   2.814  -7.223  -2.006
  199    HD2  HIS  27           2HD      HIS  27   2.754  -3.127  -1.323
  200    HE1  HIS  27           1HE      HIS  27   4.591  -6.225  -3.508
  201    H    GLN  28           H        GLN  28   1.536  -3.750   1.921
  202    HA   GLN  28           HA       GLN  28   4.280  -3.025   1.983
  203   1HB   GLN  28          2HB       GLN  28   1.737  -1.788   2.521
  204   2HB   GLN  28          1HB       GLN  28   2.856  -1.417   3.824
  205   1HG   GLN  28          2HG       GLN  28   3.844  -1.115   1.052
  206   2HG   GLN  28          1HG       GLN  28   2.663   0.059   1.631
  207   1HE2  GLN  28          1HE2      GLN  28   5.905  -1.058   1.813
  208   2HE2  GLN  28          2HE2      GLN  28   6.499   0.161   2.884
  209    H    ALA  29           H        ALA  29   2.357  -4.957   4.010
  210    HA   ALA  29           HA       ALA  29   3.652  -4.401   6.490
  211   1HB   ALA  29          1HB       ALA  29   1.736  -6.469   5.520
  212   2HB   ALA  29          2HB       ALA  29   1.552  -5.276   6.806
  213   3HB   ALA  29          3HB       ALA  29   2.561  -6.700   7.061
  214    H    TYR  30           H        TYR  30   3.844  -7.216   4.269
  215    HA   TYR  30           HA       TYR  30   6.600  -7.599   5.193
  216   1HB   TYR  30          2HB       TYR  30   4.339  -9.507   5.461
  217   2HB   TYR  30          1HB       TYR  30   5.913 -10.168   5.036
  218    HD1  TYR  30           1HD      TYR  30   3.882  -8.719   7.661
  219    HD2  TYR  30           2HD      TYR  30   7.835  -9.867   6.587
  220    HE1  TYR  30           1HE      TYR  30   4.537  -8.654  10.030
  221    HE2  TYR  30           2HE      TYR  30   8.502  -9.806   8.954
  222    HH   TYR  30           HH       TYR  30   7.565  -8.483  11.097
  223    H    TYR  31           H        TYR  31   4.809  -7.028   2.554
  224    HA   TYR  31           HA       TYR  31   6.111  -9.016   0.852
  225   1HB   TYR  31          2HB       TYR  31   3.647  -7.667   0.741
  226   2HB   TYR  31          1HB       TYR  31   4.586  -7.072  -0.620
  227    HD1  TYR  31           1HD      TYR  31   2.825  -9.915   0.803
  228    HD2  TYR  31           2HD      TYR  31   5.366  -8.641  -2.364
  229    HE1  TYR  31           1HE      TYR  31   2.271 -11.954  -0.454
  230    HE2  TYR  31           2HE      TYR  31   4.817 -10.677  -3.630
  231    HH   TYR  31           HH       TYR  31   2.261 -12.756  -2.751
  232    H    CYS  32           H        CYS  32   5.510  -5.555   0.272
  233    HA   CYS  32           HA       CYS  32   7.721  -5.183  -1.378
  234   1HB   CYS  32          2HB       CYS  32   5.618  -3.613  -0.505
  235   2HB   CYS  32          1HB       CYS  32   7.028  -2.795   0.158
  236    H    SER  33           H        SER  33   9.811  -5.271  -0.957
  237    HA   SER  33           HA       SER  33  11.772  -5.415   0.210
  238   1HB   SER  33          2HB       SER  33  10.787  -2.906   1.572
  239   2HB   SER  33          1HB       SER  33  12.454  -3.362   1.223
  240    HG   SER  33           HG       SER  33  12.117  -2.175  -0.490
  241    H    HIS  34           H        HIS  34  12.587  -4.684   2.719
  242    HA   HIS  34           HA       HIS  34  10.884  -6.323   4.479
  243   1HB   HIS  34          2HB       HIS  34  13.904  -6.147   4.497
  244   2HB   HIS  34          1HB       HIS  34  12.921  -7.125   5.581
  245    HD1  HIS  34           1HD      HIS  34  14.624  -7.218   2.363
  246    HD2  HIS  34           2HD      HIS  34  11.501  -9.267   4.184
  247    HE1  HIS  34           1HE      HIS  34  14.324  -9.320   1.018
  248    HE2  HIS  34           2HE      HIS  34  12.490 -10.587   2.193
  249    H    ARG  35           H        ARG  35   9.836  -4.507   5.340
  250    HA   ARG  35           HA       ARG  35  11.357  -2.370   6.535
  251   1HB   ARG  35          2HB       ARG  35   9.211  -1.846   5.556
  252   2HB   ARG  35          1HB       ARG  35   8.408  -3.032   6.577
  253   1HG   ARG  35          2HG       ARG  35   8.262  -1.621   8.305
  254   2HG   ARG  35          1HG       ARG  35   9.897  -1.003   8.066
  255   1HD   ARG  35          2HD       ARG  35   9.202   0.590   6.520
  256   2HD   ARG  35          1HD       ARG  35   7.693  -0.257   6.182
  257    HE   ARG  35           HE       ARG  35   8.188   1.631   8.293
  258   1HH1  ARG  35          1HH1      ARG  35   6.194  -1.034   7.246
  259   2HH1  ARG  35          2HH1      ARG  35   4.857  -0.592   8.253
  260   1HH2  ARG  35          1HH2      ARG  35   6.431   2.215   9.617
  261   2HH2  ARG  35          2HH2      ARG  35   4.991   1.252   9.599
  262    H    ILE  36           H        ILE  36  11.851  -2.081   8.647
  263    HA   ILE  36           HA       ILE  36  10.897  -4.097  10.569
  264    HB   ILE  36           HB       ILE  36  13.198  -4.648   9.912
  265   1HG1  ILE  36          2HG1      ILE  36  13.636  -3.583  12.635
  266   2HG1  ILE  36          1HG1      ILE  36  12.190  -4.568  12.430
  267   1HG2  ILE  36          1HG2      ILE  36  14.361  -2.289  11.238
  268   2HG2  ILE  36          2HG2      ILE  36  13.615  -1.999   9.666
  269   3HG2  ILE  36          3HG2      ILE  36  14.911  -3.187   9.822
  270   1HD1  ILE  36          1HD1      ILE  36  13.389  -6.424  12.462
  271   2HD1  ILE  36          2HD1      ILE  36  14.800  -5.444  12.860
  272   3HD1  ILE  36          3HD1      ILE  36  14.442  -5.830  11.177
  Start of MODEL   19
    1   1H    GLY   1          1HT       GLY   1 -10.554  13.249  -0.964
    2   2H    GLY   1          2HT       GLY   1 -11.230  13.072   0.576
    3   3H    GLY   1          3HT       GLY   1 -11.690  12.029  -0.673
    4   1HA   GLY   1          1HA       GLY   1  -9.865  11.414   1.168
    5   2HA   GLY   1          2HA       GLY   1  -9.920  10.704  -0.439
    6    H    SER   2           H        SER   2  -8.245  12.845   1.695
    7    HA   SER   2           HA       SER   2  -5.821  12.620   0.274
    8   1HB   SER   2          2HB       SER   2  -6.974  14.211  -1.253
    9   2HB   SER   2          1HB       SER   2  -7.127  15.346   0.088
   10    HG   SER   2           HG       SER   2  -5.288  15.761  -1.237
   11    H    LEU   3           H        LEU   3  -4.079  13.331   1.473
   12    HA   LEU   3           HA       LEU   3  -2.914  13.950   3.323
   13   1HB   LEU   3          2HB       LEU   3  -3.684  16.182   2.856
   14   2HB   LEU   3          1HB       LEU   3  -5.235  15.854   3.604
   15    HG   LEU   3           HG       LEU   3  -4.107  15.627   5.797
   16   1HD1  LEU   3          1HD1      LEU   3  -1.833  15.213   4.395
   17   2HD1  LEU   3          2HD1      LEU   3  -1.881  15.692   6.091
   18   3HD1  LEU   3          3HD1      LEU   3  -1.643  16.910   4.837
   19   1HD2  LEU   3          1HD2      LEU   3  -3.417  18.243   4.476
   20   2HD2  LEU   3          2HD2      LEU   3  -3.811  17.954   6.170
   21   3HD2  LEU   3          3HD2      LEU   3  -5.058  17.787   4.935
   22    H    LEU   4           H        LEU   4  -2.656  12.731   5.062
   23    HA   LEU   4           HA       LEU   4  -3.063  11.558   6.969
   24   1HB   LEU   4          2HB       LEU   4  -4.881  13.733   7.075
   25   2HB   LEU   4          1HB       LEU   4  -5.754  12.305   7.597
   26    HG   LEU   4           HG       LEU   4  -4.717  13.580   9.458
   27   1HD1  LEU   4          1HD1      LEU   4  -4.214  10.728   8.885
   28   2HD1  LEU   4          2HD1      LEU   4  -5.082  11.485  10.221
   29   3HD1  LEU   4          3HD1      LEU   4  -3.318  11.432  10.232
   30   1HD2  LEU   4          1HD2      LEU   4  -2.586  13.896   7.843
   31   2HD2  LEU   4          2HD2      LEU   4  -2.037  12.535   8.821
   32   3HD2  LEU   4          3HD2      LEU   4  -2.514  14.044   9.599
   33    H    LYS   5           H        LYS   5  -6.343  11.825   5.599
   34    HA   LYS   5           HA       LYS   5  -6.803   9.019   5.930
   35   1HB   LYS   5          2HB       LYS   5  -8.362  11.372   5.263
   36   2HB   LYS   5          1HB       LYS   5  -8.788  10.014   4.232
   37   1HG   LYS   5          2HG       LYS   5  -8.607   9.645   7.189
   38   2HG   LYS   5          1HG       LYS   5 -10.042  10.376   6.466
   39   1HD   LYS   5          2HD       LYS   5  -9.519   8.138   4.894
   40   2HD   LYS   5          1HD       LYS   5  -9.219   7.601   6.548
   41   1HE   LYS   5          2HE       LYS   5 -11.399   8.059   7.223
   42   2HE   LYS   5          1HE       LYS   5 -11.692   9.148   5.868
   43   1HZ   LYS   5          1HZ       LYS   5 -12.771   7.368   5.058
   44   2HZ   LYS   5          2HZ       LYS   5 -11.911   6.258   6.000
   45   3HZ   LYS   5          3HZ       LYS   5 -11.226   6.869   4.579
   46    HA   PRO   6           HA       PRO   6  -5.138   7.779   1.996
   47   1HB   PRO   6          2HB       PRO   6  -6.079   5.252   1.925
   48   2HB   PRO   6          1HB       PRO   6  -4.771   5.739   3.009
   49   1HG   PRO   6          2HG       PRO   6  -7.683   5.378   3.599
   50   2HG   PRO   6          1HG       PRO   6  -6.277   4.869   4.552
   51   1HD   PRO   6          2HD       PRO   6  -7.718   7.110   5.108
   52   2HD   PRO   6          1HD       PRO   6  -5.988   6.956   5.471
   53    H    ALA   7           H        ALA   7  -5.798   7.434  -0.134
   54    HA   ALA   7           HA       ALA   7  -8.578   6.998  -0.768
   55   1HB   ALA   7          1HB       ALA   7  -9.211   9.057  -1.435
   56   2HB   ALA   7          2HB       ALA   7  -7.600   9.486  -2.011
   57   3HB   ALA   7          3HB       ALA   7  -7.976   9.581  -0.290
   58    H    ARG   8           H        ARG   8  -6.072   5.679  -1.313
   59    HA   ARG   8           HA       ARG   8  -6.343   5.458  -4.184
   60   1HB   ARG   8          2HB       ARG   8  -4.338   7.118  -3.156
   61   2HB   ARG   8          1HB       ARG   8  -3.513   5.625  -3.583
   62   1HG   ARG   8          2HG       ARG   8  -5.198   6.166  -5.738
   63   2HG   ARG   8          1HG       ARG   8  -4.509   7.724  -5.280
   64   1HD   ARG   8          2HD       ARG   8  -2.283   6.887  -5.511
   65   2HD   ARG   8          1HD       ARG   8  -2.867   5.236  -5.711
   66    HE   ARG   8           HE       ARG   8  -3.287   5.683  -7.919
   67   1HH1  ARG   8          1HH1      ARG   8  -2.769   8.693  -6.229
   68   2HH1  ARG   8          2HH1      ARG   8  -2.729   9.643  -7.676
   69   1HH2  ARG   8          1HH2      ARG   8  -3.235   6.931  -9.823
   70   2HH2  ARG   8          2HH2      ARG   8  -2.994   8.643  -9.717
   71    H    PHE   9           H        PHE   9  -5.009   3.641  -5.048
   72    HA   PHE   9           HA       PHE   9  -4.012   1.724  -3.129
   73   1HB   PHE   9          2HB       PHE   9  -5.610  -0.044  -4.259
   74   2HB   PHE   9          1HB       PHE   9  -6.153   0.907  -2.882
   75    HD1  PHE   9           1HD      PHE   9  -7.839   2.601  -3.127
   76    HD2  PHE   9           2HD      PHE   9  -6.446   0.409  -6.499
   77    HE1  PHE   9           1HE      PHE   9  -9.750   3.419  -4.444
   78    HE2  PHE   9           2HE      PHE   9  -8.354   1.225  -7.822
   79    HZ   PHE   9           HZ       PHE   9 -10.008   2.731  -6.795
   80    H    MET  10           H        MET  10  -2.103   2.135  -4.373
   81    HA   MET  10           HA       MET  10  -1.749   0.266  -6.500
   82   1HB   MET  10          2HB       MET  10  -2.744   2.630  -7.383
   83   2HB   MET  10          1HB       MET  10  -1.019   2.966  -7.454
   84   1HG   MET  10          2HG       MET  10  -0.632   1.317  -9.033
   85   2HG   MET  10          1HG       MET  10  -2.126   0.464  -8.652
   86   1HE   MET  10          1HE       MET  10  -0.438   1.854 -11.206
   87   2HE   MET  10          2HE       MET  10  -0.606   3.561 -10.798
   88   3HE   MET  10          3HE       MET  10  -1.477   2.895 -12.179
   89    H    CYS  11           H        CYS  11   0.222  -0.523  -6.242
   90    HA   CYS  11           HA       CYS  11   2.203   1.053  -4.777
   91   1HB   CYS  11          2HB       CYS  11   1.440  -1.498  -4.389
   92   2HB   CYS  11          1HB       CYS  11   2.770  -1.764  -5.510
   93    H    LEU  12           H        LEU  12   2.968   2.415  -6.373
   94    HA   LEU  12           HA       LEU  12   3.811   1.501  -8.934
   95   1HB   LEU  12          2HB       LEU  12   4.852   4.022  -7.716
   96   2HB   LEU  12          1HB       LEU  12   4.419   3.692  -9.381
   97    HG   LEU  12           HG       LEU  12   2.064   3.460  -7.770
   98   1HD1  LEU  12          1HD1      LEU  12   2.952   6.257  -7.579
   99   2HD1  LEU  12          2HD1      LEU  12   3.738   5.133  -6.472
  100   3HD1  LEU  12          3HD1      LEU  12   1.982   5.291  -6.468
  101   1HD2  LEU  12          1HD2      LEU  12   3.011   5.281  -9.962
  102   2HD2  LEU  12          2HD2      LEU  12   1.413   5.440  -9.234
  103   3HD2  LEU  12          3HD2      LEU  12   1.863   3.946 -10.056
  104    HA   PRO  13           HA       PRO  13   8.243   2.254  -6.602
  105   1HB   PRO  13          2HB       PRO  13   7.199   0.544  -4.368
  106   2HB   PRO  13          1HB       PRO  13   8.492   1.751  -4.344
  107   1HG   PRO  13          2HG       PRO  13   6.067   2.357  -3.433
  108   2HG   PRO  13          1HG       PRO  13   7.010   3.537  -4.363
  109   1HD   PRO  13          2HD       PRO  13   4.618   1.982  -5.158
  110   2HD   PRO  13          1HD       PRO  13   5.196   3.550  -5.755
  111    H    CYS  14           H        CYS  14   6.122  -0.590  -6.518
  112    HA   CYS  14           HA       CYS  14   8.347  -2.204  -7.531
  113   1HB   CYS  14          2HB       CYS  14   7.235  -4.123  -6.561
  114   2HB   CYS  14          1HB       CYS  14   7.486  -2.911  -5.321
  115    H    GLY  15           H        GLY  15   5.058  -1.152  -7.966
  116   1HA   GLY  15          2HA       GLY  15   3.934  -1.023  -9.994
  117   2HA   GLY  15          1HA       GLY  15   5.123  -2.112 -10.673
  118    H    ILE  16           H        ILE  16   2.530  -2.109  -8.243
  119    HA   ILE  16           HA       ILE  16   1.371  -4.471  -9.469
  120    HB   ILE  16           HB       ILE  16   2.060  -4.554  -6.535
  121   1HG1  ILE  16          2HG1      ILE  16   3.472  -5.898  -8.852
  122   2HG1  ILE  16          1HG1      ILE  16   4.133  -4.616  -7.843
  123   1HG2  ILE  16          1HG2      ILE  16   0.526  -6.233  -8.382
  124   2HG2  ILE  16          2HG2      ILE  16   0.433  -6.094  -6.627
  125   3HG2  ILE  16          3HG2      ILE  16   1.668  -7.114  -7.366
  126   1HD1  ILE  16          1HD1      ILE  16   4.901  -6.965  -7.344
  127   2HD1  ILE  16          2HD1      ILE  16   3.277  -7.263  -6.724
  128   3HD1  ILE  16          3HD1      ILE  16   4.294  -6.031  -5.975
  129    H    ALA  17           H        ALA  17  -0.628  -3.713  -9.783
  130    HA   ALA  17           HA       ALA  17  -1.888  -1.952  -7.861
  131   1HB   ALA  17          1HB       ALA  17  -2.448  -2.835 -10.627
  132   2HB   ALA  17          2HB       ALA  17  -2.530  -1.227  -9.910
  133   3HB   ALA  17          3HB       ALA  17  -3.837  -2.381  -9.640
  134    H    PHE  18           H        PHE  18  -2.836  -2.769  -6.111
  135    HA   PHE  18           HA       PHE  18  -3.890  -5.476  -6.136
  136   1HB   PHE  18          2HB       PHE  18  -3.055  -3.510  -4.085
  137   2HB   PHE  18          1HB       PHE  18  -4.329  -4.624  -3.632
  138    HD1  PHE  18           1HD      PHE  18  -3.845  -7.151  -4.119
  139    HD2  PHE  18           2HD      PHE  18  -0.859  -4.132  -3.819
  140    HE1  PHE  18           1HE      PHE  18  -2.154  -8.875  -3.644
  141    HE2  PHE  18           2HE      PHE  18   0.837  -5.850  -3.345
  142    HZ   PHE  18           HZ       PHE  18   0.192  -8.224  -3.258
  143    H    SER  19           H        SER  19  -6.018  -5.998  -5.852
  144    HA   SER  19           HA       SER  19  -7.939  -3.909  -6.430
  145   1HB   SER  19          2HB       SER  19  -8.630  -6.794  -5.941
  146   2HB   SER  19          1HB       SER  19  -9.445  -5.622  -6.976
  147    HG   SER  19           HG       SER  19  -8.135  -6.123  -8.540
  148    H    SER  20           H        SER  20  -6.656  -3.949  -3.743
  149    HA   SER  20           HA       SER  20  -9.027  -3.521  -2.229
  150   1HB   SER  20          2HB       SER  20  -7.586  -6.081  -1.947
  151   2HB   SER  20          1HB       SER  20  -7.980  -5.264  -0.433
  152    HG   SER  20           HG       SER  20 -10.176  -5.102  -1.360
  153    HA   PRO  21           HA       PRO  21  -6.180  -0.861  -0.132
  154   1HB   PRO  21          2HB       PRO  21  -7.653  -0.176   2.012
  155   2HB   PRO  21          1HB       PRO  21  -8.060   0.375   0.384
  156   1HG   PRO  21          2HG       PRO  21  -9.251  -1.856   1.982
  157   2HG   PRO  21          1HG       PRO  21 -10.061  -0.651   0.965
  158   1HD   PRO  21          2HD       PRO  21  -9.522  -3.209   0.153
  159   2HD   PRO  21          1HD       PRO  21  -9.672  -1.834  -0.957
  160    H    SER  22           H        SER  22  -7.835  -3.220   1.973
  161    HA   SER  22           HA       SER  22  -5.934  -3.182   4.047
  162   1HB   SER  22          2HB       SER  22  -7.631  -5.561   3.263
  163   2HB   SER  22          1HB       SER  22  -6.996  -5.172   4.862
  164    HG   SER  22           HG       SER  22  -8.337  -3.258   4.763
  165    H    THR  23           H        THR  23  -6.105  -4.947   1.025
  166    HA   THR  23           HA       THR  23  -4.075  -6.826   1.554
  167    HB   THR  23           HB       THR  23  -4.557  -5.690  -1.186
  168    HG1  THR  23           1HG      THR  23  -6.264  -7.472   0.211
  169   1HG2  THR  23          1HG2      THR  23  -4.421  -8.071  -1.841
  170   2HG2  THR  23          2HG2      THR  23  -4.016  -8.467  -0.171
  171   3HG2  THR  23          3HG2      THR  23  -2.938  -7.445  -1.122
  172    H    LEU  24           H        LEU  24  -4.027  -3.506   0.452
  173    HA   LEU  24           HA       LEU  24  -1.360  -3.361  -0.384
  174   1HB   LEU  24          2HB       LEU  24  -2.649  -1.063   1.024
  175   2HB   LEU  24          1HB       LEU  24  -1.618  -1.060  -0.386
  176    HG   LEU  24           HG       LEU  24  -4.506  -1.906  -0.318
  177   1HD1  LEU  24          1HD1      LEU  24  -4.584   0.108  -1.954
  178   2HD1  LEU  24          2HD1      LEU  24  -3.091   0.589  -1.146
  179   3HD1  LEU  24          3HD1      LEU  24  -4.576   0.396  -0.214
  180   1HD2  LEU  24          1HD2      LEU  24  -3.720  -3.197  -2.029
  181   2HD2  LEU  24          2HD2      LEU  24  -2.381  -2.107  -2.383
  182   3HD2  LEU  24          3HD2      LEU  24  -4.015  -1.693  -2.900
  183    H    GLU  25           H        GLU  25  -2.892  -2.858   2.735
  184    HA   GLU  25           HA       GLU  25  -0.550  -2.147   4.142
  185   1HB   GLU  25          2HB       GLU  25  -3.160  -2.104   4.763
  186   2HB   GLU  25          1HB       GLU  25  -2.717  -3.598   5.573
  187   1HG   GLU  25          2HG       GLU  25  -0.794  -1.559   6.169
  188   2HG   GLU  25          1HG       GLU  25  -2.421  -0.972   6.504
  189    H    ALA  26           H        ALA  26  -1.927  -5.178   3.192
  190    HA   ALA  26           HA       ALA  26  -0.334  -6.777   4.898
  191   1HB   ALA  26          1HB       ALA  26  -2.596  -7.271   3.521
  192   2HB   ALA  26          2HB       ALA  26  -1.525  -8.535   4.126
  193   3HB   ALA  26          3HB       ALA  26  -1.403  -8.005   2.449
  194    H    HIS  27           H        HIS  27  -0.162  -5.541   1.663
  195    HA   HIS  27           HA       HIS  27   2.142  -7.036   0.857
  196   1HB   HIS  27          2HB       HIS  27   0.633  -6.217  -0.831
  197   2HB   HIS  27          1HB       HIS  27   0.775  -4.571  -0.238
  198    HD1  HIS  27           1HD      HIS  27   2.974  -7.201  -1.913
  199    HD2  HIS  27           2HD      HIS  27   2.603  -3.085  -1.499
  200    HE1  HIS  27           1HE      HIS  27   4.689  -6.173  -3.462
  201    H    GLN  28           H        GLN  28   1.511  -3.717   1.874
  202    HA   GLN  28           HA       GLN  28   4.216  -2.873   1.880
  203   1HB   GLN  28          2HB       GLN  28   1.618  -1.777   2.575
  204   2HB   GLN  28          1HB       GLN  28   2.850  -1.283   3.729
  205   1HG   GLN  28          2HG       GLN  28   3.946  -0.995   1.143
  206   2HG   GLN  28          1HG       GLN  28   2.333  -0.285   1.119
  207   1HE2  GLN  28          1HE2      GLN  28   5.172   0.802   1.125
  208   2HE2  GLN  28          2HE2      GLN  28   5.148   2.014   2.357
  209    H    ALA  29           H        ALA  29   2.458  -4.895   3.980
  210    HA   ALA  29           HA       ALA  29   3.963  -4.238   6.356
  211   1HB   ALA  29          1HB       ALA  29   1.754  -6.117   5.701
  212   2HB   ALA  29          2HB       ALA  29   1.850  -4.874   6.948
  213   3HB   ALA  29          3HB       ALA  29   2.715  -6.398   7.152
  214    H    TYR  30           H        TYR  30   3.819  -7.027   4.112
  215    HA   TYR  30           HA       TYR  30   6.426  -7.847   5.211
  216   1HB   TYR  30          2HB       TYR  30   3.986  -9.491   4.673
  217   2HB   TYR  30          1HB       TYR  30   5.580 -10.231   4.582
  218    HD1  TYR  30           1HD      TYR  30   2.904  -9.299   6.726
  219    HD2  TYR  30           2HD      TYR  30   7.105  -9.961   6.654
  220    HE1  TYR  30           1HE      TYR  30   2.893  -9.597   9.166
  221    HE2  TYR  30           2HE      TYR  30   7.106 -10.263   9.094
  222    HH   TYR  30           HH       TYR  30   4.955 -11.052  10.851
  223    H    TYR  31           H        TYR  31   4.786  -6.943   2.400
  224    HA   TYR  31           HA       TYR  31   6.500  -8.569   0.679
  225   1HB   TYR  31          2HB       TYR  31   3.977  -7.088   0.298
  226   2HB   TYR  31          1HB       TYR  31   5.089  -7.037  -1.064
  227    HD1  TYR  31           1HD      TYR  31   3.026  -9.219   1.059
  228    HD2  TYR  31           2HD      TYR  31   5.535  -9.006  -2.371
  229    HE1  TYR  31           1HE      TYR  31   2.257 -11.448   0.366
  230    HE2  TYR  31           2HE      TYR  31   4.772 -11.236  -3.074
  231    HH   TYR  31           HH       TYR  31   2.102 -12.817  -1.598
  232    H    CYS  32           H        CYS  32   5.500  -5.224   0.065
  233    HA   CYS  32           HA       CYS  32   7.966  -4.511  -1.063
  234   1HB   CYS  32          2HB       CYS  32   5.441  -3.274  -0.645
  235   2HB   CYS  32          1HB       CYS  32   6.675  -2.172  -0.043
  236    H    SER  33           H        SER  33   9.838  -4.458  -0.028
  237    HA   SER  33           HA       SER  33  11.461  -3.778   1.426
  238   1HB   SER  33          2HB       SER  33   9.694  -1.727   1.628
  239   2HB   SER  33          1HB       SER  33   9.670  -2.332   3.284
  240    HG   SER  33           HG       SER  33  12.009  -1.644   1.829
  241    H    HIS  34           H        HIS  34  12.274  -5.272   2.719
  242    HA   HIS  34           HA       HIS  34  10.537  -6.852   4.414
  243   1HB   HIS  34          2HB       HIS  34  13.515  -7.024   3.903
  244   2HB   HIS  34          1HB       HIS  34  12.590  -8.175   4.862
  245    HD1  HIS  34           1HD      HIS  34  12.577  -6.808   1.308
  246    HD2  HIS  34           2HD      HIS  34  11.689 -10.277   3.417
  247    HE1  HIS  34           1HE      HIS  34  11.970  -8.516  -0.433
  248    HE2  HIS  34           2HE      HIS  34  11.534 -10.634   0.860
  249    H    ARG  35           H        ARG  35  10.269  -4.509   5.485
  250    HA   ARG  35           HA       ARG  35  12.252  -3.686   7.330
  251   1HB   ARG  35          2HB       ARG  35   9.379  -3.062   6.864
  252   2HB   ARG  35          1HB       ARG  35  10.062  -2.632   8.424
  253   1HG   ARG  35          2HG       ARG  35  11.939  -1.536   6.983
  254   2HG   ARG  35          1HG       ARG  35  10.711  -1.575   5.716
  255   1HD   ARG  35          2HD       ARG  35   9.490  -0.610   8.089
  256   2HD   ARG  35          1HD       ARG  35  11.001   0.269   7.863
  257    HE   ARG  35           HE       ARG  35  10.072   1.325   6.062
  258   1HH1  ARG  35          1HH1      ARG  35   8.151  -1.489   6.818
  259   2HH1  ARG  35          2HH1      ARG  35   6.898  -1.091   5.690
  260   1HH2  ARG  35          1HH2      ARG  35   8.425   1.849   4.577
  261   2HH2  ARG  35          2HH2      ARG  35   7.054   0.802   4.417
  262    H    ILE  36           H        ILE  36  12.372  -3.961   9.570
  263    HA   ILE  36           HA       ILE  36  11.570  -6.546  10.503
  264    HB   ILE  36           HB       ILE  36  13.713  -5.551  11.174
  265   1HG1  ILE  36          2HG1      ILE  36  11.962  -5.855  13.615
  266   2HG1  ILE  36          1HG1      ILE  36  12.435  -7.223  12.612
  267   1HG2  ILE  36          1HG2      ILE  36  13.957  -3.589  12.297
  268   2HG2  ILE  36          2HG2      ILE  36  12.398  -3.728  13.108
  269   3HG2  ILE  36          3HG2      ILE  36  12.472  -3.219  11.421
  270   1HD1  ILE  36          1HD1      ILE  36  14.000  -7.267  14.297
  271   2HD1  ILE  36          2HD1      ILE  36  14.110  -5.509  14.386
  272   3HD1  ILE  36          3HD1      ILE  36  14.843  -6.372  13.033
  Start of MODEL   20
    1   1H    GLY   1          1HT       GLY   1 -11.267  11.518  -0.219
    2   2H    GLY   1          2HT       GLY   1 -10.710  12.923   0.540
    3   3H    GLY   1          3HT       GLY   1 -10.715  11.454   1.379
    4   1HA   GLY   1          1HA       GLY   1  -8.813  10.736   0.464
    5   2HA   GLY   1          2HA       GLY   1  -9.227  11.421  -1.100
    6    H    SER   2           H        SER   2  -7.937  12.992  -1.750
    7    HA   SER   2           HA       SER   2  -6.500  14.750  -1.762
    8   1HB   SER   2          2HB       SER   2  -7.859  15.304   0.881
    9   2HB   SER   2          1HB       SER   2  -6.691  16.399   0.142
   10    HG   SER   2           HG       SER   2  -9.137  16.574  -0.283
   11    H    LEU   3           H        LEU   3  -6.422  14.241   1.747
   12    HA   LEU   3           HA       LEU   3  -3.807  12.973   1.547
   13   1HB   LEU   3          2HB       LEU   3  -2.834  14.562   3.190
   14   2HB   LEU   3          1HB       LEU   3  -3.179  15.276   1.626
   15    HG   LEU   3           HG       LEU   3  -5.484  15.757   3.111
   16   1HD1  LEU   3          1HD1      LEU   3  -3.029  15.933   4.818
   17   2HD1  LEU   3          2HD1      LEU   3  -4.614  15.267   5.210
   18   3HD1  LEU   3          3HD1      LEU   3  -4.399  17.012   5.076
   19   1HD2  LEU   3          1HD2      LEU   3  -3.193  17.308   2.070
   20   2HD2  LEU   3          2HD2      LEU   3  -4.214  18.108   3.267
   21   3HD2  LEU   3          3HD2      LEU   3  -4.921  17.494   1.772
   22    H    LEU   4           H        LEU   4  -2.991  12.733   4.013
   23    HA   LEU   4           HA       LEU   4  -3.296  11.716   6.024
   24   1HB   LEU   4          2HB       LEU   4  -5.398  13.537   5.836
   25   2HB   LEU   4          1HB       LEU   4  -6.168  12.032   6.300
   26    HG   LEU   4           HG       LEU   4  -5.584  13.421   8.241
   27   1HD1  LEU   4          1HD1      LEU   4  -5.343  10.755   8.011
   28   2HD1  LEU   4          2HD1      LEU   4  -5.096  11.632   9.521
   29   3HD1  LEU   4          3HD1      LEU   4  -3.710  11.167   8.535
   30   1HD2  LEU   4          1HD2      LEU   4  -3.313  14.041   6.879
   31   2HD2  LEU   4          2HD2      LEU   4  -2.711  12.870   8.050
   32   3HD2  LEU   4          3HD2      LEU   4  -3.558  14.314   8.603
   33    H    LYS   5           H        LYS   5  -6.484  11.146   4.544
   34    HA   LYS   5           HA       LYS   5  -6.248   8.315   5.089
   35   1HB   LYS   5          2HB       LYS   5  -8.377  10.151   4.752
   36   2HB   LYS   5          1HB       LYS   5  -8.538   8.950   3.477
   37   1HG   LYS   5          2HG       LYS   5  -7.978   7.487   5.784
   38   2HG   LYS   5          1HG       LYS   5  -9.117   8.735   6.289
   39   1HD   LYS   5          2HD       LYS   5 -10.532   8.069   4.302
   40   2HD   LYS   5          1HD       LYS   5  -9.465   6.674   4.120
   41   1HE   LYS   5          2HE       LYS   5 -10.923   5.658   5.491
   42   2HE   LYS   5          1HE       LYS   5 -10.073   6.533   6.763
   43   1HZ   LYS   5          1HZ       LYS   5 -11.857   8.358   5.987
   44   2HZ   LYS   5          2HZ       LYS   5 -12.129   7.258   7.241
   45   3HZ   LYS   5          3HZ       LYS   5 -12.737   6.943   5.695
   46    HA   PRO   6           HA       PRO   6  -4.823   7.054   1.111
   47   1HB   PRO   6          2HB       PRO   6  -5.979   4.613   0.876
   48   2HB   PRO   6          1HB       PRO   6  -4.636   4.932   1.981
   49   1HG   PRO   6          2HG       PRO   6  -7.570   4.776   2.560
   50   2HG   PRO   6          1HG       PRO   6  -6.209   4.105   3.480
   51   1HD   PRO   6          2HD       PRO   6  -7.458   6.404   4.184
   52   2HD   PRO   6          1HD       PRO   6  -5.732   6.122   4.485
   53    H    ALA   7           H        ALA   7  -5.472   7.827  -0.787
   54    HA   ALA   7           HA       ALA   7  -8.322   7.909  -1.420
   55   1HB   ALA   7          1HB       ALA   7  -7.580   9.374  -3.308
   56   2HB   ALA   7          2HB       ALA   7  -5.937   9.245  -2.682
   57   3HB   ALA   7          3HB       ALA   7  -7.198   9.992  -1.702
   58    H    ARG   8           H        ARG   8  -5.278   6.953  -3.011
   59    HA   ARG   8           HA       ARG   8  -6.848   5.162  -4.741
   60   1HB   ARG   8          2HB       ARG   8  -4.948   7.093  -5.414
   61   2HB   ARG   8          1HB       ARG   8  -4.100   5.562  -5.584
   62   1HG   ARG   8          2HG       ARG   8  -5.755   4.755  -7.127
   63   2HG   ARG   8          1HG       ARG   8  -6.747   6.193  -6.870
   64   1HD   ARG   8          2HD       ARG   8  -5.505   6.365  -8.955
   65   2HD   ARG   8          1HD       ARG   8  -4.965   7.585  -7.804
   66    HE   ARG   8           HE       ARG   8  -3.400   5.175  -7.759
   67   1HH1  ARG   8          1HH1      ARG   8  -3.817   8.289  -9.276
   68   2HH1  ARG   8          2HH1      ARG   8  -2.169   8.398  -9.793
   69   1HH2  ARG   8          1HH2      ARG   8  -1.231   5.315  -8.439
   70   2HH2  ARG   8          2HH2      ARG   8  -0.700   6.709  -9.319
   71    H    PHE   9           H        PHE   9  -5.487   3.223  -5.512
   72    HA   PHE   9           HA       PHE   9  -3.820   2.168  -3.339
   73   1HB   PHE   9          2HB       PHE   9  -5.061  -0.091  -3.889
   74   2HB   PHE   9          1HB       PHE   9  -5.750   1.054  -2.743
   75    HD1  PHE   9           1HD      PHE   9  -7.758   2.259  -3.244
   76    HD2  PHE   9           2HD      PHE   9  -6.018  -0.351  -6.120
   77    HE1  PHE   9           1HE      PHE   9  -9.828   2.348  -4.570
   78    HE2  PHE   9           2HE      PHE   9  -8.085  -0.265  -7.452
   79    HZ   PHE   9           HZ       PHE   9  -9.993   1.085  -6.678
   80    H    MET  10           H        MET  10  -1.936   2.191  -4.465
   81    HA   MET  10           HA       MET  10  -1.519   0.135  -6.398
   82   1HB   MET  10          2HB       MET  10  -2.422   2.476  -7.500
   83   2HB   MET  10          1HB       MET  10  -0.679   2.683  -7.598
   84   1HG   MET  10          2HG       MET  10  -1.747   0.080  -8.486
   85   2HG   MET  10          1HG       MET  10  -2.133   1.479  -9.487
   86   1HE   MET  10          1HE       MET  10  -0.263  -0.854 -10.933
   87   2HE   MET  10          2HE       MET  10   0.604   0.426 -11.781
   88   3HE   MET  10          3HE       MET  10  -1.119   0.598 -11.449
   89    H    CYS  11           H        CYS  11   0.427  -0.647  -5.969
   90    HA   CYS  11           HA       CYS  11   2.326   0.963  -4.470
   91   1HB   CYS  11          2HB       CYS  11   1.672  -1.532  -4.042
   92   2HB   CYS  11          1HB       CYS  11   2.838  -1.867  -5.317
   93    H    LEU  12           H        LEU  12   3.049   2.410  -6.022
   94    HA   LEU  12           HA       LEU  12   3.985   1.733  -8.580
   95   1HB   LEU  12          2HB       LEU  12   5.143   4.037  -7.073
   96   2HB   LEU  12          1HB       LEU  12   4.713   3.923  -8.769
   97    HG   LEU  12           HG       LEU  12   2.273   3.647  -7.518
   98   1HD1  LEU  12          1HD1      LEU  12   3.319   6.036  -6.159
   99   2HD1  LEU  12          2HD1      LEU  12   3.828   4.489  -5.482
  100   3HD1  LEU  12          3HD1      LEU  12   2.110   4.864  -5.635
  101   1HD2  LEU  12          1HD2      LEU  12   3.730   5.784  -8.947
  102   2HD2  LEU  12          2HD2      LEU  12   2.275   6.266  -8.074
  103   3HD2  LEU  12          3HD2      LEU  12   2.185   5.017  -9.317
  104    HA   PRO  13           HA       PRO  13   8.417   1.980  -6.130
  105   1HB   PRO  13          2HB       PRO  13   7.246   0.065  -4.138
  106   2HB   PRO  13          1HB       PRO  13   8.602   1.185  -3.951
  107   1HG   PRO  13          2HG       PRO  13   6.197   1.810  -3.001
  108   2HG   PRO  13          1HG       PRO  13   7.218   3.040  -3.768
  109   1HD   PRO  13          2HD       PRO  13   4.760   1.734  -4.773
  110   2HD   PRO  13          1HD       PRO  13   5.436   3.324  -5.172
  111    H    CYS  14           H        CYS  14   6.198  -0.803  -6.319
  112    HA   CYS  14           HA       CYS  14   8.354  -2.336  -7.580
  113   1HB   CYS  14          2HB       CYS  14   7.212  -4.331  -6.795
  114   2HB   CYS  14          1HB       CYS  14   7.573  -3.279  -5.440
  115    H    GLY  15           H        GLY  15   5.068  -1.200  -7.777
  116   1HA   GLY  15          2HA       GLY  15   3.889  -0.830  -9.745
  117   2HA   GLY  15          1HA       GLY  15   5.027  -1.868 -10.571
  118    H    ILE  16           H        ILE  16   2.482  -2.034  -8.102
  119    HA   ILE  16           HA       ILE  16   1.257  -4.257  -9.507
  120    HB   ILE  16           HB       ILE  16   1.970  -4.607  -6.597
  121   1HG1  ILE  16          2HG1      ILE  16   3.336  -5.780  -9.033
  122   2HG1  ILE  16          1HG1      ILE  16   4.031  -4.597  -7.930
  123   1HG2  ILE  16          1HG2      ILE  16   0.687  -6.330  -8.688
  124   2HG2  ILE  16          2HG2      ILE  16   0.094  -5.907  -7.081
  125   3HG2  ILE  16          3HG2      ILE  16   1.444  -7.028  -7.257
  126   1HD1  ILE  16          1HD1      ILE  16   4.841  -6.260  -6.727
  127   2HD1  ILE  16          2HD1      ILE  16   4.029  -7.440  -7.756
  128   3HD1  ILE  16          3HD1      ILE  16   3.194  -6.767  -6.355
  129    H    ALA  17           H        ALA  17  -0.725  -3.422  -9.732
  130    HA   ALA  17           HA       ALA  17  -1.919  -1.801  -7.651
  131   1HB   ALA  17          1HB       ALA  17  -2.106  -1.690 -10.330
  132   2HB   ALA  17          2HB       ALA  17  -3.324  -1.029  -9.239
  133   3HB   ALA  17          3HB       ALA  17  -3.559  -2.620  -9.961
  134    H    PHE  18           H        PHE  18  -2.852  -2.746  -5.963
  135    HA   PHE  18           HA       PHE  18  -3.940  -5.420  -6.167
  136   1HB   PHE  18          2HB       PHE  18  -3.148  -3.563  -4.004
  137   2HB   PHE  18          1HB       PHE  18  -4.433  -4.696  -3.630
  138    HD1  PHE  18           1HD      PHE  18  -3.977  -7.014  -3.311
  139    HD2  PHE  18           2HD      PHE  18  -0.921  -4.379  -4.659
  140    HE1  PHE  18           1HE      PHE  18  -2.293  -8.760  -2.893
  141    HE2  PHE  18           2HE      PHE  18   0.769  -6.118  -4.245
  142    HZ   PHE  18           HZ       PHE  18   0.084  -8.311  -3.362
  143    H    SER  19           H        SER  19  -6.084  -5.971  -5.790
  144    HA   SER  19           HA       SER  19  -8.000  -3.912  -6.463
  145   1HB   SER  19          2HB       SER  19  -7.990  -6.881  -6.393
  146   2HB   SER  19          1HB       SER  19  -9.546  -6.078  -6.190
  147    HG   SER  19           HG       SER  19  -9.349  -6.256  -8.340
  148    H    SER  20           H        SER  20  -6.731  -3.993  -3.701
  149    HA   SER  20           HA       SER  20  -9.112  -3.375  -2.278
  150   1HB   SER  20          2HB       SER  20  -7.962  -6.052  -1.989
  151   2HB   SER  20          1HB       SER  20  -8.177  -5.211  -0.454
  152    HG   SER  20           HG       SER  20 -10.227  -5.360  -2.395
  153    HA   PRO  21           HA       PRO  21  -6.201  -0.869  -0.085
  154   1HB   PRO  21          2HB       PRO  21  -8.053  -0.688   2.160
  155   2HB   PRO  21          1HB       PRO  21  -7.595   0.553   0.993
  156   1HG   PRO  21          2HG       PRO  21 -10.065  -0.560   1.057
  157   2HG   PRO  21          1HG       PRO  21  -9.314   0.032  -0.436
  158   1HD   PRO  21          2HD       PRO  21  -9.548  -2.776   0.585
  159   2HD   PRO  21          1HD       PRO  21  -9.757  -2.154  -1.066
  160    H    SER  22           H        SER  22  -7.928  -3.222   1.971
  161    HA   SER  22           HA       SER  22  -6.055  -3.317   4.046
  162   1HB   SER  22          2HB       SER  22  -8.479  -4.466   3.629
  163   2HB   SER  22          1HB       SER  22  -7.422  -5.860   3.400
  164    HG   SER  22           HG       SER  22  -7.654  -4.193   5.675
  165    H    THR  23           H        THR  23  -6.136  -4.926   0.937
  166    HA   THR  23           HA       THR  23  -4.133  -6.842   1.462
  167    HB   THR  23           HB       THR  23  -4.288  -5.775  -1.289
  168    HG1  THR  23           1HG      THR  23  -6.550  -6.836   0.041
  169   1HG2  THR  23          1HG2      THR  23  -4.646  -8.520  -0.112
  170   2HG2  THR  23          2HG2      THR  23  -3.215  -7.890  -0.928
  171   3HG2  THR  23          3HG2      THR  23  -4.707  -8.141  -1.833
  172    H    LEU  24           H        LEU  24  -4.043  -3.496   0.426
  173    HA   LEU  24           HA       LEU  24  -1.353  -3.350  -0.326
  174   1HB   LEU  24          2HB       LEU  24  -2.674  -1.073   1.087
  175   2HB   LEU  24          1HB       LEU  24  -1.600  -1.047  -0.291
  176    HG   LEU  24           HG       LEU  24  -4.512  -1.796  -0.283
  177   1HD1  LEU  24          1HD1      LEU  24  -3.458   0.266  -2.090
  178   2HD1  LEU  24          2HD1      LEU  24  -3.406   0.670  -0.374
  179   3HD1  LEU  24          3HD1      LEU  24  -4.938   0.240  -1.131
  180   1HD2  LEU  24          1HD2      LEU  24  -3.798  -3.230  -1.901
  181   2HD2  LEU  24          2HD2      LEU  24  -2.366  -2.272  -2.275
  182   3HD2  LEU  24          3HD2      LEU  24  -3.946  -1.761  -2.866
  183    H    GLU  25           H        GLU  25  -2.966  -2.899   2.760
  184    HA   GLU  25           HA       GLU  25  -0.682  -2.211   4.252
  185   1HB   GLU  25          2HB       GLU  25  -3.306  -2.243   4.808
  186   2HB   GLU  25          1HB       GLU  25  -2.849  -3.754   5.580
  187   1HG   GLU  25          2HG       GLU  25  -0.930  -1.905   6.401
  188   2HG   GLU  25          1HG       GLU  25  -2.466  -1.044   6.467
  189    H    ALA  26           H        ALA  26  -1.982  -5.241   3.196
  190    HA   ALA  26           HA       ALA  26  -0.391  -6.855   4.887
  191   1HB   ALA  26          1HB       ALA  26  -2.623  -7.345   3.458
  192   2HB   ALA  26          2HB       ALA  26  -1.548  -8.608   4.059
  193   3HB   ALA  26          3HB       ALA  26  -1.400  -8.042   2.395
  194    H    HIS  27           H        HIS  27  -0.167  -5.529   1.689
  195    HA   HIS  27           HA       HIS  27   2.168  -6.993   0.906
  196   1HB   HIS  27          2HB       HIS  27   0.620  -6.137  -0.773
  197   2HB   HIS  27          1HB       HIS  27   0.868  -4.494  -0.207
  198    HD1  HIS  27           1HD      HIS  27   2.870  -7.283  -1.865
  199    HD2  HIS  27           2HD      HIS  27   2.797  -3.148  -1.485
  200    HE1  HIS  27           1HE      HIS  27   4.641  -6.394  -3.438
  201    H    GLN  28           H        GLN  28   1.497  -3.684   1.953
  202    HA   GLN  28           HA       GLN  28   4.217  -2.870   2.040
  203   1HB   GLN  28          2HB       GLN  28   1.632  -1.714   2.548
  204   2HB   GLN  28          1HB       GLN  28   2.715  -1.323   3.876
  205   1HG   GLN  28          2HG       GLN  28   3.649  -0.947   1.075
  206   2HG   GLN  28          1HG       GLN  28   2.543   0.225   1.786
  207   1HE2  GLN  28          1HE2      GLN  28   4.997   1.043   1.002
  208   2HE2  GLN  28          2HE2      GLN  28   5.985   1.391   2.376
  209    H    ALA  29           H        ALA  29   2.362  -4.907   4.010
  210    HA   ALA  29           HA       ALA  29   3.590  -4.323   6.519
  211   1HB   ALA  29          1HB       ALA  29   1.677  -6.325   5.486
  212   2HB   ALA  29          2HB       ALA  29   1.589  -5.298   6.918
  213   3HB   ALA  29          3HB       ALA  29   2.586  -6.754   6.936
  214    H    TYR  30           H        TYR  30   3.926  -7.103   4.265
  215    HA   TYR  30           HA       TYR  30   6.683  -7.374   5.201
  216   1HB   TYR  30          2HB       TYR  30   4.500  -9.352   5.566
  217   2HB   TYR  30          1HB       TYR  30   6.091  -9.970   5.141
  218    HD1  TYR  30           1HD      TYR  30   4.104  -8.283   7.705
  219    HD2  TYR  30           2HD      TYR  30   7.961  -9.762   6.689
  220    HE1  TYR  30           1HE      TYR  30   4.786  -8.103  10.060
  221    HE2  TYR  30           2HE      TYR  30   8.655  -9.588   9.042
  222    HH   TYR  30           HH       TYR  30   7.689  -9.493  11.245
  223    H    TYR  31           H        TYR  31   4.923  -6.908   2.548
  224    HA   TYR  31           HA       TYR  31   6.235  -8.952   0.918
  225   1HB   TYR  31          2HB       TYR  31   3.835  -7.353   0.660
  226   2HB   TYR  31          1HB       TYR  31   4.821  -7.261  -0.792
  227    HD1  TYR  31           1HD      TYR  31   3.195  -9.655   1.536
  228    HD2  TYR  31           2HD      TYR  31   4.832  -9.026  -2.340
  229    HE1  TYR  31           1HE      TYR  31   2.327 -11.842   0.822
  230    HE2  TYR  31           2HE      TYR  31   3.967 -11.211  -3.066
  231    HH   TYR  31           HH       TYR  31   3.159 -13.580  -1.205
  232    H    CYS  32           H        CYS  32   5.634  -5.530   0.162
  233    HA   CYS  32           HA       CYS  32   7.924  -5.237  -1.410
  234   1HB   CYS  32          2HB       CYS  32   5.750  -3.636  -0.697
  235   2HB   CYS  32          1HB       CYS  32   7.159  -2.742  -0.139
  236    H    SER  33           H        SER  33  10.003  -4.838  -0.988
  237    HA   SER  33           HA       SER  33  11.937  -4.795   0.232
  238   1HB   SER  33          2HB       SER  33  10.438  -2.385   0.661
  239   2HB   SER  33          1HB       SER  33  11.355  -2.765   2.118
  240    HG   SER  33           HG       SER  33  12.268  -2.196  -0.470
  241    H    HIS  34           H        HIS  34  12.570  -4.184   2.826
  242    HA   HIS  34           HA       HIS  34  11.167  -6.292   4.334
  243   1HB   HIS  34          2HB       HIS  34  14.067  -5.502   4.247
  244   2HB   HIS  34          1HB       HIS  34  13.408  -6.371   5.629
  245    HD1  HIS  34           1HD      HIS  34  14.798  -6.886   2.314
  246    HD2  HIS  34           2HD      HIS  34  12.263  -8.967   4.865
  247    HE1  HIS  34           1HE      HIS  34  14.769  -9.249   1.453
  248    HE2  HIS  34           2HE      HIS  34  13.172 -10.473   2.969
  249    H    ARG  35           H        ARG  35   9.685  -5.007   5.388
  250    HA   ARG  35           HA       ARG  35  10.469  -2.601   6.749
  251   1HB   ARG  35          2HB       ARG  35   7.940  -4.147   6.417
  252   2HB   ARG  35          1HB       ARG  35   8.053  -3.023   7.764
  253   1HG   ARG  35          2HG       ARG  35   8.952  -1.476   5.732
  254   2HG   ARG  35          1HG       ARG  35   7.795  -2.510   4.889
  255   1HD   ARG  35          2HD       ARG  35   6.440  -0.781   5.574
  256   2HD   ARG  35          1HD       ARG  35   6.241  -1.925   6.900
  257    HE   ARG  35           HE       ARG  35   8.351  -0.276   7.595
  258   1HH1  ARG  35          1HH1      ARG  35   4.946   0.069   6.912
  259   2HH1  ARG  35          2HH1      ARG  35   4.747   1.438   7.954
  260   1HH2  ARG  35          1HH2      ARG  35   8.092   1.524   8.966
  261   2HH2  ARG  35          2HH2      ARG  35   6.533   2.264   9.120
  262    H    ILE  36           H        ILE  36  10.730  -2.271   8.930
  263    HA   ILE  36           HA       ILE  36  10.539  -4.580  10.719
  264    HB   ILE  36           HB       ILE  36  12.868  -4.536   9.941
  265   1HG1  ILE  36          2HG1      ILE  36  13.188  -3.528  12.701
  266   2HG1  ILE  36          1HG1      ILE  36  11.997  -4.810  12.499
  267   1HG2  ILE  36          1HG2      ILE  36  14.334  -2.686  10.393
  268   2HG2  ILE  36          2HG2      ILE  36  13.038  -1.803  11.200
  269   3HG2  ILE  36          3HG2      ILE  36  12.952  -2.105   9.465
  270   1HD1  ILE  36          1HD1      ILE  36  13.580  -6.348  12.324
  271   2HD1  ILE  36          2HD1      ILE  36  14.733  -5.104  12.807
  272   3HD1  ILE  36          3HD1      ILE  36  14.441  -5.421  11.097