*HEADER    ANTIMICROBIAL PROTEIN                   11-MAR-19   6O8R              
*TITLE     SYN-SAFENCIN 24                                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CIRCULAR BACTERIOCIN, CIRCULARIN A/UBEROLYSIN FAMILY;      
*COMPND   3 CHAIN: X;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: BACILLUS SAFENSIS;                              
*SOURCE   4 ORGANISM_TAXID: 561879                                               
*KEYWDS    ANTIMICROBIAL, SYNTHETIC PEPTIDE, ANTIMICROBIAL PROTEIN               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    F.R.FIELDS,S.W.LEE                                                    
*REVDAT   1   13-MAY-20 6O8R    0                                                
# Restraints file 1: noes.tab
VARS INDEX GROUP RESID_I RESNAME_I ATOMNAME_I SEGNAME_I RESID_J RESNAME_J ATOMNAME_J SEGNAME_J D_LO D_HI FC W S
FORMAT %4d %3d  %5d %6s %6s %4s  %5d %6s %6s %4s  %9.3f %9.3f %.2f %.2f %.2f

   1  1    3 LYS  HN      A    2 TRP   HA     A    0.000   3.300 100.0 1.0 1.0
   2  1    3 LYS  HN      A    2 TRP   HB2    A    0.000   5.000 100.0 1.0 1.0
   2  2    3 LYS  HN      A    2 TRP   HB2    A    0.000   5.000 100.0 1.0 1.0
   3  1    3 LYS  HN      A    1 ALA   HB1    A    0.000   3.300 100.0 1.0 1.0
   3  1    3 LYS  HN      A    1 ALA   HB2    A    0.000   3.300 100.0 1.0 1.0
   3  1    3 LYS  HN      A    1 ALA   HB3    A    0.000   3.300 100.0 1.0 1.0
   4  1    5 LYS  HN      A    2 TRP   HA     A    0.000   3.300 100.0 1.0 1.0
   5  1    5 LYS  HN      A    2 TRP   HB1    A    0.000   5.000 100.0 1.0 1.0
   5  2    5 LYS  HN      A    2 TRP   HB2    A    0.000   5.000 100.0 1.0 1.0
   6  1    5 LYS  HN      A    1 ALA   HB1    A    0.000   2.700 100.0 1.0 1.0
   6  1    5 LYS  HN      A    1 ALA   HB2    A    0.000   2.700 100.0 1.0 1.0
   6  1    5 LYS  HN      A    1 ALA   HB3    A    0.000   2.700 100.0 1.0 1.0
   7  1    8 LYS  HN      A    6 ILE   HA     A    0.000   5.000 100.0 1.0 1.0
   8  1    8 LYS  HN      A    7 ARG   HA     A    0.000   5.000 100.0 1.0 1.0
   9  1    8 LYS  HN      A    6 ILE   HB1    A    0.000   5.000 100.0 1.0 1.0
  10  1    9 LYS  HN      A    6 ILE   HA     A    0.000   5.000 100.0 1.0 1.0
  11  1    9 LYS  HN      A    7 ARG   HA     A    0.000   5.000 100.0 1.0 1.0   
  12  1    9 LYS  HN      A    7 ARG   HB1    A    0.000   5.000 100.0 1.0 1.0
  12  1    9 LYS  HN      A    7 ARG   HB2    A    0.000   5.000 100.0 1.0 1.0
  13  1    4 GLU  HN      A    3 LYS   HA     A    0.000   3.300 100.0 1.0 1.0
  14  1    4 GLU  HN      A    3 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
  14  2    4 GLU  HN      A    3 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
  15  1   13 GLU  HN      A    9 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
  16  1   13 GLU  HN      A    9 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  16  1   13 GLU  HN      A    9 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  17  1    7 ARG  HN      A    6 ILE   HA     A    0.000   5.000 100.0 1.0 1.0
  18  1    7 ARG  HN      A    3 LYS   HA     A    0.000   3.300 100.0 1.0 1.0
  19  1    7 ARG  HN      A    6 ILE   HB1    A    0.000   3.300 100.0 1.0 1.0
  20  1    7 ARG  HN      A    3 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  20  1    7 ARG  HN      A    3 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0
  21  1   18 GLY  HN      A   16 LYS   HA     A    0.000   3.300 100.0 1.0 1.0
  22  1   18 GLY  HN      A   16 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0 
  22  1   18 GLY  HN      A   16 LYS   HB2    A    0.000   2.700 100.0 1.0 1.0 
  23  1   19 ARG  HN      A   18 GLY   HA1    A    0.000   3.300 100.0 1.0 1.0
  23  2   19 ARG  HN      A   18 GLY   HA2    A    0.000   3.300 100.0 1.0 1.0
  24  1   19 ARG  HN      A   15 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  24  1   19 ARG  HN      A   15 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0
  25  1   11 LYS  HN      A   10 LEU   HA     A    0.000   5.000 100.0 1.0 1.0
  26  1   11 LYS  HN      A    9 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
  27  1   11 LYS  HN      A    9 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0
  27  1   11 LYS  HN      A    9 LYS   HB2    A    0.000   2.700 100.0 1.0 1.0
  28  1   11 LYS  HN      A   10 LEU   HB1    A    0.000   3.300 100.0 1.0 1.0
  28  1   11 LYS  HN      A   10 LEU   HB2    A    0.000   3.300 100.0 1.0 1.0
  29  1   12 ASN  HN      A   11 LYS   HA     A    0.000   2.700 100.0 1.0 1.0
  30  1   12 ASN  HN      A   10 LEU   HA     A    0.000   5.000 100.0 1.0 1.0
  31  1   12 ASN  HN      A    8 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
  32  1   12 ASN  HN      A   11 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0
  32  1   12 ASN  HN      A   11 LYS   HB2    A    0.000   2.700 100.0 1.0 1.0
  33  1   12 ASN  HN      A   10 LEU   HB1    A    0.000   2.700 100.0 1.0 1.0
  33  1   12 ASN  HN      A   10 LEU   HB2    A    0.000   2.700 100.0 1.0 1.0
  34  1   16 LYS  HN      A   12 ASN   HA     A    0.000   5.000 100.0 1.0 1.0
  35  1   16 LYS  HN      A   15 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
  36  1   16 LYS  HN      A   12 ASN   HB1    A    0.000   3.300 100.0 1.0 1.0
  36  1   16 LYS  HN      A   12 ASN   HB2    A    0.000   3.300 100.0 1.0 1.0
  37  1   16 LYS  HN      A   15 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0
  37  1   16 LYS  HN      A   15 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0
  38  1   17 LYS  HN      A   16 LYS   HA     A    0.000   2.700 100.0 1.0 1.0
  39  1   17 LYS  HN      A   15 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
  40  1   17 LYS  HN      A   16 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0
  40  1   17 LYS  HN      A   16 LYS   HB2    A    0.000   2.700 100.0 1.0 1.0
  41  1   17 LYS  HN      A   15 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  41  1   17 LYS  HN      A   15 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0
  42  1   14 ILE  HN      A   11 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
  42  1   14 ILE  HN      A   11 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
  43  1   24 ALA  HN      A   23 ILE   HB1    A    0.000   3.300 100.0 1.0 1.0
  44  1   23 ILE  HN      A   21 ALA   HA     A    0.000   2.700 100.0 1.0 1.0
  45  1   23 ILE  HN      A   20 LYS   HA     A    0.000   2.700 100.0 1.0 1.0
  46  1   23 ILE  HN      A   22 VAL   HA     A    0.000   5.000 100.0 1.0 1.0
  47  1   23 ILE  HN      A   20 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  47  1   23 ILE  HN      A   20 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0
  48  1   24 ALA  HN      A   20 LYS   HA     A    0.000   2.700 100.0 1.0 1.0
  49  1   24 ALA  HN      A   20 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
  49  1   24 ALA  HN      A   20 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
  50  1   22 VAL  HN      A   19 ARG   HA     A    0.000   2.700 100.0 1.0 1.0
  50  1   22 VAL  HN      A   20 LYS   HA     A    0.000   2.700 100.0 1.0 1.0
  51  1   22 VAL  HN      A   19 ARG   HB1    A    0.000   2.700 100.0 1.0 1.0
  51  1   22 VAL  HN      A   19 ARG   HB2    A    0.000   2.700 100.0 1.0 1.0
  52  1   22 VAL  HN      A   20 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  52  1   22 VAL  HN      A   20 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0
  53  1   21 ALA  HN      A   18 GLY   HA1    A    0.000   2.700 100.0 1.0 1.0
  53  2   21 ALA  HN      A   18 GLY   HA2    A    0.000   5.000 100.0 1.0 1.0
  54  1   21 ALA  HN      A   20 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  54  1   21 ALA  HN      A   20 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0
  55  1   21 ALA  HN      A   19 ARG   HB1    A    0.000   2.700 100.0 1.0 1.0
  55  1   21 ALA  HN      A   19 ARG   HB2    A    0.000   2.700 100.0 1.0 1.0
  56  1   15 LYS  HN      A   13 GLU   HA     A    0.000   5.000 100.0 1.0 1.0
  57  1   15 LYS  HN      A   14 ILE   HA     A    0.000   5.000 100.0 1.0 1.0
  58  1   15 LYS  HN      A   14 ILE   HB1    A    0.000   5.000 100.0 1.0 1.0
  59  1   15 LYS  HN      A   13 GLU   HB1    A    0.000   2.700 100.0 1.0 1.0
  59  1   15 LYS  HN      A   13 GLU   HB2    A    0.000   2.700 100.0 1.0 1.0
  60  1    6 ILE  HN      A    4 GLU   HA     A    0.000   2.700 100.0 1.0 1.0
  61  1    6 ILE  HN      A    2 TRP   HB1    A    0.000   2.700 100.0 1.0 1.0
  61  1    6 ILE  HN      A    2 TRP   HB2    A    0.000   2.700 100.0 1.0 1.0
  62  1   25 TRP  HN      A   21 ALA   HA     A    0.000   2.700 100.0 1.0 1.0
  63  1   25 TRP  HN      A   23 ILE   HA     A    0.000   2.700 100.0 1.0 1.0
  64  1   25 TRP  HN      A   22 VAL   HA     A    0.000   3.300 100.0 1.0 1.0
  65  1   25 TRP  HN      A   22 VAL   HB1    A    0.000   3.300 100.0 1.0 1.0
  65  1   25 TRP  HN      A   22 VAL   HB2    A    0.000   3.300 100.0 1.0 1.0
  66  1   25 TRP  HN      A   23 ILE   HB1    A    0.000   3.300 100.0 1.0 1.0
  67  1   25 TRP  HN      A   24 ALA   HB1    A    0.000   3.300 100.0 1.0 1.0
  67  1   25 TRP  HN      A   24 ALA   HB2    A    0.000   3.300 100.0 1.0 1.0
  67  1   25 TRP  HN      A   24 ALA   HB3    A    0.000   3.300 100.0 1.0 1.0
  68  1   10 LEU  HN      A    7 ARG   HA     A    0.000   3.300 100.0 1.0 1.0
  69  1   10 LEU  HN      A    7 ARG   HB1    A    0.000   5.000 100.0 1.0 1.0
  69  1   10 LEU  HN      A    7 ARG   HB2    A    0.000   5.000 100.0 1.0 1.0
  70  1   10 LEU  HN      A    8 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
  70  1   10 LEU  HN      A    8 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
  71  1    2 TRP  HN      A    1 ALA   HB1    A    0.000   2.700 100.0 1.0 1.0
  71  1    2 TRP  HN      A    1 ALA   HB2    A    0.000   2.700 100.0 1.0 1.0
  71  1    2 TRP  HN      A    1 ALA   HB3    A    0.000   2.700 100.0 1.0 1.0
  72  1    6 ILE  HN      A    2 TRP   HN     A    0.000   5.000 100.0 1.0 1.0
  73  1   22 VAL  HN      A   25 TRP   HN     A    0.000   3.300 100.0 1.0 1.0
  74  1   21 ALA  HN      A   25 TRP   HN     A    0.000   2.700 100.0 1.0 1.0
  75  1   23 ILE  HN      A   25 TRP   HN     A    0.000   3.300 100.0 1.0 1.0
  76  1   24 ALA  HN      A   25 TRP   HN     A    0.000   3.300 100.0 1.0 1.0
  77  1   16 LYS  HN      A   15 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  78  1   17 LYS  HN      A   21 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  79  1   12 ASN  HN      A   15 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  80  1   19 ARG  HN      A   21 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  81  1   19 ARG  HN      A   15 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  82  1   18 GLY  HN      A   15 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  83  1   18 GLY  HN      A   20 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  84  1   13 GLU  HN      A   15 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  85  1    7 ARG  HN      A   12 ASN   HN     A    0.000   5.000 100.0 1.0 1.0 
  86  1   13 GLU  HN      A   12 ASN   HN     A    0.000   5.000 100.0 1.0 1.0
  87  1   13 GLU  HN      A   11 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  88  1    7 ARG  HN      A   10 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  89  1    9 LYS  HN      A   11 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  90  1    9 LYS  HN      A   12 ASN   HN     A    0.000   5.000 100.0 1.0 1.0
  91  1    8 LYS  HN      A   12 ASN   HN     A    0.000   5.000 100.0 1.0 1.0
  92  1    8 LYS  HN      A    7 ARG   HN     A    0.000   5.000 100.0 1.0 1.0 
  93  1    8 LYS  HN      A    9 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  94  1    3 LYS  HN      A    2 TRP   HN     A    0.000   3.300 100.0 1.0 1.0
  95  1   11 LYS  HN      A   10 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  96  1   13 GLU  HN      A   15 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  97  1    7 ARG  HN      A   15 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
  98  1   14 ILE  HN      A   11 LYS   HA     A    0.000   2.700 100.0 1.0 1.0
  99  1   24 ALA  HN      A   23 ILE   HA     A    0.000   3.300 100.0 1.0 1.0
 100  1   25 TRP  HN      A   24 ALA   HA     A    0.000   3.300 100.0 1.0 1.0
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           HT1      ALA   1  51.290  11.103  11.375
    2    H2   ALA   1           HT2      ALA   1  51.425  10.240  12.831
    3    H3   ALA   1           HT3      ALA   1  50.095   9.982  11.805
    4    HA   ALA   1           HA       ALA   1  52.735   8.885  11.732
    5    HB1  ALA   1           HB1      ALA   1  50.809   7.461  11.992
    6    HB2  ALA   1           HB2      ALA   1  51.484   7.175  10.367
    7    HB3  ALA   1           HB3      ALA   1  50.024   8.178  10.562
    8    H    TRP   2           HN       TRP   2  50.645   8.729   8.957
    9    HA   TRP   2           HA       TRP   2  51.981  10.642   7.365
   10    HB2  TRP   2           HB2      TRP   2  53.344   8.188   7.686
   11    HB3  TRP   2           HB1      TRP   2  52.747   8.265   6.014
   12    HD1  TRP   2           HD1      TRP   2  55.537   9.370   8.158
   13    HE1  TRP   2           HE1      TRP   2  57.034  11.128   6.963
   14    HE3  TRP   2           HE3      TRP   2  52.457  10.516   4.232
   15    HZ2  TRP   2           HZ2      TRP   2  56.884  12.791   4.619
   16    HZ3  TRP   2           HZ3      TRP   2  53.156  12.193   2.527
   17    HH2  TRP   2           HH2      TRP   2  55.364  13.329   2.717
   18    H    LYS   3           HN       LYS   3  49.283  10.201   7.875
   19    HA   LYS   3           HA       LYS   3  47.310   9.603   6.715
   20    HB2  LYS   3           HB2      LYS   3  49.164   9.834   4.373
   21    HB3  LYS   3           HB1      LYS   3  47.601   9.009   4.183
   22    HG2  LYS   3           HG2      LYS   3  47.486  11.429   3.618
   23    HG3  LYS   3           HG1      LYS   3  46.429  11.003   4.985
   24    HD2  LYS   3           HD2      LYS   3  48.000  11.883   6.588
   25    HD3  LYS   3           HD1      LYS   3  49.260  12.064   5.343
   26    HE2  LYS   3           HE2      LYS   3  48.029  14.213   5.989
   27    HE3  LYS   3           HE1      LYS   3  48.054  13.833   4.249
   28    HZ1  LYS   3           HZ1      LYS   3  45.854  13.065   4.327
   29    HZ2  LYS   3           HZ2      LYS   3  45.838  14.493   5.247
   30    HZ3  LYS   3           HZ3      LYS   3  45.832  12.981   6.022
   31    H    GLU   4           HN       GLU   4  49.709   8.244   7.771
   32    HA   GLU   4           HA       GLU   4  49.880   6.420   8.824
   33    HB2  GLU   4           HB2      GLU   4  47.428   5.874   8.517
   34    HB3  GLU   4           HB1      GLU   4  47.978   4.888   7.143
   35    HG2  GLU   4           HG2      GLU   4  47.764   3.423   9.066
   36    HG3  GLU   4           HG1      GLU   4  49.500   3.647   8.749
   37    H    LYS   5           HN       LYS   5  51.771   7.328   7.563
   38    HA   LYS   5           HA       LYS   5  53.679   6.342   6.423
   39    HB2  LYS   5           HB2      LYS   5  52.753   4.063   7.736
   40    HB3  LYS   5           HB1      LYS   5  52.504   3.597   6.039
   41    HG2  LYS   5           HG2      LYS   5  54.927   4.384   5.632
   42    HG3  LYS   5           HG1      LYS   5  55.102   4.415   7.400
   43    HD2  LYS   5           HD2      LYS   5  54.274   1.995   5.732
   44    HD3  LYS   5           HD1      LYS   5  55.874   2.251   6.464
   45    HE2  LYS   5           HE2      LYS   5  53.221   1.757   7.861
   46    HE3  LYS   5           HE1      LYS   5  54.730   0.828   7.992
   47    HZ1  LYS   5           HZ1      LYS   5  55.692   3.029   8.867
   48    HZ2  LYS   5           HZ2      LYS   5  54.715   2.105   9.904
   49    HZ3  LYS   5           HZ3      LYS   5  54.077   3.476   9.131
   50    H    ILE   6           HN       ILE   6  50.459   6.655   6.152
   51    HA   ILE   6           HA       ILE   6  49.436   7.657   4.087
   52    HB   ILE   6           HB       ILE   6  49.925   7.187   1.853
   53   HG12  ILE   6          HG12      ILE   6  51.982   5.310   1.561
   54   HG13  ILE   6          HG11      ILE   6  51.065   4.613   2.900
   55   HG21  ILE   6          HG21      ILE   6  51.715   8.559   1.941
   56   HG22  ILE   6          HG22      ILE   6  52.787   7.202   2.310
   57   HG23  ILE   6          HG23      ILE   6  52.009   8.098   3.626
   58   HD11  ILE   6           HD1      ILE   6  48.980   5.171   1.259
   59   HD12  ILE   6           HD2      ILE   6  49.911   3.665   1.122
   60   HD13  ILE   6           HD3      ILE   6  50.258   5.022   0.030
   61    H    ARG   7           HN       ARG   7  47.484   7.318   4.310
   62    HA   ARG   7           HA       ARG   7  45.934   5.523   2.926
   63    HB2  ARG   7           HB2      ARG   7  47.303   3.970   5.080
   64    HB3  ARG   7           HB1      ARG   7  45.562   3.722   4.995
   65    HG2  ARG   7           HG2      ARG   7  45.625   2.776   2.854
   66    HG3  ARG   7           HG1      ARG   7  47.142   3.580   2.409
   67    HD2  ARG   7           HD2      ARG   7  48.449   2.078   3.741
   68    HD3  ARG   7           HD1      ARG   7  47.011   1.466   4.593
   69    HE   ARG   7           HE       ARG   7  46.640   0.004   2.774
   70   HH11  ARG   7          HH11      ARG   7  46.272   0.414   0.353
   71   HH12  ARG   7          HH12      ARG   7  47.738   0.709  -0.520
   72   HH21  ARG   7          HH21      ARG   7  49.625   1.315   2.326
   73   HH22  ARG   7          HH22      ARG   7  49.636   1.220   0.596
   74    H    LYS   8           HN       LYS   8  46.165   7.915   5.013
   75    HA   LYS   8           HA       LYS   8  43.662   7.230   6.410
   76    HB2  LYS   8           HB2      LYS   8  45.520   8.504   7.600
   77    HB3  LYS   8           HB1      LYS   8  45.067   9.899   6.581
   78    HG2  LYS   8           HG2      LYS   8  42.792   9.860   7.465
   79    HG3  LYS   8           HG1      LYS   8  43.146   8.388   8.402
   80    HD2  LYS   8           HD2      LYS   8  44.753   9.563   9.781
   81    HD3  LYS   8           HD1      LYS   8  44.657  11.010   8.749
   82    HE2  LYS   8           HE2      LYS   8  42.340   9.845  10.355
   83    HE3  LYS   8           HE1      LYS   8  43.307  11.262  10.830
   84    HZ1  LYS   8           HZ1      LYS   8  41.621  12.289   9.731
   85    HZ2  LYS   8           HZ2      LYS   8  41.323  10.980   8.689
   86    HZ3  LYS   8           HZ3      LYS   8  42.642  12.012   8.406
   87    H    LYS   9           HN       LYS   9  44.609   8.881   3.506
   88    HA   LYS   9           HA       LYS   9  42.054  10.417   3.521
   89    HB2  LYS   9           HB2      LYS   9  43.858  10.664   1.607
   90    HB3  LYS   9           HB1      LYS   9  43.019   9.229   0.916
   91    HG2  LYS   9           HG2      LYS   9  41.841  10.996  -0.087
   92    HG3  LYS   9           HG1      LYS   9  40.835  10.688   1.343
   93    HD2  LYS   9           HD2      LYS   9  41.948  12.541   2.546
   94    HD3  LYS   9           HD1      LYS   9  43.011  12.822   1.147
   95    HE2  LYS   9           HE2      LYS   9  41.089  14.401   1.178
   96    HE3  LYS   9           HE1      LYS   9  41.057  13.349  -0.257
   97    HZ1  LYS   9           HZ1      LYS   9  39.354  12.064   0.636
   98    HZ2  LYS   9           HZ2      LYS   9  38.907  13.645   1.064
   99    HZ3  LYS   9           HZ3      LYS   9  39.609  12.615   2.219
  100    H    LEU  10           HN       LEU  10  43.140   7.235   3.372
  101    HA   LEU  10           HA       LEU  10  41.031   5.650   3.963
  102    HB2  LEU  10           HB2      LEU  10  39.625   6.809   2.246
  103    HB3  LEU  10           HB1      LEU  10  40.921   6.472   1.033
  104    HG   LEU  10           HG       LEU  10  40.409   3.999   1.362
  105   HD11  LEU  10          HD11      LEU  10  38.490   5.098   3.438
  106   HD12  LEU  10          HD12      LEU  10  39.682   3.785   3.601
  107   HD13  LEU  10          HD13      LEU  10  38.198   3.523   2.661
  108   HD21  LEU  10          HD21      LEU  10  37.764   5.434   0.924
  109   HD22  LEU  10          HD22      LEU  10  38.371   3.964   0.127
  110   HD23  LEU  10          HD23      LEU  10  39.080   5.547  -0.267
  111    H    LYS  11           HN       LYS  11  42.617   6.533   1.127
  112    HA   LYS  11           HA       LYS  11  44.333   4.272   0.859
  113    HB2  LYS  11           HB2      LYS  11  43.167   5.940  -1.171
  114    HB3  LYS  11           HB1      LYS  11  44.101   4.446  -1.501
  115    HG2  LYS  11           HG2      LYS  11  42.158   3.329  -0.032
  116    HG3  LYS  11           HG1      LYS  11  41.257   4.763  -0.583
  117    HD2  LYS  11           HD2      LYS  11  41.835   4.193  -2.943
  118    HD3  LYS  11           HD1      LYS  11  42.641   2.715  -2.362
  119    HE2  LYS  11           HE2      LYS  11  39.714   3.401  -1.852
  120    HE3  LYS  11           HE1      LYS  11  40.287   2.305  -3.131
  121    HZ1  LYS  11           HZ1      LYS  11  39.747   0.953  -1.305
  122    HZ2  LYS  11           HZ2      LYS  11  40.522   1.973  -0.190
  123    HZ3  LYS  11           HZ3      LYS  11  41.439   1.054  -1.285
  124    H    ASN  12           HN       ASN  12  43.640   6.868   1.407
  125    HA   ASN  12           HA       ASN  12  45.040   8.932   1.877
  126    HB2  ASN  12           HB2      ASN  12  47.097   7.433   2.261
  127    HB3  ASN  12           HB1      ASN  12  47.393   7.619   0.542
  128   HD21  ASN  12          HD21      ASN  12  45.939  10.449   1.101
  129   HD22  ASN  12          HD22      ASN  12  47.327  11.426   1.591
  130    H    GLU  13           HN       GLU  13  43.633   7.564  -0.280
  131    HA   GLU  13           HA       GLU  13  43.054   7.981  -2.507
  132    HB2  GLU  13           HB2      GLU  13  44.084  10.433  -1.901
  133    HB3  GLU  13           HB1      GLU  13  45.426   9.830  -2.914
  134    HG2  GLU  13           HG2      GLU  13  42.478   9.829  -3.789
  135    HG3  GLU  13           HG1      GLU  13  43.607  11.143  -4.168
  136    H    ILE  14           HN       ILE  14  44.900   5.963  -1.211
  137    HA   ILE  14           HA       ILE  14  46.287   4.340  -2.151
  138    HB   ILE  14           HB       ILE  14  46.993   6.049  -4.588
  139   HG12  ILE  14          HG12      ILE  14  44.668   4.106  -4.155
  140   HG13  ILE  14          HG11      ILE  14  44.567   5.781  -4.725
  141   HG21  ILE  14          HG21      ILE  14  46.978   3.030  -4.236
  142   HG22  ILE  14          HG22      ILE  14  48.393   4.029  -3.836
  143   HG23  ILE  14          HG23      ILE  14  47.782   3.988  -5.501
  144   HD11  ILE  14           HD1      ILE  14  46.021   5.008  -6.724
  145   HD12  ILE  14           HD2      ILE  14  44.320   4.481  -6.693
  146   HD13  ILE  14           HD3      ILE  14  45.610   3.353  -6.211
  147    H    LYS  15           HN       LYS  15  47.130   7.846  -2.037
  148    HA   LYS  15           HA       LYS  15  49.375   7.156  -0.326
  149    HB2  LYS  15           HB2      LYS  15  50.182   6.525  -2.767
  150    HB3  LYS  15           HB1      LYS  15  50.339   8.279  -2.920
  151    HG2  LYS  15           HG2      LYS  15  52.214   8.377  -1.563
  152    HG3  LYS  15           HG1      LYS  15  51.603   7.153  -0.435
  153    HD2  LYS  15           HD2      LYS  15  52.257   5.350  -1.905
  154    HD3  LYS  15           HD1      LYS  15  52.649   6.486  -3.216
  155    HE2  LYS  15           HE2      LYS  15  54.432   7.487  -1.795
  156    HE3  LYS  15           HE1      LYS  15  54.051   6.316  -0.511
  157    HZ1  LYS  15           HZ1      LYS  15  54.363   4.780  -2.745
  158    HZ2  LYS  15           HZ2      LYS  15  55.518   4.999  -1.519
  159    HZ3  LYS  15           HZ3      LYS  15  55.570   5.957  -2.922
  160    H    LYS  16           HN       LYS  16  47.756   9.360  -2.303
  161    HA   LYS  16           HA       LYS  16  47.843  11.370  -0.639
  162    HB2  LYS  16           HB2      LYS  16  50.347  11.338  -1.634
  163    HB3  LYS  16           HB1      LYS  16  49.516  12.616  -2.520
  164    HG2  LYS  16           HG2      LYS  16  50.488  13.743  -0.668
  165    HG3  LYS  16           HG1      LYS  16  48.787  13.527  -0.205
  166    HD2  LYS  16           HD2      LYS  16  49.343  11.610   1.177
  167    HD3  LYS  16           HD1      LYS  16  51.026  11.621   0.601
  168    HE2  LYS  16           HE2      LYS  16  49.684  13.883   2.146
  169    HE3  LYS  16           HE1      LYS  16  50.802  12.686   2.843
  170    HZ1  LYS  16           HZ1      LYS  16  52.365  13.461   0.972
  171    HZ2  LYS  16           HZ2      LYS  16  52.167  14.466   2.327
  172    HZ3  LYS  16           HZ3      LYS  16  51.358  14.823   0.876
  173    H    LYS  17           HN       LYS  17  48.557  11.115  -3.283
  174    HA   LYS  17           HA       LYS  17  45.883  11.408  -4.593
  175    HB2  LYS  17           HB2      LYS  17  48.181  13.234  -5.352
  176    HB3  LYS  17           HB1      LYS  17  46.674  13.060  -6.251
  177    HG2  LYS  17           HG2      LYS  17  46.864  14.093  -3.383
  178    HG3  LYS  17           HG1      LYS  17  46.729  15.124  -4.821
  179    HD2  LYS  17           HD2      LYS  17  44.587  13.728  -5.370
  180    HD3  LYS  17           HD1      LYS  17  44.677  13.197  -3.674
  181    HE2  LYS  17           HE2      LYS  17  43.223  15.140  -3.780
  182    HE3  LYS  17           HE1      LYS  17  44.740  15.625  -2.986
  183    HZ1  LYS  17           HZ1      LYS  17  43.978  17.201  -4.710
  184    HZ2  LYS  17           HZ2      LYS  17  44.164  15.987  -5.884
  185    HZ3  LYS  17           HZ3      LYS  17  45.516  16.566  -5.034
  186    H    GLY  18           HN       GLY  18  48.494  10.098  -3.640
  187    HA2  GLY  18           HA1      GLY  18  49.183   7.974  -4.907
  188    HA3  GLY  18           HA2      GLY  18  49.224   8.963  -6.394
  189    H    ARG  19           HN       ARG  19  50.004  10.499  -3.494
  190    HA   ARG  19           HA       ARG  19  52.424  10.512  -2.577
  191    HB2  ARG  19           HB2      ARG  19  52.837  11.045  -5.599
  192    HB3  ARG  19           HB1      ARG  19  54.045  11.450  -4.333
  193    HG2  ARG  19           HG2      ARG  19  53.172   8.605  -4.106
  194    HG3  ARG  19           HG1      ARG  19  53.989   8.978  -5.642
  195    HD2  ARG  19           HD2      ARG  19  55.527   8.231  -3.769
  196    HD3  ARG  19           HD1      ARG  19  55.942   9.807  -4.483
  197    HE   ARG  19           HE       ARG  19  54.186  10.023  -2.149
  198   HH11  ARG  19          HH11      ARG  19  55.571  12.230  -1.871
  199   HH12  ARG  19          HH12      ARG  19  57.091  11.883  -1.118
  200   HH21  ARG  19          HH21      ARG  19  56.950   8.484  -1.796
  201   HH22  ARG  19          HH22      ARG  19  57.872   9.762  -1.076
  202    H    LYS  20           HN       LYS  20  50.571  11.979  -5.003
  203    HA   LYS  20           HA       LYS  20  50.331  13.970  -5.841
  204    HB2  LYS  20           HB2      LYS  20  49.779  15.719  -4.861
  205    HB3  LYS  20           HB1      LYS  20  49.165  14.479  -3.792
  206    HG2  LYS  20           HG2      LYS  20  51.420  14.961  -2.436
  207    HG3  LYS  20           HG1      LYS  20  51.352  16.510  -3.290
  208    HD2  LYS  20           HD2      LYS  20  49.068  15.391  -1.618
  209    HD3  LYS  20           HD1      LYS  20  50.260  16.571  -1.028
  210    HE2  LYS  20           HE2      LYS  20  48.373  16.951  -3.394
  211    HE3  LYS  20           HE1      LYS  20  48.235  17.734  -1.803
  212    HZ1  LYS  20           HZ1      LYS  20  49.322  19.296  -3.112
  213    HZ2  LYS  20           HZ2      LYS  20  50.287  18.140  -3.897
  214    HZ3  LYS  20           HZ3      LYS  20  50.598  18.553  -2.278
  215    H    ALA  21           HN       ALA  21  51.668  13.338  -6.542
  216    HA   ALA  21           HA       ALA  21  53.782  14.831  -7.321
  217    HB1  ALA  21           HB1      ALA  21  55.759  13.818  -6.546
  218    HB2  ALA  21           HB2      ALA  21  54.948  12.253  -6.316
  219    HB3  ALA  21           HB3      ALA  21  54.758  13.545  -5.104
  220    H    VAL  22           HN       VAL  22  51.372  13.089  -6.765
  221    HA   VAL  22           HA       VAL  22  51.573  11.993  -9.609
  222    HB   VAL  22           HB       VAL  22  50.166  10.778  -7.206
  223   HG11  VAL  22          HG11      VAL  22  48.411  10.840  -8.851
  224   HG12  VAL  22          HG12      VAL  22  49.110   9.216  -9.004
  225   HG13  VAL  22          HG13      VAL  22  49.544  10.485 -10.174
  226   HG21  VAL  22          HG21      VAL  22  51.244   8.695  -8.046
  227   HG22  VAL  22          HG22      VAL  22  52.458   9.971  -7.768
  228   HG23  VAL  22          HG23      VAL  22  51.909   9.606  -9.418
  229    H    ILE  23           HN       ILE  23  51.124  14.391  -7.708
  230    HA   ILE  23           HA       ILE  23  49.135  15.387  -9.493
  231    HB   ILE  23           HB       ILE  23  48.196  14.960  -6.708
  232   HG12  ILE  23          HG12      ILE  23  47.109  14.045  -8.869
  233   HG13  ILE  23          HG11      ILE  23  46.027  14.768  -7.665
  234   HG21  ILE  23          HG21      ILE  23  48.493  17.312  -6.446
  235   HG22  ILE  23          HG22      ILE  23  46.760  17.060  -6.762
  236   HG23  ILE  23          HG23      ILE  23  47.825  17.645  -8.062
  237   HD11  ILE  23           HD1      ILE  23  45.663  15.452 -10.130
  238   HD12  ILE  23           HD2      ILE  23  47.148  16.413  -9.966
  239   HD13  ILE  23           HD3      ILE  23  45.747  16.759  -8.930
  240    H    ALA  24           HN       ALA  24  51.189  15.577  -6.910
  241    HA   ALA  24           HA       ALA  24  51.799  18.334  -7.702
  242    HB1  ALA  24           HB1      ALA  24  53.436  18.435  -6.037
  243    HB2  ALA  24           HB2      ALA  24  53.740  16.693  -6.097
  244    HB3  ALA  24           HB3      ALA  24  52.283  17.313  -5.296
  245    H    TRP  25           HN       TRP  25  51.695  15.142  -8.595
  246    HA   TRP  25           HA       TRP  25  52.728  14.095 -10.468
  247    HB2  TRP  25           HB2      TRP  25  51.836  16.127 -11.589
  248    HB3  TRP  25           HB1      TRP  25  53.410  16.920 -11.348
  249    HD1  TRP  25           HD1      TRP  25  52.168  13.541 -12.819
  250    HE1  TRP  25           HE1      TRP  25  53.541  13.011 -14.965
  251    HE3  TRP  25           HE3      TRP  25  55.274  17.610 -12.816
  252    HZ2  TRP  25           HZ2      TRP  25  55.695  14.215 -16.451
  253    HZ3  TRP  25           HZ3      TRP  25  56.979  17.899 -14.606
  254    HH2  TRP  25           HH2      TRP  25  57.193  16.208 -16.422
  Start of MODEL    2
    1    H1   ALA   1           HT1      ALA   1  47.149  13.783  10.474
    2    H2   ALA   1           HT2      ALA   1  47.439  14.841   9.177
    3    H3   ALA   1           HT3      ALA   1  47.982  15.234  10.739
    4    HA   ALA   1           HA       ALA   1  49.854  14.183  10.456
    5    HB1  ALA   1           HB1      ALA   1  49.873  11.787   9.786
    6    HB2  ALA   1           HB2      ALA   1  48.126  11.898   9.450
    7    HB3  ALA   1           HB3      ALA   1  48.729  12.123  11.114
    8    H    TRP   2           HN       TRP   2  49.434  11.995   8.030
    9    HA   TRP   2           HA       TRP   2  49.855  13.868   5.821
   10    HB2  TRP   2           HB2      TRP   2  51.941  12.448   7.078
   11    HB3  TRP   2           HB1      TRP   2  51.659  11.673   5.507
   12    HD1  TRP   2           HD1      TRP   2  51.582  15.442   6.460
   13    HE1  TRP   2           HE1      TRP   2  53.201  16.737   4.894
   14    HE3  TRP   2           HE3      TRP   2  53.474  11.490   3.812
   15    HZ2  TRP   2           HZ2      TRP   2  55.058  16.110   2.784
   16    HZ3  TRP   2           HZ3      TRP   2  55.169  11.863   2.028
   17    HH2  TRP   2           HH2      TRP   2  55.964  14.168   1.513
   18    H    LYS   3           HN       LYS   3  47.401  12.625   6.156
   19    HA   LYS   3           HA       LYS   3  46.088  10.856   5.155
   20    HB2  LYS   3           HB2      LYS   3  48.344  11.059   3.147
   21    HB3  LYS   3           HB1      LYS   3  47.174   9.733   3.088
   22    HG2  LYS   3           HG2      LYS   3  46.497  11.637   1.655
   23    HG3  LYS   3           HG1      LYS   3  45.327  11.337   2.961
   24    HD2  LYS   3           HD2      LYS   3  46.179  13.172   4.270
   25    HD3  LYS   3           HD1      LYS   3  47.577  13.375   3.187
   26    HE2  LYS   3           HE2      LYS   3  44.676  13.714   2.315
   27    HE3  LYS   3           HE1      LYS   3  45.733  15.059   2.804
   28    HZ1  LYS   3           HZ1      LYS   3  47.297  14.342   1.052
   29    HZ2  LYS   3           HZ2      LYS   3  45.791  14.827   0.433
   30    HZ3  LYS   3           HZ3      LYS   3  46.178  13.176   0.541
   31    H    GLU   4           HN       GLU   4  48.515  11.072   6.924
   32    HA   GLU   4           HA       GLU   4  49.103   9.916   8.606
   33    HB2  GLU   4           HB2      GLU   4  47.111   8.395   8.414
   34    HB3  GLU   4           HB1      GLU   4  48.189   7.316   7.501
   35    HG2  GLU   4           HG2      GLU   4  49.647   7.039   9.420
   36    HG3  GLU   4           HG1      GLU   4  48.782   8.306  10.323
   37    H    LYS   5           HN       LYS   5  50.809  11.014   7.239
   38    HA   LYS   5           HA       LYS   5  53.100  10.527   6.599
   39    HB2  LYS   5           HB2      LYS   5  52.931   7.633   7.527
   40    HB3  LYS   5           HB1      LYS   5  54.326   8.724   7.476
   41    HG2  LYS   5           HG2      LYS   5  53.057  10.110   9.293
   42    HG3  LYS   5           HG1      LYS   5  52.066   8.648   9.506
   43    HD2  LYS   5           HD2      LYS   5  54.167   7.324   9.868
   44    HD3  LYS   5           HD1      LYS   5  55.095   8.841   9.785
   45    HE2  LYS   5           HE2      LYS   5  54.684   8.348  12.126
   46    HE3  LYS   5           HE1      LYS   5  53.660   9.730  11.671
   47    HZ1  LYS   5           HZ1      LYS   5  52.815   7.390  12.814
   48    HZ2  LYS   5           HZ2      LYS   5  52.377   7.218  11.181
   49    HZ3  LYS   5           HZ3      LYS   5  51.831   8.556  12.074
   50    H    ILE   6           HN       ILE   6  50.120   9.420   6.108
   51    HA   ILE   6           HA       ILE   6  49.315   9.113   3.741
   52    HB   ILE   6           HB       ILE   6  50.285   7.748   2.054
   53   HG12  ILE   6          HG12      ILE   6  52.857   6.897   2.871
   54   HG13  ILE   6          HG11      ILE   6  51.875   6.597   4.310
   55   HG21  ILE   6          HG21      ILE   6  52.852   9.016   2.387
   56   HG22  ILE   6          HG22      ILE   6  51.659  10.079   3.149
   57   HG23  ILE   6          HG23      ILE   6  51.460   9.593   1.461
   58   HD11  ILE   6           HD1      ILE   6  51.512   5.493   1.509
   59   HD12  ILE   6           HD2      ILE   6  50.194   5.457   2.701
   60   HD13  ILE   6           HD3      ILE   6  51.718   4.604   3.036
   61    H    ARG   7           HN       ARG   7  47.460   8.160   3.778
   62    HA   ARG   7           HA       ARG   7  46.277   6.059   3.521
   63    HB2  ARG   7           HB2      ARG   7  48.248   4.614   3.959
   64    HB3  ARG   7           HB1      ARG   7  47.919   4.826   5.691
   65    HG2  ARG   7           HG2      ARG   7  45.692   3.839   5.416
   66    HG3  ARG   7           HG1      ARG   7  45.939   3.723   3.658
   67    HD2  ARG   7           HD2      ARG   7  47.707   2.108   3.931
   68    HD3  ARG   7           HD1      ARG   7  47.762   2.372   5.690
   69    HE   ARG   7           HE       ARG   7  45.128   1.526   5.039
   70   HH11  ARG   7          HH11      ARG   7  47.543   0.035   3.453
   71   HH12  ARG   7          HH12      ARG   7  47.492  -1.466   4.317
   72   HH21  ARG   7          HH21      ARG   7  45.412  -0.261   6.816
   73   HH22  ARG   7          HH22      ARG   7  46.285  -1.633   6.221
   74    H    LYS   8           HN       LYS   8  45.116   7.801   4.148
   75    HA   LYS   8           HA       LYS   8  43.473   6.895   6.236
   76    HB2  LYS   8           HB2      LYS   8  44.865   8.064   7.826
   77    HB3  LYS   8           HB1      LYS   8  45.031   9.465   6.749
   78    HG2  LYS   8           HG2      LYS   8  42.733  10.103   7.073
   79    HG3  LYS   8           HG1      LYS   8  42.347   8.567   7.881
   80    HD2  LYS   8           HD2      LYS   8  44.495  10.363   9.064
   81    HD3  LYS   8           HD1      LYS   8  42.785  10.775   9.319
   82    HE2  LYS   8           HE2      LYS   8  44.101   8.114  10.040
   83    HE3  LYS   8           HE1      LYS   8  43.627   9.393  11.180
   84    HZ1  LYS   8           HZ1      LYS   8  41.405   8.868   9.604
   85    HZ2  LYS   8           HZ2      LYS   8  41.627   8.473  11.241
   86    HZ3  LYS   8           HZ3      LYS   8  42.034   7.352  10.031
   87    H    LYS   9           HN       LYS   9  44.340   8.599   3.519
   88    HA   LYS   9           HA       LYS   9  41.728   9.986   3.319
   89    HB2  LYS   9           HB2      LYS   9  43.821  10.162   1.618
   90    HB3  LYS   9           HB1      LYS   9  43.018   8.737   0.887
   91    HG2  LYS   9           HG2      LYS   9  42.009  10.507  -0.285
   92    HG3  LYS   9           HG1      LYS   9  40.841  10.246   1.030
   93    HD2  LYS   9           HD2      LYS   9  41.893  12.095   2.323
   94    HD3  LYS   9           HD1      LYS   9  43.058  12.348   1.003
   95    HE2  LYS   9           HE2      LYS   9  41.099  13.927   0.923
   96    HE3  LYS   9           HE1      LYS   9  41.265  12.930  -0.542
   97    HZ1  LYS   9           HZ1      LYS   9  39.565  11.471   0.237
   98    HZ2  LYS   9           HZ2      LYS   9  38.968  13.056   0.356
   99    HZ3  LYS   9           HZ3      LYS   9  39.496  12.237   1.748
  100    H    LEU  10           HN       LEU  10  43.156   6.881   3.456
  101    HA   LEU  10           HA       LEU  10  41.439   4.973   3.912
  102    HB2  LEU  10           HB2      LEU  10  39.650   6.062   2.571
  103    HB3  LEU  10           HB1      LEU  10  40.772   5.987   1.148
  104    HG   LEU  10           HG       LEU  10  40.559   3.520   1.137
  105   HD11  LEU  10          HD11      LEU  10  39.178   3.958   3.807
  106   HD12  LEU  10          HD12      LEU  10  40.538   2.876   3.418
  107   HD13  LEU  10          HD13      LEU  10  38.899   2.477   2.859
  108   HD21  LEU  10          HD21      LEU  10  38.231   3.277   0.577
  109   HD22  LEU  10          HD22      LEU  10  38.671   4.953   0.173
  110   HD23  LEU  10          HD23      LEU  10  37.764   4.605   1.664
  111    H    LYS  11           HN       LYS  11  42.285   6.104   0.823
  112    HA   LYS  11           HA       LYS  11  43.971   3.971   0.023
  113    HB2  LYS  11           HB2      LYS  11  42.635   6.079  -1.379
  114    HB3  LYS  11           HB1      LYS  11  43.500   4.742  -2.203
  115    HG2  LYS  11           HG2      LYS  11  41.765   3.220  -0.867
  116    HG3  LYS  11           HG1      LYS  11  40.807   4.718  -0.830
  117    HD2  LYS  11           HD2      LYS  11  40.936   4.882  -3.292
  118    HD3  LYS  11           HD1      LYS  11  41.912   3.394  -3.343
  119    HE2  LYS  11           HE2      LYS  11  40.049   2.133  -2.304
  120    HE3  LYS  11           HE1      LYS  11  39.070   3.619  -2.257
  121    HZ1  LYS  11           HZ1      LYS  11  39.679   1.878  -4.482
  122    HZ2  LYS  11           HZ2      LYS  11  39.874   3.529  -4.830
  123    HZ3  LYS  11           HZ3      LYS  11  38.382   2.948  -4.262
  124    H    ASN  12           HN       ASN  12  43.522   6.389   1.242
  125    HA   ASN  12           HA       ASN  12  45.084   8.297   1.793
  126    HB2  ASN  12           HB2      ASN  12  47.531   7.679   0.494
  127    HB3  ASN  12           HB1      ASN  12  47.254   7.681   2.170
  128   HD21  ASN  12          HD21      ASN  12  49.180   6.009   0.761
  129   HD22  ASN  12          HD22      ASN  12  48.693   4.332   1.020
  130    H    GLU  13           HN       GLU  13  43.543   7.367  -0.539
  131    HA   GLU  13           HA       GLU  13  42.949   8.188  -2.620
  132    HB2  GLU  13           HB2      GLU  13  44.038  10.451  -1.588
  133    HB3  GLU  13           HB1      GLU  13  45.356  10.039  -2.712
  134    HG2  GLU  13           HG2      GLU  13  42.407  10.268  -3.524
  135    HG3  GLU  13           HG1      GLU  13  43.584  11.586  -3.692
  136    H    ILE  14           HN       ILE  14  44.578   5.898  -1.819
  137    HA   ILE  14           HA       ILE  14  45.928   4.419  -2.960
  138    HB   ILE  14           HB       ILE  14  46.595   6.420  -5.173
  139   HG12  ILE  14          HG12      ILE  14  44.226   4.508  -4.902
  140   HG13  ILE  14          HG11      ILE  14  44.150   6.264  -5.144
  141   HG21  ILE  14          HG21      ILE  14  47.934   4.263  -4.806
  142   HG22  ILE  14          HG22      ILE  14  47.219   4.477  -6.415
  143   HG23  ILE  14          HG23      ILE  14  46.450   3.387  -5.237
  144   HD11  ILE  14           HD1      ILE  14  43.737   5.379  -7.300
  145   HD12  ILE  14           HD2      ILE  14  44.986   4.124  -7.121
  146   HD13  ILE  14           HD3      ILE  14  45.460   5.825  -7.347
  147    H    LYS  15           HN       LYS  15  46.868   7.788  -2.201
  148    HA   LYS  15           HA       LYS  15  49.185   6.872  -0.746
  149    HB2  LYS  15           HB2      LYS  15  49.678   6.936  -3.552
  150    HB3  LYS  15           HB1      LYS  15  50.434   8.384  -2.867
  151    HG2  LYS  15           HG2      LYS  15  51.739   7.037  -1.301
  152    HG3  LYS  15           HG1      LYS  15  50.886   5.557  -1.803
  153    HD2  LYS  15           HD2      LYS  15  51.770   5.844  -4.111
  154    HD3  LYS  15           HD1      LYS  15  52.658   7.292  -3.578
  155    HE2  LYS  15           HE2      LYS  15  53.933   5.944  -1.958
  156    HE3  LYS  15           HE1      LYS  15  53.019   4.490  -2.428
  157    HZ1  LYS  15           HZ1      LYS  15  54.027   5.687  -4.752
  158    HZ2  LYS  15           HZ2      LYS  15  54.443   4.185  -4.078
  159    HZ3  LYS  15           HZ3      LYS  15  55.304   5.583  -3.642
  160    H    LYS  16           HN       LYS  16  47.614   9.401  -2.388
  161    HA   LYS  16           HA       LYS  16  47.932  11.175  -0.486
  162    HB2  LYS  16           HB2      LYS  16  50.312  11.069  -1.889
  163    HB3  LYS  16           HB1      LYS  16  49.567  12.654  -2.141
  164    HG2  LYS  16           HG2      LYS  16  50.198  11.424   0.585
  165    HG3  LYS  16           HG1      LYS  16  51.172  12.662  -0.231
  166    HD2  LYS  16           HD2      LYS  16  48.847  13.990  -0.308
  167    HD3  LYS  16           HD1      LYS  16  48.423  12.901   1.028
  168    HE2  LYS  16           HE2      LYS  16  50.778  14.828   0.914
  169    HE3  LYS  16           HE1      LYS  16  49.361  14.919   1.987
  170    HZ1  LYS  16           HZ1      LYS  16  51.712  13.200   2.142
  171    HZ2  LYS  16           HZ2      LYS  16  50.229  12.478   2.551
  172    HZ3  LYS  16           HZ3      LYS  16  50.762  13.860   3.382
  173    H    LYS  17           HN       LYS  17  48.519  11.201  -3.175
  174    HA   LYS  17           HA       LYS  17  45.812  11.994  -4.246
  175    HB2  LYS  17           HB2      LYS  17  48.343  13.476  -5.029
  176    HB3  LYS  17           HB1      LYS  17  46.760  13.662  -5.790
  177    HG2  LYS  17           HG2      LYS  17  47.331  14.286  -2.855
  178    HG3  LYS  17           HG1      LYS  17  47.293  15.502  -4.144
  179    HD2  LYS  17           HD2      LYS  17  44.902  14.575  -4.662
  180    HD3  LYS  17           HD1      LYS  17  45.005  13.829  -3.051
  181    HE2  LYS  17           HE2      LYS  17  43.908  16.034  -2.917
  182    HE3  LYS  17           HE1      LYS  17  45.461  16.051  -2.050
  183    HZ1  LYS  17           HZ1      LYS  17  46.495  17.159  -3.851
  184    HZ2  LYS  17           HZ2      LYS  17  45.044  17.992  -3.554
  185    HZ3  LYS  17           HZ3      LYS  17  45.162  16.929  -4.875
  186    H    GLY  18           HN       GLY  18  48.193  10.153  -3.639
  187    HA2  GLY  18           HA1      GLY  18  48.231   8.095  -5.291
  188    HA3  GLY  18           HA2      GLY  18  48.664   9.306  -6.540
  189    H    ARG  19           HN       ARG  19  49.856  10.888  -4.417
  190    HA   ARG  19           HA       ARG  19  52.164   9.817  -3.215
  191    HB2  ARG  19           HB2      ARG  19  52.613   9.233  -5.799
  192    HB3  ARG  19           HB1      ARG  19  52.840  11.009  -5.967
  193    HG2  ARG  19           HG2      ARG  19  54.696  10.949  -4.410
  194    HG3  ARG  19           HG1      ARG  19  54.312   9.309  -3.859
  195    HD2  ARG  19           HD2      ARG  19  56.220   9.863  -5.779
  196    HD3  ARG  19           HD1      ARG  19  55.372   8.306  -5.642
  197    HE   ARG  19           HE       ARG  19  53.744   9.956  -7.255
  198   HH11  ARG  19          HH11      ARG  19  55.851   7.459  -7.551
  199   HH12  ARG  19          HH12      ARG  19  56.439   7.862  -9.129
  200   HH21  ARG  19          HH21      ARG  19  54.961  10.999  -9.171
  201   HH22  ARG  19          HH22      ARG  19  55.936   9.866 -10.046
  202    H    LYS  20           HN       LYS  20  50.405  12.031  -5.047
  203    HA   LYS  20           HA       LYS  20  50.537  14.155  -5.570
  204    HB2  LYS  20           HB2      LYS  20  50.591  15.801  -4.191
  205    HB3  LYS  20           HB1      LYS  20  49.587  14.548  -3.508
  206    HG2  LYS  20           HG2      LYS  20  50.766  14.569  -1.513
  207    HG3  LYS  20           HG1      LYS  20  52.281  14.310  -2.378
  208    HD2  LYS  20           HD2      LYS  20  52.519  16.370  -1.179
  209    HD3  LYS  20           HD1      LYS  20  52.272  16.822  -2.876
  210    HE2  LYS  20           HE2      LYS  20  49.851  17.184  -2.421
  211    HE3  LYS  20           HE1      LYS  20  50.127  16.765  -0.713
  212    HZ1  LYS  20           HZ1      LYS  20  50.499  18.944  -0.479
  213    HZ2  LYS  20           HZ2      LYS  20  50.737  19.201  -2.141
  214    HZ3  LYS  20           HZ3      LYS  20  52.016  18.637  -1.174
  215    H    ALA  21           HN       ALA  21  51.741  13.264  -6.428
  216    HA   ALA  21           HA       ALA  21  53.909  14.597  -7.281
  217    HB1  ALA  21           HB1      ALA  21  54.962  13.111  -5.243
  218    HB2  ALA  21           HB2      ALA  21  55.858  13.400  -6.751
  219    HB3  ALA  21           HB3      ALA  21  54.950  11.891  -6.536
  220    H    VAL  22           HN       VAL  22  51.400  13.238  -6.678
  221    HA   VAL  22           HA       VAL  22  51.221  12.193  -9.530
  222    HB   VAL  22           HB       VAL  22  49.795  11.130  -7.053
  223   HG11  VAL  22          HG11      VAL  22  48.468   9.764  -8.831
  224   HG12  VAL  22          HG12      VAL  22  49.059  10.955 -10.010
  225   HG13  VAL  22          HG13      VAL  22  48.028  11.475  -8.663
  226   HG21  VAL  22          HG21      VAL  22  51.082   9.554  -9.328
  227   HG22  VAL  22          HG22      VAL  22  50.678   8.986  -7.693
  228   HG23  VAL  22          HG23      VAL  22  52.029  10.110  -7.935
  229    H    ILE  23           HN       ILE  23  51.189  14.521  -7.360
  230    HA   ILE  23           HA       ILE  23  49.243  15.865  -8.992
  231    HB   ILE  23           HB       ILE  23  48.487  15.392  -6.165
  232   HG12  ILE  23          HG12      ILE  23  47.114  14.795  -8.268
  233   HG13  ILE  23          HG11      ILE  23  46.241  15.583  -6.938
  234   HG21  ILE  23          HG21      ILE  23  47.370  17.669  -5.956
  235   HG22  ILE  23          HG22      ILE  23  48.396  18.199  -7.310
  236   HG23  ILE  23          HG23      ILE  23  49.141  17.659  -5.788
  237   HD11  ILE  23           HD1      ILE  23  46.153  17.671  -8.061
  238   HD12  ILE  23           HD2      ILE  23  45.805  16.473  -9.328
  239   HD13  ILE  23           HD3      ILE  23  47.417  17.210  -9.222
  240    H    ALA  24           HN       ALA  24  51.533  15.649  -6.617
  241    HA   ALA  24           HA       ALA  24  52.441  18.333  -7.373
  242    HB1  ALA  24           HB1      ALA  24  54.213  18.133  -5.859
  243    HB2  ALA  24           HB2      ALA  24  54.265  16.370  -6.008
  244    HB3  ALA  24           HB3      ALA  24  52.984  17.142  -5.059
  245    H    TRP  25           HN       TRP  25  51.810  15.223  -8.335
  246    HA   TRP  25           HA       TRP  25  52.526  14.096 -10.301
  247    HB2  TRP  25           HB2      TRP  25  51.802  16.283 -11.284
  248    HB3  TRP  25           HB1      TRP  25  53.499  16.818 -11.232
  249    HD1  TRP  25           HD1      TRP  25  51.660  13.627 -12.488
  250    HE1  TRP  25           HE1      TRP  25  52.639  12.953 -14.801
  251    HE3  TRP  25           HE3      TRP  25  55.148  17.340 -13.002
  252    HZ2  TRP  25           HZ2      TRP  25  54.666  13.919 -16.605
  253    HZ3  TRP  25           HZ3      TRP  25  56.593  17.443 -15.028
  254    HH2  TRP  25           HH2      TRP  25  56.356  15.737 -16.827
  Start of MODEL    3
    1    H1   ALA   1           HT1      ALA   1  50.411  11.613  12.657
    2    H2   ALA   1           HT2      ALA   1  49.810  12.340  11.244
    3    H3   ALA   1           HT3      ALA   1  51.377  12.703  11.790
    4    HA   ALA   1           HA       ALA   1  52.125  10.518  11.364
    5    HB1  ALA   1           HB1      ALA   1  49.767   9.590  11.910
    6    HB2  ALA   1           HB2      ALA   1  50.719   8.777  10.647
    7    HB3  ALA   1           HB3      ALA   1  49.398   9.891  10.192
    8    H    TRP   2           HN       TRP   2  50.465   9.708   8.728
    9    HA   TRP   2           HA       TRP   2  51.178  11.926   7.015
   10    HB2  TRP   2           HB2      TRP   2  53.172  10.126   7.474
   11    HB3  TRP   2           HB1      TRP   2  52.393   9.444   6.030
   12    HD1  TRP   2           HD1      TRP   2  51.621  12.249   4.666
   13    HE1  TRP   2           HE1      TRP   2  53.478  13.689   3.551
   14    HE3  TRP   2           HE3      TRP   2  55.699  10.321   7.086
   15    HZ2  TRP   2           HZ2      TRP   2  56.342  13.941   3.712
   16    HZ3  TRP   2           HZ3      TRP   2  57.983  11.176   6.589
   17    HH2  TRP   2           HH2      TRP   2  58.309  12.982   4.905
   18    H    LYS   3           HN       LYS   3  48.561  11.319   7.208
   19    HA   LYS   3           HA       LYS   3  46.808  10.166   6.013
   20    HB2  LYS   3           HB2      LYS   3  48.946  10.230   3.898
   21    HB3  LYS   3           HB1      LYS   3  47.485   9.244   3.699
   22    HG2  LYS   3           HG2      LYS   3  47.240  11.491   2.683
   23    HG3  LYS   3           HG1      LYS   3  46.079  11.227   4.008
   24    HD2  LYS   3           HD2      LYS   3  47.383  12.542   5.540
   25    HD3  LYS   3           HD1      LYS   3  48.775  12.580   4.432
   26    HE2  LYS   3           HE2      LYS   3  46.063  13.762   3.710
   27    HE3  LYS   3           HE1      LYS   3  47.351  14.707   4.497
   28    HZ1  LYS   3           HZ1      LYS   3  48.130  15.045   2.455
   29    HZ2  LYS   3           HZ2      LYS   3  47.115  13.869   1.768
   30    HZ3  LYS   3           HZ3      LYS   3  48.608  13.417   2.439
   31    H    GLU   4           HN       GLU   4  49.093   9.424   7.656
   32    HA   GLU   4           HA       GLU   4  49.440   7.829   8.975
   33    HB2  GLU   4           HB2      GLU   4  47.118   6.928   8.644
   34    HB3  GLU   4           HB1      GLU   4  47.861   5.818   7.470
   35    HG2  GLU   4           HG2      GLU   4  49.301   4.886   9.241
   36    HG3  GLU   4           HG1      GLU   4  48.630   6.041  10.416
   37    H    LYS   5           HN       LYS   5  51.350   8.704   7.814
   38    HA   LYS   5           HA       LYS   5  53.433   7.841   7.001
   39    HB2  LYS   5           HB2      LYS   5  52.544   4.941   7.293
   40    HB3  LYS   5           HB1      LYS   5  54.169   5.640   7.408
   41    HG2  LYS   5           HG2      LYS   5  53.287   6.869   9.531
   42    HG3  LYS   5           HG1      LYS   5  51.940   5.707   9.476
   43    HD2  LYS   5           HD2      LYS   5  53.690   3.852   9.380
   44    HD3  LYS   5           HD1      LYS   5  54.909   5.096   9.746
   45    HE2  LYS   5           HE2      LYS   5  53.675   5.687  11.819
   46    HE3  LYS   5           HE1      LYS   5  52.475   4.423  11.457
   47    HZ1  LYS   5           HZ1      LYS   5  53.833   2.857  12.224
   48    HZ2  LYS   5           HZ2      LYS   5  54.803   4.098  12.861
   49    HZ3  LYS   5           HZ3      LYS   5  55.159   3.436  11.337
   50    H    ILE   6           HN       ILE   6  50.287   7.686   6.367
   51    HA   ILE   6           HA       ILE   6  49.432   8.051   3.978
   52    HB   ILE   6           HB       ILE   6  51.544   6.010   3.107
   53   HG12  ILE   6          HG12      ILE   6  51.327   8.867   2.087
   54   HG13  ILE   6          HG11      ILE   6  52.091   8.596   3.661
   55   HG21  ILE   6          HG21      ILE   6  49.292   7.326   1.618
   56   HG22  ILE   6          HG22      ILE   6  49.713   5.613   1.691
   57   HG23  ILE   6          HG23      ILE   6  50.731   6.742   0.783
   58   HD11  ILE   6           HD1      ILE   6  52.950   7.427   0.979
   59   HD12  ILE   6           HD2      ILE   6  53.631   6.914   2.539
   60   HD13  ILE   6           HD3      ILE   6  53.835   8.591   1.987
   61    H    ARG   7           HN       ARG   7  47.506   7.539   4.101
   62    HA   ARG   7           HA       ARG   7  45.937   5.751   3.181
   63    HB2  ARG   7           HB2      ARG   7  47.471   3.941   5.087
   64    HB3  ARG   7           HB1      ARG   7  45.847   3.562   4.502
   65    HG2  ARG   7           HG2      ARG   7  46.510   3.272   2.282
   66    HG3  ARG   7           HG1      ARG   7  47.961   4.272   2.456
   67    HD2  ARG   7           HD2      ARG   7  48.369   1.756   2.283
   68    HD3  ARG   7           HD1      ARG   7  49.107   2.547   3.696
   69    HE   ARG   7           HE       ARG   7  46.602   1.694   4.588
   70   HH11  ARG   7          HH11      ARG   7  49.360   0.290   3.066
   71   HH12  ARG   7          HH12      ARG   7  49.153  -1.256   3.819
   72   HH21  ARG   7          HH21      ARG   7  46.321  -0.313   5.585
   73   HH22  ARG   7          HH22      ARG   7  47.432  -1.598   5.245
   74    H    LYS   8           HN       LYS   8  45.595   7.935   4.534
   75    HA   LYS   8           HA       LYS   8  43.663   6.969   6.573
   76    HB2  LYS   8           HB2      LYS   8  45.747   8.423   7.477
   77    HB3  LYS   8           HB1      LYS   8  44.748   9.766   6.895
   78    HG2  LYS   8           HG2      LYS   8  42.821   8.711   8.228
   79    HG3  LYS   8           HG1      LYS   8  44.051   7.676   8.992
   80    HD2  LYS   8           HD2      LYS   8  44.056  10.731   8.981
   81    HD3  LYS   8           HD1      LYS   8  43.602   9.701  10.359
   82    HE2  LYS   8           HE2      LYS   8  45.961   8.629  10.083
   83    HE3  LYS   8           HE1      LYS   8  46.333  10.053   9.081
   84    HZ1  LYS   8           HZ1      LYS   8  46.889  10.303  11.475
   85    HZ2  LYS   8           HZ2      LYS   8  45.232  10.208  11.840
   86    HZ3  LYS   8           HZ3      LYS   8  45.823  11.488  10.892
   87    H    LYS   9           HN       LYS   9  44.474   8.768   3.728
   88    HA   LYS   9           HA       LYS   9  41.942  10.312   3.835
   89    HB2  LYS   9           HB2      LYS   9  43.696  10.501   1.896
   90    HB3  LYS   9           HB1      LYS   9  42.808   9.071   1.208
   91    HG2  LYS   9           HG2      LYS   9  40.676  10.511   1.568
   92    HG3  LYS   9           HG1      LYS   9  41.765  11.886   1.844
   93    HD2  LYS   9           HD2      LYS   9  42.855  11.292  -0.399
   94    HD3  LYS   9           HD1      LYS   9  41.474  10.196  -0.662
   95    HE2  LYS   9           HE2      LYS   9  39.916  12.117  -0.333
   96    HE3  LYS   9           HE1      LYS   9  41.319  13.200  -0.157
   97    HZ1  LYS   9           HZ1      LYS   9  41.467  13.325  -2.350
   98    HZ2  LYS   9           HZ2      LYS   9  40.088  12.347  -2.514
   99    HZ3  LYS   9           HZ3      LYS   9  41.633  11.643  -2.483
  100    H    LEU  10           HN       LEU  10  42.946   7.108   3.568
  101    HA   LEU  10           HA       LEU  10  40.656   5.635   4.105
  102    HB2  LEU  10           HB2      LEU  10  40.746   6.788   1.312
  103    HB3  LEU  10           HB1      LEU  10  40.224   5.103   1.452
  104    HG   LEU  10           HG       LEU  10  38.833   7.024   3.336
  105   HD11  LEU  10          HD11      LEU  10  38.842   8.138   1.023
  106   HD12  LEU  10          HD12      LEU  10  37.235   7.738   1.667
  107   HD13  LEU  10          HD13      LEU  10  37.979   6.704   0.425
  108   HD21  LEU  10          HD21      LEU  10  36.955   5.500   2.914
  109   HD22  LEU  10          HD22      LEU  10  38.409   4.578   3.365
  110   HD23  LEU  10          HD23      LEU  10  37.899   4.656   1.662
  111    H    LYS  11           HN       LYS  11  42.510   6.354   1.387
  112    HA   LYS  11           HA       LYS  11  44.226   4.057   1.418
  113    HB2  LYS  11           HB2      LYS  11  42.799   5.282  -0.714
  114    HB3  LYS  11           HB1      LYS  11  43.975   3.969  -0.988
  115    HG2  LYS  11           HG2      LYS  11  42.581   2.295  -0.163
  116    HG3  LYS  11           HG1      LYS  11  41.653   3.404   0.849
  117    HD2  LYS  11           HD2      LYS  11  40.544   4.357  -1.113
  118    HD3  LYS  11           HD1      LYS  11  41.556   3.365  -2.192
  119    HE2  LYS  11           HE2      LYS  11  39.388   2.276  -1.943
  120    HE3  LYS  11           HE1      LYS  11  40.612   1.307  -1.086
  121    HZ1  LYS  11           HZ1      LYS  11  39.018   1.460   0.514
  122    HZ2  LYS  11           HZ2      LYS  11  38.449   2.973  -0.006
  123    HZ3  LYS  11           HZ3      LYS  11  39.889   2.866   0.888
  124    H    ASN  12           HN       ASN  12  43.540   6.704   1.569
  125    HA   ASN  12           HA       ASN  12  44.935   8.826   1.652
  126    HB2  ASN  12           HB2      ASN  12  47.000   7.578   2.255
  127    HB3  ASN  12           HB1      ASN  12  47.205   7.205   0.558
  128   HD21  ASN  12          HD21      ASN  12  49.025   8.947   2.201
  129   HD22  ASN  12          HD22      ASN  12  48.948  10.538   1.449
  130    H    GLU  13           HN       GLU  13  43.228   7.358  -0.003
  131    HA   GLU  13           HA       GLU  13  42.515   7.209  -2.233
  132    HB2  GLU  13           HB2      GLU  13  43.202   9.789  -2.176
  133    HB3  GLU  13           HB1      GLU  13  44.640   9.237  -3.061
  134    HG2  GLU  13           HG2      GLU  13  43.005   9.865  -4.719
  135    HG3  GLU  13           HG1      GLU  13  43.034   8.085  -4.691
  136    H    ILE  14           HN       ILE  14  44.603   5.488  -0.887
  137    HA   ILE  14           HA       ILE  14  46.131   3.904  -1.723
  138    HB   ILE  14           HB       ILE  14  46.359   5.304  -4.428
  139   HG12  ILE  14          HG12      ILE  14  43.951   4.474  -3.779
  140   HG13  ILE  14          HG11      ILE  14  44.632   3.950  -5.328
  141   HG21  ILE  14          HG21      ILE  14  48.194   3.844  -4.005
  142   HG22  ILE  14          HG22      ILE  14  47.093   2.978  -5.102
  143   HG23  ILE  14          HG23      ILE  14  47.131   2.567  -3.371
  144   HD11  ILE  14           HD1      ILE  14  45.160   1.768  -4.456
  145   HD12  ILE  14           HD2      ILE  14  43.500   2.132  -3.931
  146   HD13  ILE  14           HD3      ILE  14  44.847   2.285  -2.784
  147    H    LYS  15           HN       LYS  15  46.520   7.362  -2.376
  148    HA   LYS  15           HA       LYS  15  48.841   7.606  -0.725
  149    HB2  LYS  15           HB2      LYS  15  49.400   6.873  -3.540
  150    HB3  LYS  15           HB1      LYS  15  50.032   8.505  -3.122
  151    HG2  LYS  15           HG2      LYS  15  51.355   7.587  -1.318
  152    HG3  LYS  15           HG1      LYS  15  50.562   5.997  -1.439
  153    HD2  LYS  15           HD2      LYS  15  51.548   5.596  -3.619
  154    HD3  LYS  15           HD1      LYS  15  52.193   7.255  -3.684
  155    HE2  LYS  15           HE2      LYS  15  53.993   5.737  -3.033
  156    HE3  LYS  15           HE1      LYS  15  53.560   6.747  -1.633
  157    HZ1  LYS  15           HZ1      LYS  15  52.277   4.116  -2.053
  158    HZ2  LYS  15           HZ2      LYS  15  52.459   5.001  -0.614
  159    HZ3  LYS  15           HZ3      LYS  15  53.799   4.222  -1.312
  160    H    LYS  16           HN       LYS  16  49.376   9.667  -0.510
  161    HA   LYS  16           HA       LYS  16  48.329  11.748  -0.579
  162    HB2  LYS  16           HB2      LYS  16  50.572  11.341  -2.069
  163    HB3  LYS  16           HB1      LYS  16  49.820  12.893  -2.415
  164    HG2  LYS  16           HG2      LYS  16  51.449  13.336  -0.714
  165    HG3  LYS  16           HG1      LYS  16  49.901  13.287   0.154
  166    HD2  LYS  16           HD2      LYS  16  50.432  10.761   0.524
  167    HD3  LYS  16           HD1      LYS  16  52.085  11.173   0.024
  168    HE2  LYS  16           HE2      LYS  16  50.544  12.456   2.324
  169    HE3  LYS  16           HE1      LYS  16  51.873  11.282   2.482
  170    HZ1  LYS  16           HZ1      LYS  16  53.358  12.890   2.196
  171    HZ2  LYS  16           HZ2      LYS  16  52.096  14.023   2.310
  172    HZ3  LYS  16           HZ3      LYS  16  52.600  13.457   0.789
  173    H    LYS  17           HN       LYS  17  48.848  11.670  -3.287
  174    HA   LYS  17           HA       LYS  17  45.967  11.793  -4.164
  175    HB2  LYS  17           HB2      LYS  17  47.182  14.252  -3.900
  176    HB3  LYS  17           HB1      LYS  17  47.704  13.816  -5.536
  177    HG2  LYS  17           HG2      LYS  17  45.664  14.933  -5.943
  178    HG3  LYS  17           HG1      LYS  17  45.154  13.229  -5.915
  179    HD2  LYS  17           HD2      LYS  17  44.631  13.551  -3.429
  180    HD3  LYS  17           HD1      LYS  17  44.908  15.289  -3.681
  181    HE2  LYS  17           HE2      LYS  17  42.531  14.883  -3.912
  182    HE3  LYS  17           HE1      LYS  17  43.184  15.213  -5.534
  183    HZ1  LYS  17           HZ1      LYS  17  41.965  12.831  -4.510
  184    HZ2  LYS  17           HZ2      LYS  17  43.480  12.513  -5.212
  185    HZ3  LYS  17           HZ3      LYS  17  42.267  13.286  -6.116
  186    H    GLY  18           HN       GLY  18  48.579  10.488  -3.654
  187    HA2  GLY  18           HA1      GLY  18  48.929   8.404  -5.198
  188    HA3  GLY  18           HA2      GLY  18  48.996   9.525  -6.580
  189    H    ARG  19           HN       ARG  19  50.136  10.591  -3.623
  190    HA   ARG  19           HA       ARG  19  52.571  10.340  -2.848
  191    HB2  ARG  19           HB2      ARG  19  53.316   9.432  -5.183
  192    HB3  ARG  19           HB1      ARG  19  53.128  11.155  -5.794
  193    HG2  ARG  19           HG2      ARG  19  54.900  11.869  -4.319
  194    HG3  ARG  19           HG1      ARG  19  54.842  10.400  -3.330
  195    HD2  ARG  19           HD2      ARG  19  55.766   9.058  -5.116
  196    HD3  ARG  19           HD1      ARG  19  55.643  10.403  -6.270
  197    HE   ARG  19           HE       ARG  19  57.801   9.989  -4.400
  198   HH11  ARG  19          HH11      ARG  19  56.707  12.499  -3.280
  199   HH12  ARG  19          HH12      ARG  19  57.470  13.715  -4.248
  200   HH21  ARG  19          HH21      ARG  19  58.401  11.511  -6.758
  201   HH22  ARG  19          HH22      ARG  19  58.429  13.157  -6.217
  202    H    LYS  20           HN       LYS  20  50.782  11.983  -5.141
  203    HA   LYS  20           HA       LYS  20  50.706  13.947  -6.008
  204    HB2  LYS  20           HB2      LYS  20  50.153  15.705  -5.029
  205    HB3  LYS  20           HB1      LYS  20  49.423  14.404  -4.108
  206    HG2  LYS  20           HG2      LYS  20  51.573  14.749  -2.528
  207    HG3  LYS  20           HG1      LYS  20  51.545  16.373  -3.237
  208    HD2  LYS  20           HD2      LYS  20  49.094  16.522  -2.553
  209    HD3  LYS  20           HD1      LYS  20  49.348  15.036  -1.612
  210    HE2  LYS  20           HE2      LYS  20  50.641  17.753  -1.230
  211    HE3  LYS  20           HE1      LYS  20  49.730  16.783  -0.049
  212    HZ1  LYS  20           HZ1      LYS  20  52.285  15.863  -1.253
  213    HZ2  LYS  20           HZ2      LYS  20  51.484  15.241   0.110
  214    HZ3  LYS  20           HZ3      LYS  20  52.227  16.768   0.181
  215    H    ALA  21           HN       ALA  21  52.051  13.487  -6.708
  216    HA   ALA  21           HA       ALA  21  53.993  15.137  -7.425
  217    HB1  ALA  21           HB1      ALA  21  55.463  12.729  -6.411
  218    HB2  ALA  21           HB2      ALA  21  55.132  14.015  -5.227
  219    HB3  ALA  21           HB3      ALA  21  56.089  14.368  -6.684
  220    H    VAL  22           HN       VAL  22  51.765  13.175  -7.046
  221    HA   VAL  22           HA       VAL  22  52.270  12.140  -9.874
  222    HB   VAL  22           HB       VAL  22  50.720  10.736  -7.656
  223   HG11  VAL  22          HG11      VAL  22  50.453  10.540 -10.666
  224   HG12  VAL  22          HG12      VAL  22  49.174  10.588  -9.428
  225   HG13  VAL  22          HG13      VAL  22  50.131   9.111  -9.656
  226   HG21  VAL  22          HG21      VAL  22  52.083   8.760  -8.373
  227   HG22  VAL  22          HG22      VAL  22  53.119  10.113  -7.865
  228   HG23  VAL  22          HG23      VAL  22  52.878   9.780  -9.592
  229    H    ILE  23           HN       ILE  23  51.418  14.415  -7.945
  230    HA   ILE  23           HA       ILE  23  49.468  15.227  -9.888
  231    HB   ILE  23           HB       ILE  23  48.449  15.274  -7.042
  232   HG12  ILE  23          HG12      ILE  23  48.195  12.989  -8.211
  233   HG13  ILE  23          HG11      ILE  23  46.699  13.723  -7.650
  234   HG21  ILE  23          HG21      ILE  23  47.378  16.400  -9.644
  235   HG22  ILE  23          HG22      ILE  23  47.747  17.260  -8.129
  236   HG23  ILE  23          HG23      ILE  23  46.343  16.170  -8.213
  237   HD11  ILE  23           HD1      ILE  23  47.680  14.011 -10.516
  238   HD12  ILE  23           HD2      ILE  23  46.086  14.437  -9.862
  239   HD13  ILE  23           HD3      ILE  23  46.575  12.734  -9.974
  240    H    ALA  24           HN       ALA  24  51.295  15.518  -7.150
  241    HA   ALA  24           HA       ALA  24  51.577  18.376  -7.735
  242    HB1  ALA  24           HB1      ALA  24  52.040  17.150  -5.375
  243    HB2  ALA  24           HB2      ALA  24  52.972  18.570  -5.884
  244    HB3  ALA  24           HB3      ALA  24  53.643  16.945  -6.106
  245    H    TRP  25           HN       TRP  25  51.960  15.255  -8.788
  246    HA   TRP  25           HA       TRP  25  53.234  14.436 -10.610
  247    HB2  TRP  25           HB2      TRP  25  52.245  16.452 -11.709
  248    HB3  TRP  25           HB1      TRP  25  53.728  17.351 -11.312
  249    HD1  TRP  25           HD1      TRP  25  52.798  14.021 -13.083
  250    HE1  TRP  25           HE1      TRP  25  54.401  13.672 -15.102
  251    HE3  TRP  25           HE3      TRP  25  55.749  18.163 -12.496
  252    HZ2  TRP  25           HZ2      TRP  25  56.653  15.031 -16.276
  253    HZ3  TRP  25           HZ3      TRP  25  57.618  18.617 -14.078
  254    HH2  TRP  25           HH2      TRP  25  58.073  17.057 -15.966
  Start of MODEL    4
    1    H1   ALA   1           HT1      ALA   1  53.568   1.925  10.009
    2    H2   ALA   1           HT2      ALA   1  52.357   0.993   9.265
    3    H3   ALA   1           HT3      ALA   1  51.937   2.216  10.369
    4    HA   ALA   1           HA       ALA   1  53.046   3.819   8.828
    5    HB1  ALA   1           HB1      ALA   1  53.997   3.010   6.921
    6    HB2  ALA   1           HB2      ALA   1  52.489   2.164   6.450
    7    HB3  ALA   1           HB3      ALA   1  53.684   1.367   7.519
    8    H    TRP   2           HN       TRP   2  51.726   3.959   6.425
    9    HA   TRP   2           HA       TRP   2  49.007   3.324   6.740
   10    HB2  TRP   2           HB2      TRP   2  49.744   6.188   6.916
   11    HB3  TRP   2           HB1      TRP   2  48.097   5.637   6.622
   12    HD1  TRP   2           HD1      TRP   2  50.738   5.855   9.374
   13    HE1  TRP   2           HE1      TRP   2  49.661   5.304  11.671
   14    HE3  TRP   2           HE3      TRP   2  46.148   4.272   7.753
   15    HZ2  TRP   2           HZ2      TRP   2  47.143   4.308  12.643
   16    HZ3  TRP   2           HZ3      TRP   2  44.423   3.525   9.385
   17    HH2  TRP   2           HH2      TRP   2  44.916   3.540  11.827
   18    H    LYS   3           HN       LYS   3  49.528   2.227   4.769
   19    HA   LYS   3           HA       LYS   3  49.999   2.152   2.597
   20    HB2  LYS   3           HB2      LYS   3  48.037   4.150   2.273
   21    HB3  LYS   3           HB1      LYS   3  49.376   4.507   1.199
   22    HG2  LYS   3           HG2      LYS   3  48.084   1.764   1.355
   23    HG3  LYS   3           HG1      LYS   3  47.506   3.041   0.264
   24    HD2  LYS   3           HD2      LYS   3  49.559   3.108  -0.947
   25    HD3  LYS   3           HD1      LYS   3  50.424   2.180   0.298
   26    HE2  LYS   3           HE2      LYS   3  48.074   1.041  -1.267
   27    HE3  LYS   3           HE1      LYS   3  49.764   0.871  -1.800
   28    HZ1  LYS   3           HZ1      LYS   3  49.724   0.186   0.880
   29    HZ2  LYS   3           HZ2      LYS   3  49.909  -0.860  -0.445
   30    HZ3  LYS   3           HZ3      LYS   3  48.366  -0.574   0.206
   31    H    GLU   4           HN       GLU   4  51.236   3.836   4.670
   32    HA   GLU   4           HA       GLU   4  53.294   4.109   5.008
   33    HB2  GLU   4           HB2      GLU   4  53.999   3.508   2.621
   34    HB3  GLU   4           HB1      GLU   4  54.026   5.268   2.383
   35    HG2  GLU   4           HG2      GLU   4  55.585   3.966   4.659
   36    HG3  GLU   4           HG1      GLU   4  56.262   4.054   3.019
   37    H    LYS   5           HN       LYS   5  51.788   5.111   6.356
   38    HA   LYS   5           HA       LYS   5  51.668   7.117   7.647
   39    HB2  LYS   5           HB2      LYS   5  53.684   8.552   5.857
   40    HB3  LYS   5           HB1      LYS   5  53.230   8.904   7.533
   41    HG2  LYS   5           HG2      LYS   5  54.202   6.586   8.131
   42    HG3  LYS   5           HG1      LYS   5  54.936   6.603   6.512
   43    HD2  LYS   5           HD2      LYS   5  56.073   8.735   7.031
   44    HD3  LYS   5           HD1      LYS   5  55.326   8.745   8.647
   45    HE2  LYS   5           HE2      LYS   5  57.525   7.846   8.957
   46    HE3  LYS   5           HE1      LYS   5  56.427   6.448   9.012
   47    HZ1  LYS   5           HZ1      LYS   5  57.061   5.767   6.915
   48    HZ2  LYS   5           HZ2      LYS   5  58.528   6.358   7.535
   49    HZ3  LYS   5           HZ3      LYS   5  57.622   7.298   6.449
   50    H    ILE   6           HN       ILE   6  51.387   6.073   4.694
   51    HA   ILE   6           HA       ILE   6  49.744   8.572   3.628
   52    HB   ILE   6           HB       ILE   6  50.671   5.990   2.375
   53   HG12  ILE   6          HG12      ILE   6  52.264   8.015   2.824
   54   HG13  ILE   6          HG11      ILE   6  52.319   7.210   1.253
   55   HG21  ILE   6          HG21      ILE   6  48.522   6.526   1.442
   56   HG22  ILE   6          HG22      ILE   6  49.818   6.788   0.260
   57   HG23  ILE   6          HG23      ILE   6  49.078   8.168   1.091
   58   HD11  ILE   6           HD1      ILE   6  52.332   9.752   1.203
   59   HD12  ILE   6           HD2      ILE   6  50.661   9.714   1.799
   60   HD13  ILE   6           HD3      ILE   6  51.064   8.993   0.220
   61    H    ARG   7           HN       ARG   7  48.439   5.054   3.111
   62    HA   ARG   7           HA       ARG   7  45.867   5.312   3.192
   63    HB2  ARG   7           HB2      ARG   7  47.222   3.811   5.455
   64    HB3  ARG   7           HB1      ARG   7  45.490   3.845   5.334
   65    HG2  ARG   7           HG2      ARG   7  45.996   2.985   2.831
   66    HG3  ARG   7           HG1      ARG   7  47.491   2.435   3.575
   67    HD2  ARG   7           HD2      ARG   7  44.792   1.739   4.779
   68    HD3  ARG   7           HD1      ARG   7  45.592   0.738   3.551
   69    HE   ARG   7           HE       ARG   7  46.488   1.126   6.348
   70   HH11  ARG   7          HH11      ARG   7  48.760   1.311   4.271
   71   HH12  ARG   7          HH12      ARG   7  49.316  -0.330   4.264
   72   HH21  ARG   7          HH21      ARG   7  46.501  -1.570   5.864
   73   HH22  ARG   7          HH22      ARG   7  48.038  -1.960   5.167
   74    H    LYS   8           HN       LYS   8  46.325   7.859   3.828
   75    HA   LYS   8           HA       LYS   8  45.403   8.188   6.583
   76    HB2  LYS   8           HB2      LYS   8  47.337   9.579   6.136
   77    HB3  LYS   8           HB1      LYS   8  46.595  10.165   4.630
   78    HG2  LYS   8           HG2      LYS   8  44.910  11.397   5.852
   79    HG3  LYS   8           HG1      LYS   8  45.377  10.626   7.388
   80    HD2  LYS   8           HD2      LYS   8  47.558  11.728   7.331
   81    HD3  LYS   8           HD1      LYS   8  47.210  12.404   5.721
   82    HE2  LYS   8           HE2      LYS   8  46.780  14.148   7.344
   83    HE3  LYS   8           HE1      LYS   8  45.204  13.577   6.746
   84    HZ1  LYS   8           HZ1      LYS   8  46.017  11.996   8.940
   85    HZ2  LYS   8           HZ2      LYS   8  44.651  12.995   8.795
   86    HZ3  LYS   8           HZ3      LYS   8  46.115  13.631   9.379
   87    H    LYS   9           HN       LYS   9  44.740   8.788   3.335
   88    HA   LYS   9           HA       LYS   9  42.069   9.925   4.174
   89    HB2  LYS   9           HB2      LYS   9  42.918  10.361   1.752
   90    HB3  LYS   9           HB1      LYS   9  42.482   8.648   1.432
   91    HG2  LYS   9           HG2      LYS   9  40.245   9.972   2.806
   92    HG3  LYS   9           HG1      LYS   9  40.733  10.952   1.409
   93    HD2  LYS   9           HD2      LYS   9  40.569   8.941  -0.046
   94    HD3  LYS   9           HD1      LYS   9  40.057   7.976   1.360
   95    HE2  LYS   9           HE2      LYS   9  38.600  10.484   0.428
   96    HE3  LYS   9           HE1      LYS   9  38.152   8.840  -0.086
   97    HZ1  LYS   9           HZ1      LYS   9  37.083   9.950   2.024
   98    HZ2  LYS   9           HZ2      LYS   9  38.483   9.360   2.784
   99    HZ3  LYS   9           HZ3      LYS   9  37.429   8.290   1.988
  100    H    LEU  10           HN       LEU  10  43.888   6.983   3.981
  101    HA   LEU  10           HA       LEU  10  42.400   5.090   5.280
  102    HB2  LEU  10           HB2      LEU  10  41.131   5.818   2.640
  103    HB3  LEU  10           HB1      LEU  10  41.040   4.125   3.177
  104    HG   LEU  10           HG       LEU  10  40.114   6.227   5.176
  105   HD11  LEU  10          HD11      LEU  10  37.879   6.225   4.299
  106   HD12  LEU  10          HD12      LEU  10  38.254   4.937   3.131
  107   HD13  LEU  10          HD13      LEU  10  38.916   6.569   2.897
  108   HD21  LEU  10          HD21      LEU  10  39.280   3.357   4.579
  109   HD22  LEU  10          HD22      LEU  10  38.722   4.354   5.944
  110   HD23  LEU  10          HD23      LEU  10  40.428   3.856   5.843
  111    H    LYS  11           HN       LYS  11  42.812   6.032   2.142
  112    HA   LYS  11           HA       LYS  11  44.735   4.139   1.281
  113    HB2  LYS  11           HB2      LYS  11  42.398   5.253   0.079
  114    HB3  LYS  11           HB1      LYS  11  43.503   4.208  -0.843
  115    HG2  LYS  11           HG2      LYS  11  42.771   2.239   0.131
  116    HG3  LYS  11           HG1      LYS  11  42.355   3.017   1.661
  117    HD2  LYS  11           HD2      LYS  11  40.307   2.317   0.521
  118    HD3  LYS  11           HD1      LYS  11  40.383   4.094   0.548
  119    HE2  LYS  11           HE2      LYS  11  41.427   2.473  -1.808
  120    HE3  LYS  11           HE1      LYS  11  39.730   2.996  -1.694
  121    HZ1  LYS  11           HZ1      LYS  11  40.651   4.759  -2.785
  122    HZ2  LYS  11           HZ2      LYS  11  42.164   4.610  -2.027
  123    HZ3  LYS  11           HZ3      LYS  11  40.852   5.289  -1.187
  124    H    ASN  12           HN       ASN  12  43.775   6.575   2.111
  125    HA   ASN  12           HA       ASN  12  44.612   8.968   1.771
  126    HB2  ASN  12           HB2      ASN  12  46.822   7.812   2.192
  127    HB3  ASN  12           HB1      ASN  12  46.966   7.798   0.434
  128   HD21  ASN  12          HD21      ASN  12  48.458   9.409   2.642
  129   HD22  ASN  12          HD22      ASN  12  48.309  11.078   2.087
  130    H    GLU  13           HN       GLU  13  43.116   7.228   0.088
  131    HA   GLU  13           HA       GLU  13  42.023   7.350  -1.970
  132    HB2  GLU  13           HB2      GLU  13  44.126   9.354  -2.898
  133    HB3  GLU  13           HB1      GLU  13  42.571   8.983  -3.665
  134    HG2  GLU  13           HG2      GLU  13  41.305  10.073  -1.992
  135    HG3  GLU  13           HG1      GLU  13  42.643  10.057  -0.824
  136    H    ILE  14           HN       ILE  14  44.249   5.521  -1.024
  137    HA   ILE  14           HA       ILE  14  45.442   3.855  -2.098
  138    HB   ILE  14           HB       ILE  14  43.989   4.764  -4.396
  139   HG12  ILE  14          HG12      ILE  14  44.288   2.418  -3.576
  140   HG13  ILE  14          HG11      ILE  14  44.493   2.596  -5.330
  141   HG21  ILE  14          HG21      ILE  14  45.957   6.040  -5.186
  142   HG22  ILE  14          HG22      ILE  14  45.625   4.653  -6.245
  143   HG23  ILE  14          HG23      ILE  14  46.964   4.582  -5.079
  144   HD11  ILE  14           HD1      ILE  14  46.239   1.163  -3.937
  145   HD12  ILE  14           HD2      ILE  14  46.932   2.750  -3.533
  146   HD13  ILE  14           HD3      ILE  14  46.816   2.236  -5.232
  147    H    LYS  15           HN       LYS  15  45.809   7.230  -2.380
  148    HA   LYS  15           HA       LYS  15  48.279   7.462  -1.275
  149    HB2  LYS  15           HB2      LYS  15  48.580   6.690  -4.125
  150    HB3  LYS  15           HB1      LYS  15  49.373   8.240  -3.688
  151    HG2  LYS  15           HG2      LYS  15  50.815   7.206  -2.126
  152    HG3  LYS  15           HG1      LYS  15  49.788   5.769  -1.945
  153    HD2  LYS  15           HD2      LYS  15  50.343   5.095  -4.279
  154    HD3  LYS  15           HD1      LYS  15  51.410   6.514  -4.419
  155    HE2  LYS  15           HE2      LYS  15  51.706   4.271  -2.374
  156    HE3  LYS  15           HE1      LYS  15  52.699   4.475  -3.837
  157    HZ1  LYS  15           HZ1      LYS  15  53.273   6.730  -2.954
  158    HZ2  LYS  15           HZ2      LYS  15  53.876   5.435  -2.033
  159    HZ3  LYS  15           HZ3      LYS  15  52.517   6.302  -1.497
  160    H    LYS  16           HN       LYS  16  48.731   9.525  -1.019
  161    HA   LYS  16           HA       LYS  16  47.653  11.594  -1.143
  162    HB2  LYS  16           HB2      LYS  16  50.038  11.163  -2.232
  163    HB3  LYS  16           HB1      LYS  16  49.294  12.517  -3.069
  164    HG2  LYS  16           HG2      LYS  16  50.580  13.504  -1.316
  165    HG3  LYS  16           HG1      LYS  16  48.904  13.536  -0.719
  166    HD2  LYS  16           HD2      LYS  16  49.399  11.297   0.424
  167    HD3  LYS  16           HD1      LYS  16  51.110  11.567   0.016
  168    HE2  LYS  16           HE2      LYS  16  50.620  12.373   2.301
  169    HE3  LYS  16           HE1      LYS  16  51.056  13.729   1.235
  170    HZ1  LYS  16           HZ1      LYS  16  48.231  13.063   1.311
  171    HZ2  LYS  16           HZ2      LYS  16  48.996  14.580   1.343
  172    HZ3  LYS  16           HZ3      LYS  16  48.860  13.663   2.767
  173    H    LYS  17           HN       LYS  17  48.283  11.446  -3.825
  174    HA   LYS  17           HA       LYS  17  45.458  11.411  -4.839
  175    HB2  LYS  17           HB2      LYS  17  46.478  14.011  -4.584
  176    HB3  LYS  17           HB1      LYS  17  46.954  13.596  -6.240
  177    HG2  LYS  17           HG2      LYS  17  44.648  13.077  -6.835
  178    HG3  LYS  17           HG1      LYS  17  44.125  13.306  -5.149
  179    HD2  LYS  17           HD2      LYS  17  44.612  15.655  -5.212
  180    HD3  LYS  17           HD1      LYS  17  45.482  15.505  -6.755
  181    HE2  LYS  17           HE2      LYS  17  43.210  16.434  -7.100
  182    HE3  LYS  17           HE1      LYS  17  43.378  14.845  -7.885
  183    HZ1  LYS  17           HZ1      LYS  17  42.446  13.922  -5.722
  184    HZ2  LYS  17           HZ2      LYS  17  41.362  14.746  -6.737
  185    HZ3  LYS  17           HZ3      LYS  17  41.985  15.512  -5.355
  186    H    GLY  18           HN       GLY  18  48.094  10.327  -4.193
  187    HA2  GLY  18           HA1      GLY  18  48.711   8.322  -5.799
  188    HA3  GLY  18           HA2      GLY  18  48.846   9.535  -7.088
  189    H    ARG  19           HN       ARG  19  49.748  10.007  -3.724
  190    HA   ARG  19           HA       ARG  19  52.058  10.073  -2.865
  191    HB2  ARG  19           HB2      ARG  19  52.928   9.142  -5.218
  192    HB3  ARG  19           HB1      ARG  19  52.999  10.907  -5.695
  193    HG2  ARG  19           HG2      ARG  19  54.478  11.289  -3.709
  194    HG3  ARG  19           HG1      ARG  19  54.398   9.565  -3.282
  195    HD2  ARG  19           HD2      ARG  19  55.516   8.918  -5.311
  196    HD3  ARG  19           HD1      ARG  19  55.361  10.553  -5.996
  197    HE   ARG  19           HE       ARG  19  56.820  10.960  -3.676
  198   HH11  ARG  19          HH11      ARG  19  58.249  11.525  -6.097
  199   HH12  ARG  19          HH12      ARG  19  59.454  10.284  -6.193
  200   HH21  ARG  19          HH21      ARG  19  57.868   8.200  -3.920
  201   HH22  ARG  19          HH22      ARG  19  59.238   8.402  -4.960
  202    H    LYS  20           HN       LYS  20  50.378  11.691  -5.282
  203    HA   LYS  20           HA       LYS  20  50.676  13.586  -6.227
  204    HB2  LYS  20           HB2      LYS  20  49.507  15.164  -5.726
  205    HB3  LYS  20           HB1      LYS  20  48.760  13.820  -4.891
  206    HG2  LYS  20           HG2      LYS  20  49.132  14.740  -2.735
  207    HG3  LYS  20           HG1      LYS  20  50.526  15.670  -3.267
  208    HD2  LYS  20           HD2      LYS  20  48.986  17.161  -4.565
  209    HD3  LYS  20           HD1      LYS  20  47.612  16.242  -3.909
  210    HE2  LYS  20           HE2      LYS  20  48.399  16.805  -1.592
  211    HE3  LYS  20           HE1      LYS  20  49.668  17.826  -2.311
  212    HZ1  LYS  20           HZ1      LYS  20  48.161  19.362  -3.012
  213    HZ2  LYS  20           HZ2      LYS  20  47.331  18.799  -1.640
  214    HZ3  LYS  20           HZ3      LYS  20  46.899  18.243  -3.185
  215    H    ALA  21           HN       ALA  21  52.069  13.326  -6.552
  216    HA   ALA  21           HA       ALA  21  53.998  15.194  -6.715
  217    HB1  ALA  21           HB1      ALA  21  55.910  14.473  -5.505
  218    HB2  ALA  21           HB2      ALA  21  55.257  12.828  -5.316
  219    HB3  ALA  21           HB3      ALA  21  54.618  14.160  -4.325
  220    H    VAL  22           HN       VAL  22  51.985  13.000  -7.139
  221    HA   VAL  22           HA       VAL  22  53.402  12.336  -9.738
  222    HB   VAL  22           HB       VAL  22  52.845  10.207  -7.933
  223   HG11  VAL  22          HG11      VAL  22  50.358  10.625  -8.499
  224   HG12  VAL  22          HG12      VAL  22  50.959   8.977  -8.764
  225   HG13  VAL  22          HG13      VAL  22  50.750  10.078 -10.143
  226   HG21  VAL  22          HG21      VAL  22  54.399  10.091  -9.814
  227   HG22  VAL  22          HG22      VAL  22  53.043  10.158 -10.965
  228   HG23  VAL  22          HG23      VAL  22  53.239   8.744  -9.903
  229    H    ILE  23           HN       ILE  23  51.829  14.208  -8.033
  230    HA   ILE  23           HA       ILE  23  50.167  14.874 -10.226
  231    HB   ILE  23           HB       ILE  23  48.605  14.209  -7.718
  232   HG12  ILE  23          HG12      ILE  23  48.525  13.210 -10.602
  233   HG13  ILE  23          HG11      ILE  23  48.822  12.266  -9.129
  234   HG21  ILE  23          HG21      ILE  23  46.646  15.280  -8.798
  235   HG22  ILE  23          HG22      ILE  23  47.621  15.655 -10.233
  236   HG23  ILE  23          HG23      ILE  23  47.956  16.461  -8.687
  237   HD11  ILE  23           HD1      ILE  23  46.588  11.736  -9.683
  238   HD12  ILE  23           HD2      ILE  23  46.209  13.408 -10.157
  239   HD13  ILE  23           HD3      ILE  23  46.408  12.992  -8.440
  240    H    ALA  24           HN       ALA  24  51.235  15.231  -7.117
  241    HA   ALA  24           HA       ALA  24  51.185  18.160  -7.518
  242    HB1  ALA  24           HB1      ALA  24  52.996  16.900  -5.477
  243    HB2  ALA  24           HB2      ALA  24  51.250  16.886  -5.139
  244    HB3  ALA  24           HB3      ALA  24  52.093  18.425  -5.387
  245    H    TRP  25           HN       TRP  25  52.274  15.200  -8.528
  246    HA   TRP  25           HA       TRP  25  54.077  14.635  -9.945
  247    HB2  TRP  25           HB2      TRP  25  53.179  16.486 -11.299
  248    HB3  TRP  25           HB1      TRP  25  54.237  17.631 -10.443
  249    HD1  TRP  25           HD1      TRP  25  54.570  14.381 -12.536
  250    HE1  TRP  25           HE1      TRP  25  56.780  14.484 -13.903
  251    HE3  TRP  25           HE3      TRP  25  56.397  18.830 -10.781
  252    HZ2  TRP  25           HZ2      TRP  25  59.019  16.276 -14.174
  253    HZ3  TRP  25           HZ3      TRP  25  58.571  19.717 -11.608
  254    HH2  TRP  25           HH2      TRP  25  59.882  18.445 -13.301
  Start of MODEL    5
    1    H1   ALA   1           HT1      ALA   1  50.124   4.952  12.537
    2    H2   ALA   1           HT2      ALA   1  51.393   3.866  12.223
    3    H3   ALA   1           HT3      ALA   1  49.796   3.455  11.813
    4    HA   ALA   1           HA       ALA   1  51.125   5.813  10.677
    5    HB1  ALA   1           HB1      ALA   1  51.822   3.021  10.249
    6    HB2  ALA   1           HB2      ALA   1  52.529   4.461   9.489
    7    HB3  ALA   1           HB3      ALA   1  51.112   3.662   8.739
    8    H    TRP   2           HN       TRP   2  50.352   5.258   8.138
    9    HA   TRP   2           HA       TRP   2  47.662   4.566   7.950
   10    HB2  TRP   2           HB2      TRP   2  48.313   7.452   8.005
   11    HB3  TRP   2           HB1      TRP   2  46.961   6.921   7.024
   12    HD1  TRP   2           HD1      TRP   2  45.574   4.817   8.837
   13    HE1  TRP   2           HE1      TRP   2  44.436   5.461  11.074
   14    HE3  TRP   2           HE3      TRP   2  47.979   9.260   9.746
   15    HZ2  TRP   2           HZ2      TRP   2  44.554   7.609  12.973
   16    HZ3  TRP   2           HZ3      TRP   2  47.439  10.586  11.778
   17    HH2  TRP   2           HH2      TRP   2  45.727   9.768  13.390
   18    H    LYS   3           HN       LYS   3  48.688   3.136   6.404
   19    HA   LYS   3           HA       LYS   3  49.712   2.722   4.435
   20    HB2  LYS   3           HB2      LYS   3  47.747   4.075   3.284
   21    HB3  LYS   3           HB1      LYS   3  49.125   5.069   2.857
   22    HG2  LYS   3           HG2      LYS   3  49.069   3.604   1.049
   23    HG3  LYS   3           HG1      LYS   3  50.241   2.807   2.123
   24    HD2  LYS   3           HD2      LYS   3  48.331   1.425   3.056
   25    HD3  LYS   3           HD1      LYS   3  47.277   2.144   1.817
   26    HE2  LYS   3           HE2      LYS   3  48.981   1.332   0.083
   27    HE3  LYS   3           HE1      LYS   3  49.726   0.389   1.395
   28    HZ1  LYS   3           HZ1      LYS   3  47.709  -0.799   1.723
   29    HZ2  LYS   3           HZ2      LYS   3  48.037  -0.833   0.056
   30    HZ3  LYS   3           HZ3      LYS   3  46.847   0.214   0.669
   31    H    GLU   4           HN       GLU   4  50.333   4.725   6.467
   32    HA   GLU   4           HA       GLU   4  52.137   5.262   7.322
   33    HB2  GLU   4           HB2      GLU   4  53.620   4.190   5.610
   34    HB3  GLU   4           HB1      GLU   4  53.643   5.783   4.817
   35    HG2  GLU   4           HG2      GLU   4  54.658   6.806   6.788
   36    HG3  GLU   4           HG1      GLU   4  54.510   5.283   7.698
   37    H    LYS   5           HN       LYS   5  50.419   6.426   8.007
   38    HA   LYS   5           HA       LYS   5  50.030   8.629   8.844
   39    HB2  LYS   5           HB2      LYS   5  52.731   8.868   8.587
   40    HB3  LYS   5           HB1      LYS   5  52.258   9.927   7.239
   41    HG2  LYS   5           HG2      LYS   5  50.674  11.088   8.906
   42    HG3  LYS   5           HG1      LYS   5  51.538  10.205  10.184
   43    HD2  LYS   5           HD2      LYS   5  52.762  12.140   8.166
   44    HD3  LYS   5           HD1      LYS   5  52.539  12.428   9.908
   45    HE2  LYS   5           HE2      LYS   5  54.440  10.500   8.535
   46    HE3  LYS   5           HE1      LYS   5  54.810  11.767   9.727
   47    HZ1  LYS   5           HZ1      LYS   5  54.793  10.018  11.126
   48    HZ2  LYS   5           HZ2      LYS   5  53.796   9.066  10.133
   49    HZ3  LYS   5           HZ3      LYS   5  53.115  10.267  11.122
   50    H    ILE   6           HN       ILE   6  50.387   7.042   6.156
   51    HA   ILE   6           HA       ILE   6  48.953   9.219   4.313
   52    HB   ILE   6           HB       ILE   6  50.491   6.666   3.792
   53   HG12  ILE   6          HG12      ILE   6  51.005   9.491   2.815
   54   HG13  ILE   6          HG11      ILE   6  51.660   8.866   4.330
   55   HG21  ILE   6          HG21      ILE   6  49.425   8.407   1.597
   56   HG22  ILE   6          HG22      ILE   6  48.477   7.046   2.191
   57   HG23  ILE   6          HG23      ILE   6  50.071   6.763   1.510
   58   HD11  ILE   6           HD1      ILE   6  53.352   8.556   2.638
   59   HD12  ILE   6           HD2      ILE   6  52.183   7.805   1.531
   60   HD13  ILE   6           HD3      ILE   6  52.682   6.951   3.006
   61    H    ARG   7           HN       ARG   7  48.139   5.603   3.841
   62    HA   ARG   7           HA       ARG   7  45.625   5.402   3.368
   63    HB2  ARG   7           HB2      ARG   7  46.682   3.844   5.100
   64    HB3  ARG   7           HB1      ARG   7  46.109   4.958   6.311
   65    HG2  ARG   7           HG2      ARG   7  43.781   4.471   4.935
   66    HG3  ARG   7           HG1      ARG   7  44.613   2.911   4.772
   67    HD2  ARG   7           HD2      ARG   7  45.014   3.065   7.320
   68    HD3  ARG   7           HD1      ARG   7  43.786   4.354   7.307
   69    HE   ARG   7           HE       ARG   7  42.153   2.678   7.000
   70   HH11  ARG   7          HH11      ARG   7  41.817   1.056   5.135
   71   HH12  ARG   7          HH12      ARG   7  42.818  -0.349   5.273
   72   HH21  ARG   7          HH21      ARG   7  44.950   1.072   7.609
   73   HH22  ARG   7          HH22      ARG   7  44.593  -0.341   6.673
   74    H    LYS   8           HN       LYS   8  45.829   8.232   3.686
   75    HA   LYS   8           HA       LYS   8  44.028   8.783   5.895
   76    HB2  LYS   8           HB2      LYS   8  45.930  10.244   5.964
   77    HB3  LYS   8           HB1      LYS   8  45.753  10.600   4.232
   78    HG2  LYS   8           HG2      LYS   8  43.735  11.881   4.628
   79    HG3  LYS   8           HG1      LYS   8  43.661  11.343   6.324
   80    HD2  LYS   8           HD2      LYS   8  45.702  12.553   6.860
   81    HD3  LYS   8           HD1      LYS   8  45.962  12.958   5.146
   82    HE2  LYS   8           HE2      LYS   8  43.628  13.881   6.880
   83    HE3  LYS   8           HE1      LYS   8  44.987  14.885   6.323
   84    HZ1  LYS   8           HZ1      LYS   8  43.615  15.335   4.624
   85    HZ2  LYS   8           HZ2      LYS   8  42.645  13.964   4.882
   86    HZ3  LYS   8           HZ3      LYS   8  44.102  13.827   4.020
   87    H    LYS   9           HN       LYS   9  44.243   8.591   2.701
   88    HA   LYS   9           HA       LYS   9  41.361   9.711   2.559
   89    HB2  LYS   9           HB2      LYS   9  43.002  10.312   0.590
   90    HB3  LYS   9           HB1      LYS   9  42.764   8.603   0.099
   91    HG2  LYS   9           HG2      LYS   9  41.045   9.657  -1.097
   92    HG3  LYS   9           HG1      LYS   9  40.171   9.264   0.393
   93    HD2  LYS   9           HD2      LYS   9  40.665  11.555   1.264
   94    HD3  LYS   9           HD1      LYS   9  41.475  11.938  -0.273
   95    HE2  LYS   9           HE2      LYS   9  38.583  11.001  -0.068
   96    HE3  LYS   9           HE1      LYS   9  39.067  12.712  -0.150
   97    HZ1  LYS   9           HZ1      LYS   9  38.586  12.002  -2.345
   98    HZ2  LYS   9           HZ2      LYS   9  39.525  10.595  -2.187
   99    HZ3  LYS   9           HZ3      LYS   9  40.275  12.119  -2.241
  100    H    LEU  10           HN       LEU  10  43.381   7.035   3.168
  101    HA   LEU  10           HA       LEU  10  41.762   4.954   3.835
  102    HB2  LEU  10           HB2      LEU  10  40.176   5.450   1.991
  103    HB3  LEU  10           HB1      LEU  10  41.598   5.469   0.844
  104    HG   LEU  10           HG       LEU  10  41.759   3.044   1.052
  105   HD11  LEU  10          HD11      LEU  10  39.958   3.372   3.467
  106   HD12  LEU  10          HD12      LEU  10  41.584   2.651   3.393
  107   HD13  LEU  10          HD13      LEU  10  40.198   1.792   2.683
  108   HD21  LEU  10          HD21      LEU  10  39.829   3.847  -0.317
  109   HD22  LEU  10          HD22      LEU  10  38.783   3.665   1.112
  110   HD23  LEU  10          HD23      LEU  10  39.551   2.235   0.382
  111    H    LYS  11           HN       LYS  11  43.305   6.157   1.200
  112    HA   LYS  11           HA       LYS  11  45.562   4.482   1.061
  113    HB2  LYS  11           HB2      LYS  11  43.409   4.920  -0.751
  114    HB3  LYS  11           HB1      LYS  11  44.969   4.580  -1.459
  115    HG2  LYS  11           HG2      LYS  11  45.093   2.373  -0.694
  116    HG3  LYS  11           HG1      LYS  11  43.907   2.653   0.589
  117    HD2  LYS  11           HD2      LYS  11  42.162   3.009  -1.257
  118    HD3  LYS  11           HD1      LYS  11  43.396   2.446  -2.407
  119    HE2  LYS  11           HE2      LYS  11  43.582   0.309  -1.208
  120    HE3  LYS  11           HE1      LYS  11  42.410   0.868   0.009
  121    HZ1  LYS  11           HZ1      LYS  11  41.196   1.288  -2.425
  122    HZ2  LYS  11           HZ2      LYS  11  40.844   0.052  -1.315
  123    HZ3  LYS  11           HZ3      LYS  11  41.940  -0.228  -2.583
  124    H    ASN  12           HN       ASN  12  44.022   6.743   1.301
  125    HA   ASN  12           HA       ASN  12  44.641   9.209   1.219
  126    HB2  ASN  12           HB2      ASN  12  46.816   8.332   2.256
  127    HB3  ASN  12           HB1      ASN  12  47.459   8.468   0.597
  128   HD21  ASN  12          HD21      ASN  12  48.672  10.085   2.491
  129   HD22  ASN  12          HD22      ASN  12  48.134  11.757   2.291
  130    H    GLU  13           HN       GLU  13  44.085   7.177  -0.787
  131    HA   GLU  13           HA       GLU  13  43.573   7.287  -3.083
  132    HB2  GLU  13           HB2      GLU  13  44.198   9.880  -2.905
  133    HB3  GLU  13           HB1      GLU  13  45.777   9.335  -3.545
  134    HG2  GLU  13           HG2      GLU  13  44.431   9.922  -5.468
  135    HG3  GLU  13           HG1      GLU  13  44.441   8.146  -5.402
  136    H    ILE  14           HN       ILE  14  45.688   5.841  -1.303
  137    HA   ILE  14           HA       ILE  14  47.209   4.192  -1.964
  138    HB   ILE  14           HB       ILE  14  47.796   5.603  -4.618
  139   HG12  ILE  14          HG12      ILE  14  46.236   2.998  -4.441
  140   HG13  ILE  14          HG11      ILE  14  45.346   4.505  -4.170
  141   HG21  ILE  14          HG21      ILE  14  48.757   3.333  -5.145
  142   HG22  ILE  14          HG22      ILE  14  48.499   2.891  -3.442
  143   HG23  ILE  14          HG23      ILE  14  49.610   4.217  -3.862
  144   HD11  ILE  14           HD1      ILE  14  46.998   3.807  -6.637
  145   HD12  ILE  14           HD2      ILE  14  46.205   5.375  -6.358
  146   HD13  ILE  14           HD3      ILE  14  45.225   3.902  -6.537
  147    H    LYS  15           HN       LYS  15  47.502   7.694  -2.163
  148    HA   LYS  15           HA       LYS  15  49.837   7.480  -0.486
  149    HB2  LYS  15           HB2      LYS  15  50.593   7.117  -3.067
  150    HB3  LYS  15           HB1      LYS  15  50.671   8.894  -2.949
  151    HG2  LYS  15           HG2      LYS  15  52.854   8.256  -2.281
  152    HG3  LYS  15           HG1      LYS  15  52.023   8.433  -0.725
  153    HD2  LYS  15           HD2      LYS  15  51.675   6.018  -0.574
  154    HD3  LYS  15           HD1      LYS  15  52.328   5.785  -2.214
  155    HE2  LYS  15           HE2      LYS  15  54.524   6.584  -1.504
  156    HE3  LYS  15           HE1      LYS  15  53.896   6.971   0.116
  157    HZ1  LYS  15           HZ1      LYS  15  53.213   4.327  -0.418
  158    HZ2  LYS  15           HZ2      LYS  15  54.355   4.899   0.703
  159    HZ3  LYS  15           HZ3      LYS  15  54.837   4.495  -0.876
  160    H    LYS  16           HN       LYS  16  47.914   9.511  -2.553
  161    HA   LYS  16           HA       LYS  16  47.757  11.390  -0.715
  162    HB2  LYS  16           HB2      LYS  16  50.049  12.023  -1.034
  163    HB3  LYS  16           HB1      LYS  16  49.588  12.227  -2.734
  164    HG2  LYS  16           HG2      LYS  16  49.744  14.398  -1.367
  165    HG3  LYS  16           HG1      LYS  16  48.209  14.147  -2.225
  166    HD2  LYS  16           HD2      LYS  16  47.050  13.579  -0.231
  167    HD3  LYS  16           HD1      LYS  16  48.556  13.240   0.656
  168    HE2  LYS  16           HE2      LYS  16  47.455  15.427   1.289
  169    HE3  LYS  16           HE1      LYS  16  49.128  15.602   0.708
  170    HZ1  LYS  16           HZ1      LYS  16  47.444  15.696  -1.516
  171    HZ2  LYS  16           HZ2      LYS  16  48.375  16.955  -0.858
  172    HZ3  LYS  16           HZ3      LYS  16  46.770  16.728  -0.350
  173    H    LYS  17           HN       LYS  17  48.296  11.251  -3.405
  174    HA   LYS  17           HA       LYS  17  45.469  11.710  -4.350
  175    HB2  LYS  17           HB2      LYS  17  46.861  13.966  -4.361
  176    HB3  LYS  17           HB1      LYS  17  47.695  13.243  -5.741
  177    HG2  LYS  17           HG2      LYS  17  45.947  14.363  -6.841
  178    HG3  LYS  17           HG1      LYS  17  45.205  12.767  -6.604
  179    HD2  LYS  17           HD2      LYS  17  44.076  13.584  -4.557
  180    HD3  LYS  17           HD1      LYS  17  44.855  15.171  -4.752
  181    HE2  LYS  17           HE2      LYS  17  42.590  15.286  -5.655
  182    HE3  LYS  17           HE1      LYS  17  43.752  15.380  -7.000
  183    HZ1  LYS  17           HZ1      LYS  17  41.751  13.422  -6.483
  184    HZ2  LYS  17           HZ2      LYS  17  43.280  12.692  -6.599
  185    HZ3  LYS  17           HZ3      LYS  17  42.694  13.651  -7.873
  186    H    GLY  18           HN       GLY  18  48.140  10.118  -3.771
  187    HA2  GLY  18           HA1      GLY  18  47.806   7.966  -5.555
  188    HA3  GLY  18           HA2      GLY  18  48.448   9.183  -6.683
  189    H    ARG  19           HN       ARG  19  50.205  10.442  -5.336
  190    HA   ARG  19           HA       ARG  19  52.346   8.526  -4.529
  191    HB2  ARG  19           HB2      ARG  19  51.990   8.692  -7.114
  192    HB3  ARG  19           HB1      ARG  19  52.502  10.421  -6.947
  193    HG2  ARG  19           HG2      ARG  19  54.553   9.328  -7.427
  194    HG3  ARG  19           HG1      ARG  19  54.586   9.310  -5.653
  195    HD2  ARG  19           HD2      ARG  19  53.703   6.990  -5.658
  196    HD3  ARG  19           HD1      ARG  19  53.653   7.015  -7.437
  197    HE   ARG  19           HE       ARG  19  56.299   7.672  -6.680
  198   HH11  ARG  19          HH11      ARG  19  55.353   5.533  -4.618
  199   HH12  ARG  19          HH12      ARG  19  55.985   4.102  -5.364
  200   HH21  ARG  19          HH21      ARG  19  56.562   5.630  -8.422
  201   HH22  ARG  19          HH22      ARG  19  56.669   4.157  -7.517
  202    H    LYS  20           HN       LYS  20  50.898  11.412  -5.338
  203    HA   LYS  20           HA       LYS  20  51.218  13.543  -5.142
  204    HB2  LYS  20           HB2      LYS  20  52.558  14.573  -3.575
  205    HB3  LYS  20           HB1      LYS  20  51.208  13.677  -2.981
  206    HG2  LYS  20           HG2      LYS  20  52.697  11.848  -2.191
  207    HG3  LYS  20           HG1      LYS  20  54.100  12.737  -2.839
  208    HD2  LYS  20           HD2      LYS  20  53.558  14.631  -1.296
  209    HD3  LYS  20           HD1      LYS  20  52.254  13.644  -0.594
  210    HE2  LYS  20           HE2      LYS  20  53.913  11.902   0.027
  211    HE3  LYS  20           HE1      LYS  20  55.214  12.908  -0.654
  212    HZ1  LYS  20           HZ1      LYS  20  55.326  13.709   1.422
  213    HZ2  LYS  20           HZ2      LYS  20  53.765  13.184   1.842
  214    HZ3  LYS  20           HZ3      LYS  20  53.976  14.637   0.986
  215    H    ALA  21           HN       ALA  21  51.719  12.983  -6.644
  216    HA   ALA  21           HA       ALA  21  53.769  14.146  -7.933
  217    HB1  ALA  21           HB1      ALA  21  54.162  11.297  -8.670
  218    HB2  ALA  21           HB2      ALA  21  54.767  11.658  -7.036
  219    HB3  ALA  21           HB3      ALA  21  55.407  12.548  -8.436
  220    H    VAL  22           HN       VAL  22  51.356  12.906  -6.693
  221    HA   VAL  22           HA       VAL  22  49.902  13.223  -9.367
  222    HB   VAL  22           HB       VAL  22  48.942  11.430  -7.078
  223   HG11  VAL  22          HG11      VAL  22  47.730  12.357  -9.720
  224   HG12  VAL  22          HG12      VAL  22  47.028  12.470  -8.091
  225   HG13  VAL  22          HG13      VAL  22  47.145  10.894  -8.898
  226   HG21  VAL  22          HG21      VAL  22  50.647  10.233  -8.323
  227   HG22  VAL  22          HG22      VAL  22  49.996  10.801  -9.873
  228   HG23  VAL  22          HG23      VAL  22  49.086   9.624  -8.899
  229    H    ILE  23           HN       ILE  23  51.279  14.461  -6.874
  230    HA   ILE  23           HA       ILE  23  49.263  16.507  -6.875
  231    HB   ILE  23           HB       ILE  23  49.180  14.827  -4.500
  232   HG12  ILE  23          HG12      ILE  23  47.227  15.963  -5.639
  233   HG13  ILE  23          HG11      ILE  23  47.260  16.167  -3.873
  234   HG21  ILE  23          HG21      ILE  23  50.960  16.198  -3.538
  235   HG22  ILE  23          HG22      ILE  23  49.431  16.586  -2.734
  236   HG23  ILE  23          HG23      ILE  23  50.103  17.692  -3.952
  237   HD11  ILE  23           HD1      ILE  23  47.852  18.434  -4.001
  238   HD12  ILE  23           HD2      ILE  23  46.783  18.263  -5.411
  239   HD13  ILE  23           HD3      ILE  23  48.547  18.281  -5.629
  240    H    ALA  24           HN       ALA  24  52.113  15.102  -5.965
  241    HA   ALA  24           HA       ALA  24  53.376  17.761  -6.019
  242    HB1  ALA  24           HB1      ALA  24  54.974  15.228  -6.335
  243    HB2  ALA  24           HB2      ALA  24  54.330  15.618  -4.727
  244    HB3  ALA  24           HB3      ALA  24  55.429  16.747  -5.542
  245    H    TRP  25           HN       TRP  25  51.649  15.492  -7.705
  246    HA   TRP  25           HA       TRP  25  51.355  15.245 -10.037
  247    HB2  TRP  25           HB2      TRP  25  51.089  17.730  -9.847
  248    HB3  TRP  25           HB1      TRP  25  52.804  17.905 -10.285
  249    HD1  TRP  25           HD1      TRP  25  49.405  16.971 -11.720
  250    HE1  TRP  25           HE1      TRP  25  49.547  16.834 -14.313
  251    HE3  TRP  25           HE3      TRP  25  54.477  17.404 -12.275
  252    HZ2  TRP  25           HZ2      TRP  25  51.604  16.906 -16.326
  253    HZ3  TRP  25           HZ3      TRP  25  55.507  17.368 -14.541
  254    HH2  TRP  25           HH2      TRP  25  54.076  17.120 -16.565
  Start of MODEL    6
    1    H1   ALA   1           HT1      ALA   1  46.238   5.536   8.241
    2    H2   ALA   1           HT2      ALA   1  46.295   5.678   9.934
    3    H3   ALA   1           HT3      ALA   1  46.984   4.328   9.166
    4    HA   ALA   1           HA       ALA   1  48.800   5.583   9.657
    5    HB1  ALA   1           HB1      ALA   1  49.198   5.066   7.421
    6    HB2  ALA   1           HB2      ALA   1  49.225   6.846   7.313
    7    HB3  ALA   1           HB3      ALA   1  47.763   5.948   6.868
    8    H    TRP   2           HN       TRP   2  48.054   8.068   7.457
    9    HA   TRP   2           HA       TRP   2  47.118   9.969   9.355
   10    HB2  TRP   2           HB2      TRP   2  49.781   9.608   9.441
   11    HB3  TRP   2           HB1      TRP   2  49.632  10.880   8.245
   12    HD1  TRP   2           HD1      TRP   2  50.959  11.166  11.135
   13    HE1  TRP   2           HE1      TRP   2  50.140  12.980  12.791
   14    HE3  TRP   2           HE3      TRP   2  46.227  12.034   9.225
   15    HZ2  TRP   2           HZ2      TRP   2  47.802  14.558  13.220
   16    HZ3  TRP   2           HZ3      TRP   2  44.757  13.701  10.297
   17    HH2  TRP   2           HH2      TRP   2  45.532  14.966  12.290
   18    H    LYS   3           HN       LYS   3  47.544   8.730   6.352
   19    HA   LYS   3           HA       LYS   3  47.223   9.572   4.212
   20    HB2  LYS   3           HB2      LYS   3  45.130  10.404   4.425
   21    HB3  LYS   3           HB1      LYS   3  45.519  11.414   5.836
   22    HG2  LYS   3           HG2      LYS   3  46.607  13.080   4.427
   23    HG3  LYS   3           HG1      LYS   3  46.444  12.032   2.994
   24    HD2  LYS   3           HD2      LYS   3  44.036  12.239   3.032
   25    HD3  LYS   3           HD1      LYS   3  44.073  13.047   4.616
   26    HE2  LYS   3           HE2      LYS   3  45.394  14.167   2.108
   27    HE3  LYS   3           HE1      LYS   3  43.763  14.623   2.658
   28    HZ1  LYS   3           HZ1      LYS   3  45.402  16.185   3.468
   29    HZ2  LYS   3           HZ2      LYS   3  46.293  14.937   4.199
   30    HZ3  LYS   3           HZ3      LYS   3  44.742  15.326   4.773
   31    H    GLU   4           HN       GLU   4  49.084  10.264   6.523
   32    HA   GLU   4           HA       GLU   4  50.975  11.809   5.027
   33    HB2  GLU   4           HB2      GLU   4  49.565  13.086   7.154
   34    HB3  GLU   4           HB1      GLU   4  51.145  12.649   7.841
   35    HG2  GLU   4           HG2      GLU   4  52.271  13.794   5.933
   36    HG3  GLU   4           HG1      GLU   4  50.678  14.272   5.297
   37    H    LYS   5           HN       LYS   5  49.938   9.499   7.649
   38    HA   LYS   5           HA       LYS   5  52.877   8.578   7.487
   39    HB2  LYS   5           HB2      LYS   5  50.459   7.534   9.052
   40    HB3  LYS   5           HB1      LYS   5  51.878   6.536   8.737
   41    HG2  LYS   5           HG2      LYS   5  53.319   8.046   9.923
   42    HG3  LYS   5           HG1      LYS   5  52.047   9.283  10.030
   43    HD2  LYS   5           HD2      LYS   5  50.695   7.796  11.462
   44    HD3  LYS   5           HD1      LYS   5  51.936   6.525  11.329
   45    HE2  LYS   5           HE2      LYS   5  52.394   9.308  12.496
   46    HE3  LYS   5           HE1      LYS   5  52.149   7.825  13.450
   47    HZ1  LYS   5           HZ1      LYS   5  54.458   8.096  13.282
   48    HZ2  LYS   5           HZ2      LYS   5  54.397   8.491  11.630
   49    HZ3  LYS   5           HZ3      LYS   5  54.090   6.898  12.139
   50    H    ILE   6           HN       ILE   6  50.252   9.356   5.939
   51    HA   ILE   6           HA       ILE   6  49.177   8.756   4.030
   52    HB   ILE   6           HB       ILE   6  50.325   7.502   2.226
   53   HG12  ILE   6          HG12      ILE   6  52.713   7.284   4.120
   54   HG13  ILE   6          HG11      ILE   6  51.617   5.922   3.808
   55   HG21  ILE   6          HG21      ILE   6  52.047   9.179   1.888
   56   HG22  ILE   6          HG22      ILE   6  52.128   9.516   3.633
   57   HG23  ILE   6          HG23      ILE   6  50.674   9.950   2.706
   58   HD11  ILE   6           HD1      ILE   6  53.377   5.603   2.263
   59   HD12  ILE   6           HD2      ILE   6  53.480   7.334   1.880
   60   HD13  ILE   6           HD3      ILE   6  52.106   6.372   1.287
   61    H    ARG   7           HN       ARG   7  47.371   7.867   3.949
   62    HA   ARG   7           HA       ARG   7  46.074   5.922   3.240
   63    HB2  ARG   7           HB2      ARG   7  47.995   4.328   3.477
   64    HB3  ARG   7           HB1      ARG   7  47.675   4.285   5.221
   65    HG2  ARG   7           HG2      ARG   7  45.552   3.250   4.925
   66    HG3  ARG   7           HG1      ARG   7  45.494   3.672   3.203
   67    HD2  ARG   7           HD2      ARG   7  47.590   1.810   4.379
   68    HD3  ARG   7           HD1      ARG   7  46.041   1.233   3.719
   69    HE   ARG   7           HE       ARG   7  47.390   2.941   1.815
   70   HH11  ARG   7          HH11      ARG   7  49.512   0.972   2.762
   71   HH12  ARG   7          HH12      ARG   7  49.307  -0.317   1.623
   72   HH21  ARG   7          HH21      ARG   7  46.199   0.777   0.543
   73   HH22  ARG   7          HH22      ARG   7  47.431  -0.428   0.367
   74    H    LYS   8           HN       LYS   8  45.324   7.891   4.469
   75    HA   LYS   8           HA       LYS   8  43.700   6.701   6.598
   76    HB2  LYS   8           HB2      LYS   8  45.671   8.119   7.604
   77    HB3  LYS   8           HB1      LYS   8  44.771   9.513   6.978
   78    HG2  LYS   8           HG2      LYS   8  43.882   9.368   9.142
   79    HG3  LYS   8           HG1      LYS   8  42.711   8.379   8.243
   80    HD2  LYS   8           HD2      LYS   8  43.992   6.325   8.887
   81    HD3  LYS   8           HD1      LYS   8  45.111   7.343   9.824
   82    HE2  LYS   8           HE2      LYS   8  42.112   7.050  10.291
   83    HE3  LYS   8           HE1      LYS   8  43.410   6.396  11.318
   84    HZ1  LYS   8           HZ1      LYS   8  44.179   8.691  11.667
   85    HZ2  LYS   8           HZ2      LYS   8  42.595   8.452  12.233
   86    HZ3  LYS   8           HZ3      LYS   8  42.862   9.271  10.769
   87    H    LYS   9           HN       LYS   9  44.185   8.454   3.804
   88    HA   LYS   9           HA       LYS   9  41.567   9.879   4.010
   89    HB2  LYS   9           HB2      LYS   9  43.444  10.150   2.123
   90    HB3  LYS   9           HB1      LYS   9  42.496   8.831   1.332
   91    HG2  LYS   9           HG2      LYS   9  41.421  11.549   2.327
   92    HG3  LYS   9           HG1      LYS   9  41.840  11.178   0.641
   93    HD2  LYS   9           HD2      LYS   9  40.143   9.187   0.911
   94    HD3  LYS   9           HD1      LYS   9  39.554  10.107   2.320
   95    HE2  LYS   9           HE2      LYS   9  38.210  10.795   0.454
   96    HE3  LYS   9           HE1      LYS   9  39.346  12.125   0.783
   97    HZ1  LYS   9           HZ1      LYS   9  39.232  11.618  -1.577
   98    HZ2  LYS   9           HZ2      LYS   9  39.691  10.010  -1.286
   99    HZ3  LYS   9           HZ3      LYS   9  40.779  11.277  -0.972
  100    H    LEU  10           HN       LEU  10  42.936   6.828   3.745
  101    HA   LEU  10           HA       LEU  10  40.927   5.030   4.239
  102    HB2  LEU  10           HB2      LEU  10  40.736   6.243   1.476
  103    HB3  LEU  10           HB1      LEU  10  40.389   4.510   1.641
  104    HG   LEU  10           HG       LEU  10  38.913   6.309   3.587
  105   HD11  LEU  10          HD11      LEU  10  37.152   6.795   2.010
  106   HD12  LEU  10          HD12      LEU  10  37.905   5.782   0.756
  107   HD13  LEU  10          HD13      LEU  10  38.660   7.319   1.227
  108   HD21  LEU  10          HD21      LEU  10  38.156   3.793   2.045
  109   HD22  LEU  10          HD22      LEU  10  37.207   4.563   3.339
  110   HD23  LEU  10          HD23      LEU  10  38.787   3.830   3.709
  111    H    LYS  11           HN       LYS  11  42.471   6.088   1.422
  112    HA   LYS  11           HA       LYS  11  44.361   3.944   1.176
  113    HB2  LYS  11           HB2      LYS  11  42.838   5.306  -0.818
  114    HB3  LYS  11           HB1      LYS  11  43.923   3.925  -1.163
  115    HG2  LYS  11           HG2      LYS  11  42.012   3.006   0.793
  116    HG3  LYS  11           HG1      LYS  11  41.091   3.857  -0.464
  117    HD2  LYS  11           HD2      LYS  11  42.242   2.469  -2.197
  118    HD3  LYS  11           HD1      LYS  11  43.063   1.573  -0.896
  119    HE2  LYS  11           HE2      LYS  11  41.027   0.378  -1.669
  120    HE3  LYS  11           HE1      LYS  11  40.874   0.889   0.028
  121    HZ1  LYS  11           HZ1      LYS  11  38.984   1.360  -1.708
  122    HZ2  LYS  11           HZ2      LYS  11  39.940   2.716  -2.075
  123    HZ3  LYS  11           HZ3      LYS  11  39.355   2.489  -0.497
  124    H    ASN  12           HN       ASN  12  43.527   6.522   1.589
  125    HA   ASN  12           HA       ASN  12  44.744   8.739   1.678
  126    HB2  ASN  12           HB2      ASN  12  46.895   7.844   2.320
  127    HB3  ASN  12           HB1      ASN  12  47.171   7.225   0.711
  128   HD21  ASN  12          HD21      ASN  12  49.148   8.832   1.478
  129   HD22  ASN  12          HD22      ASN  12  48.974  10.457   0.810
  130    H    GLU  13           HN       GLU  13  43.133   7.308   0.007
  131    HA   GLU  13           HA       GLU  13  42.356   7.233  -2.197
  132    HB2  GLU  13           HB2      GLU  13  44.385   9.389  -2.925
  133    HB3  GLU  13           HB1      GLU  13  42.801   9.055  -3.675
  134    HG2  GLU  13           HG2      GLU  13  41.764   9.671  -1.391
  135    HG3  GLU  13           HG1      GLU  13  43.365  10.312  -0.959
  136    H    ILE  14           HN       ILE  14  44.544   5.492  -1.071
  137    HA   ILE  14           HA       ILE  14  46.030   3.977  -2.071
  138    HB   ILE  14           HB       ILE  14  46.111   5.524  -4.710
  139   HG12  ILE  14          HG12      ILE  14  44.253   3.256  -3.834
  140   HG13  ILE  14          HG11      ILE  14  43.755   4.884  -4.335
  141   HG21  ILE  14          HG21      ILE  14  47.055   3.516  -5.587
  142   HG22  ILE  14          HG22      ILE  14  46.614   2.583  -4.135
  143   HG23  ILE  14          HG23      ILE  14  47.901   3.809  -4.051
  144   HD11  ILE  14           HD1      ILE  14  44.905   2.654  -6.036
  145   HD12  ILE  14           HD2      ILE  14  44.978   4.349  -6.578
  146   HD13  ILE  14           HD3      ILE  14  43.403   3.577  -6.276
  147    H    LYS  15           HN       LYS  15  46.287   7.456  -2.475
  148    HA   LYS  15           HA       LYS  15  48.537   7.790  -0.915
  149    HB2  LYS  15           HB2      LYS  15  49.312   6.946  -3.624
  150    HB3  LYS  15           HB1      LYS  15  49.883   8.596  -3.204
  151    HG2  LYS  15           HG2      LYS  15  50.917   7.700  -1.135
  152    HG3  LYS  15           HG1      LYS  15  50.378   6.060  -1.548
  153    HD2  LYS  15           HD2      LYS  15  52.201   7.775  -3.293
  154    HD3  LYS  15           HD1      LYS  15  52.772   6.513  -2.178
  155    HE2  LYS  15           HE2      LYS  15  52.657   5.292  -4.170
  156    HE3  LYS  15           HE1      LYS  15  51.019   4.998  -3.544
  157    HZ1  LYS  15           HZ1      LYS  15  51.575   6.006  -5.971
  158    HZ2  LYS  15           HZ2      LYS  15  51.321   7.435  -5.086
  159    HZ3  LYS  15           HZ3      LYS  15  50.109   6.245  -5.150
  160    H    LYS  16           HN       LYS  16  49.021   9.794  -0.696
  161    HA   LYS  16           HA       LYS  16  47.901  11.846  -0.845
  162    HB2  LYS  16           HB2      LYS  16  50.007  12.041  -2.689
  163    HB3  LYS  16           HB1      LYS  16  49.448  13.372  -1.688
  164    HG2  LYS  16           HG2      LYS  16  50.591  10.777  -0.563
  165    HG3  LYS  16           HG1      LYS  16  51.588  12.199  -0.907
  166    HD2  LYS  16           HD2      LYS  16  49.178  12.238   0.980
  167    HD3  LYS  16           HD1      LYS  16  50.848  11.988   1.507
  168    HE2  LYS  16           HE2      LYS  16  51.340  14.231   0.234
  169    HE3  LYS  16           HE1      LYS  16  49.581  14.482   0.354
  170    HZ1  LYS  16           HZ1      LYS  16  49.788  14.992   2.483
  171    HZ2  LYS  16           HZ2      LYS  16  51.477  14.959   2.301
  172    HZ3  LYS  16           HZ3      LYS  16  50.648  13.569   2.820
  173    H    LYS  17           HN       LYS  17  48.755  11.774  -3.465
  174    HA   LYS  17           HA       LYS  17  46.053  12.108  -4.770
  175    HB2  LYS  17           HB2      LYS  17  48.387  13.926  -5.513
  176    HB3  LYS  17           HB1      LYS  17  46.736  13.977  -6.153
  177    HG2  LYS  17           HG2      LYS  17  47.396  14.478  -3.217
  178    HG3  LYS  17           HG1      LYS  17  47.298  15.774  -4.417
  179    HD2  LYS  17           HD2      LYS  17  44.955  14.970  -4.978
  180    HD3  LYS  17           HD1      LYS  17  45.068  13.877  -3.580
  181    HE2  LYS  17           HE2      LYS  17  45.287  16.915  -3.539
  182    HE3  LYS  17           HE1      LYS  17  43.957  15.932  -2.881
  183    HZ1  LYS  17           HZ1      LYS  17  46.421  16.630  -1.673
  184    HZ2  LYS  17           HZ2      LYS  17  46.305  14.939  -1.784
  185    HZ3  LYS  17           HZ3      LYS  17  45.090  15.828  -0.994
  186    H    GLY  18           HN       GLY  18  48.524  10.594  -3.867
  187    HA2  GLY  18           HA1      GLY  18  49.000   8.483  -5.315
  188    HA3  GLY  18           HA2      GLY  18  49.217   9.565  -6.704
  189    H    ARG  19           HN       ARG  19  50.180  10.432  -3.503
  190    HA   ARG  19           HA       ARG  19  52.595  10.094  -2.674
  191    HB2  ARG  19           HB2      ARG  19  53.442   9.351  -5.006
  192    HB3  ARG  19           HB1      ARG  19  53.216  11.097  -5.569
  193    HG2  ARG  19           HG2      ARG  19  54.946  11.811  -4.066
  194    HG3  ARG  19           HG1      ARG  19  54.895  10.341  -3.077
  195    HD2  ARG  19           HD2      ARG  19  56.080   9.064  -4.662
  196    HD3  ARG  19           HD1      ARG  19  55.667  10.152  -6.007
  197    HE   ARG  19           HE       ARG  19  57.596  11.385  -5.460
  198   HH11  ARG  19          HH11      ARG  19  58.289  12.747  -3.564
  199   HH12  ARG  19          HH12      ARG  19  58.789  11.844  -2.174
  200   HH21  ARG  19          HH21      ARG  19  57.450   8.853  -3.305
  201   HH22  ARG  19          HH22      ARG  19  58.315   9.639  -2.027
  202    H    LYS  20           HN       LYS  20  51.113  11.906  -5.004
  203    HA   LYS  20           HA       LYS  20  51.029  13.876  -5.729
  204    HB2  LYS  20           HB2      LYS  20  50.626  15.669  -4.705
  205    HB3  LYS  20           HB1      LYS  20  49.756  14.406  -3.836
  206    HG2  LYS  20           HG2      LYS  20  51.628  14.458  -2.077
  207    HG3  LYS  20           HG1      LYS  20  52.204  15.941  -2.852
  208    HD2  LYS  20           HD2      LYS  20  49.333  15.680  -1.899
  209    HD3  LYS  20           HD1      LYS  20  50.637  16.235  -0.827
  210    HE2  LYS  20           HE2      LYS  20  49.830  17.511  -3.479
  211    HE3  LYS  20           HE1      LYS  20  49.496  18.157  -1.858
  212    HZ1  LYS  20           HZ1      LYS  20  52.151  17.774  -3.137
  213    HZ2  LYS  20           HZ2      LYS  20  51.949  18.145  -1.492
  214    HZ3  LYS  20           HZ3      LYS  20  51.423  19.237  -2.683
  215    H    ALA  21           HN       ALA  21  52.330  13.485  -6.551
  216    HA   ALA  21           HA       ALA  21  54.346  15.066  -7.131
  217    HB1  ALA  21           HB1      ALA  21  56.422  14.012  -6.612
  218    HB2  ALA  21           HB2      ALA  21  55.614  12.482  -6.212
  219    HB3  ALA  21           HB3      ALA  21  55.533  13.853  -5.082
  220    H    VAL  22           HN       VAL  22  52.042  13.195  -6.879
  221    HA   VAL  22           HA       VAL  22  52.483  12.308  -9.752
  222    HB   VAL  22           HB       VAL  22  50.835  10.908  -7.619
  223   HG11  VAL  22          HG11      VAL  22  50.216   9.375  -9.668
  224   HG12  VAL  22          HG12      VAL  22  50.660  10.797 -10.641
  225   HG13  VAL  22          HG13      VAL  22  49.342  10.907  -9.450
  226   HG21  VAL  22          HG21      VAL  22  52.136   8.897  -8.384
  227   HG22  VAL  22          HG22      VAL  22  53.190  10.183  -7.751
  228   HG23  VAL  22          HG23      VAL  22  53.030   9.949  -9.506
  229    H    ILE  23           HN       ILE  23  51.747  14.529  -7.734
  230    HA   ILE  23           HA       ILE  23  50.026  15.586  -9.713
  231    HB   ILE  23           HB       ILE  23  48.464  14.328  -7.711
  232   HG12  ILE  23          HG12      ILE  23  47.817  14.835 -10.080
  233   HG13  ILE  23          HG11      ILE  23  46.548  15.210  -8.894
  234   HG21  ILE  23          HG21      ILE  23  47.186  16.240  -6.715
  235   HG22  ILE  23          HG22      ILE  23  48.405  17.362  -7.352
  236   HG23  ILE  23          HG23      ILE  23  48.861  16.155  -6.136
  237   HD11  ILE  23           HD1      ILE  23  47.114  16.972 -10.778
  238   HD12  ILE  23           HD2      ILE  23  48.502  17.375  -9.740
  239   HD13  ILE  23           HD3      ILE  23  46.844  17.539  -9.114
  240    H    ALA  24           HN       ALA  24  51.769  15.486  -6.911
  241    HA   ALA  24           HA       ALA  24  52.117  18.382  -7.128
  242    HB1  ALA  24           HB1      ALA  24  53.591  18.345  -5.326
  243    HB2  ALA  24           HB2      ALA  24  54.149  16.709  -5.696
  244    HB3  ALA  24           HB3      ALA  24  52.580  16.955  -4.914
  245    H    TRP  25           HN       TRP  25  52.458  15.384  -8.510
  246    HA   TRP  25           HA       TRP  25  53.848  16.614 -10.794
  247    HB2  TRP  25           HB2      TRP  25  55.699  15.117  -8.917
  248    HB3  TRP  25           HB1      TRP  25  55.953  14.962 -10.658
  249    HD1  TRP  25           HD1      TRP  25  55.919  17.519 -11.950
  250    HE1  TRP  25           HE1      TRP  25  57.251  19.636 -11.239
  251    HE3  TRP  25           HE3      TRP  25  56.768  16.329  -7.043
  252    HZ2  TRP  25           HZ2      TRP  25  58.504  20.647  -8.851
  253    HZ3  TRP  25           HZ3      TRP  25  58.033  17.885  -5.567
  254    HH2  TRP  25           HH2      TRP  25  58.901  20.040  -6.465
  Start of MODEL    7
    1    H1   ALA   1           HT1      ALA   1  52.086   0.414   9.175
    2    H2   ALA   1           HT2      ALA   1  50.468   0.600   9.658
    3    H3   ALA   1           HT3      ALA   1  51.728   0.908  10.756
    4    HA   ALA   1           HA       ALA   1  51.696   2.992  10.191
    5    HB1  ALA   1           HB1      ALA   1  52.195   2.164   7.315
    6    HB2  ALA   1           HB2      ALA   1  53.449   2.021   8.576
    7    HB3  ALA   1           HB3      ALA   1  52.771   3.617   8.170
    8    H    TRP   2           HN       TRP   2  51.030   4.197   7.612
    9    HA   TRP   2           HA       TRP   2  48.198   3.542   7.332
   10    HB2  TRP   2           HB2      TRP   2  49.091   6.355   7.307
   11    HB3  TRP   2           HB1      TRP   2  47.438   5.769   7.328
   12    HD1  TRP   2           HD1      TRP   2  46.307   5.777   9.560
   13    HE1  TRP   2           HE1      TRP   2  46.997   5.805  12.061
   14    HE3  TRP   2           HE3      TRP   2  51.417   5.408   9.031
   15    HZ2  TRP   2           HZ2      TRP   2  49.416   5.692  13.591
   16    HZ3  TRP   2           HZ3      TRP   2  52.874   5.380  11.034
   17    HH2  TRP   2           HH2      TRP   2  51.885   5.517  13.313
   18    H    LYS   3           HN       LYS   3  49.210   2.295   5.621
   19    HA   LYS   3           HA       LYS   3  49.516   2.077   3.357
   20    HB2  LYS   3           HB2      LYS   3  48.263   3.850   2.366
   21    HB3  LYS   3           HB1      LYS   3  49.446   4.968   3.000
   22    HG2  LYS   3           HG2      LYS   3  49.682   4.450   0.536
   23    HG3  LYS   3           HG1      LYS   3  51.155   4.253   1.511
   24    HD2  LYS   3           HD2      LYS   3  50.964   1.876   1.517
   25    HD3  LYS   3           HD1      LYS   3  49.263   1.928   0.991
   26    HE2  LYS   3           HE2      LYS   3  50.948   1.289  -0.819
   27    HE3  LYS   3           HE1      LYS   3  49.887   2.660  -1.221
   28    HZ1  LYS   3           HZ1      LYS   3  51.615   4.047  -1.282
   29    HZ2  LYS   3           HZ2      LYS   3  52.608   2.669  -1.316
   30    HZ3  LYS   3           HZ3      LYS   3  52.284   3.450   0.158
   31    H    GLU   4           HN       GLU   4  50.614   4.962   4.539
   32    HA   GLU   4           HA       GLU   4  52.670   4.207   5.846
   33    HB2  GLU   4           HB2      GLU   4  53.737   3.803   3.470
   34    HB3  GLU   4           HB1      GLU   4  54.003   5.556   3.563
   35    HG2  GLU   4           HG2      GLU   4  54.944   3.588   5.696
   36    HG3  GLU   4           HG1      GLU   4  55.964   4.164   4.356
   37    H    LYS   5           HN       LYS   5  50.990   5.325   7.006
   38    HA   LYS   5           HA       LYS   5  50.792   7.424   8.211
   39    HB2  LYS   5           HB2      LYS   5  53.522   7.559   7.694
   40    HB3  LYS   5           HB1      LYS   5  52.941   8.916   6.704
   41    HG2  LYS   5           HG2      LYS   5  51.747   9.828   8.703
   42    HG3  LYS   5           HG1      LYS   5  52.412   8.499   9.682
   43    HD2  LYS   5           HD2      LYS   5  54.725   9.248   9.030
   44    HD3  LYS   5           HD1      LYS   5  53.995  10.649   8.210
   45    HE2  LYS   5           HE2      LYS   5  52.925  11.317  10.371
   46    HE3  LYS   5           HE1      LYS   5  53.755   9.962  11.172
   47    HZ1  LYS   5           HZ1      LYS   5  55.864  10.988  10.200
   48    HZ2  LYS   5           HZ2      LYS   5  55.141  11.786  11.514
   49    HZ3  LYS   5           HZ3      LYS   5  54.936  12.382   9.936
   50    H    ILE   6           HN       ILE   6  50.898   6.219   5.242
   51    HA   ILE   6           HA       ILE   6  49.549   8.722   3.929
   52    HB   ILE   6           HB       ILE   6  50.984   6.262   2.871
   53   HG12  ILE   6          HG12      ILE   6  51.160   9.224   2.256
   54   HG13  ILE   6          HG11      ILE   6  52.176   8.355   3.424
   55   HG21  ILE   6          HG21      ILE   6  50.308   6.697   0.622
   56   HG22  ILE   6          HG22      ILE   6  49.394   8.138   1.094
   57   HG23  ILE   6          HG23      ILE   6  48.810   6.521   1.540
   58   HD11  ILE   6           HD1      ILE   6  52.718   6.772   1.372
   59   HD12  ILE   6           HD2      ILE   6  53.525   8.351   1.492
   60   HD13  ILE   6           HD3      ILE   6  52.139   8.146   0.398
   61    H    ARG   7           HN       ARG   7  48.228   5.143   3.479
   62    HA   ARG   7           HA       ARG   7  45.708   5.801   3.050
   63    HB2  ARG   7           HB2      ARG   7  45.721   3.548   3.249
   64    HB3  ARG   7           HB1      ARG   7  47.117   3.589   4.295
   65    HG2  ARG   7           HG2      ARG   7  45.818   3.692   6.284
   66    HG3  ARG   7           HG1      ARG   7  44.326   4.076   5.395
   67    HD2  ARG   7           HD2      ARG   7  44.217   1.743   5.999
   68    HD3  ARG   7           HD1      ARG   7  44.575   1.787   4.261
   69    HE   ARG   7           HE       ARG   7  46.742   0.925   4.722
   70   HH11  ARG   7          HH11      ARG   7  48.137  -0.177   6.123
   71   HH12  ARG   7          HH12      ARG   7  47.961   0.027   7.834
   72   HH21  ARG   7          HH21      ARG   7  45.194   2.101   7.568
   73   HH22  ARG   7          HH22      ARG   7  46.294   1.318   8.652
   74    H    LYS   8           HN       LYS   8  45.620   7.906   3.783
   75    HA   LYS   8           HA       LYS   8  44.476   8.007   6.483
   76    HB2  LYS   8           HB2      LYS   8  45.307  10.255   6.847
   77    HB3  LYS   8           HB1      LYS   8  46.704   9.272   6.350
   78    HG2  LYS   8           HG2      LYS   8  46.177  10.028   3.938
   79    HG3  LYS   8           HG1      LYS   8  45.083  11.225   4.669
   80    HD2  LYS   8           HD2      LYS   8  47.004  12.064   6.056
   81    HD3  LYS   8           HD1      LYS   8  48.077  10.951   5.173
   82    HE2  LYS   8           HE2      LYS   8  47.615  12.058   3.069
   83    HE3  LYS   8           HE1      LYS   8  46.338  13.049   3.813
   84    HZ1  LYS   8           HZ1      LYS   8  49.104  13.558   3.683
   85    HZ2  LYS   8           HZ2      LYS   8  48.667  13.392   5.316
   86    HZ3  LYS   8           HZ3      LYS   8  47.879  14.533   4.335
   87    H    LYS   9           HN       LYS   9  44.590   8.827   3.198
   88    HA   LYS   9           HA       LYS   9  41.878  10.097   3.482
   89    HB2  LYS   9           HB2      LYS   9  43.337  10.416   1.288
   90    HB3  LYS   9           HB1      LYS   9  42.697   8.785   0.873
   91    HG2  LYS   9           HG2      LYS   9  41.057  10.169  -0.073
   92    HG3  LYS   9           HG1      LYS   9  40.357   9.909   1.535
   93    HD2  LYS   9           HD2      LYS   9  41.343  12.059   2.307
   94    HD3  LYS   9           HD1      LYS   9  42.034  12.313   0.687
   95    HE2  LYS   9           HE2      LYS   9  39.947  13.561   0.842
   96    HE3  LYS   9           HE1      LYS   9  39.705  12.187  -0.262
   97    HZ1  LYS   9           HZ1      LYS   9  38.074  12.733   1.758
   98    HZ2  LYS   9           HZ2      LYS   9  39.160  11.703   2.562
   99    HZ3  LYS   9           HZ3      LYS   9  38.332  11.158   1.183
  100    H    LEU  10           HN       LEU  10  43.598   7.079   3.643
  101    HA   LEU  10           HA       LEU  10  41.830   5.262   4.656
  102    HB2  LEU  10           HB2      LEU  10  41.051   5.993   1.838
  103    HB3  LEU  10           HB1      LEU  10  40.780   4.319   2.400
  104    HG   LEU  10           HG       LEU  10  39.661   6.532   4.168
  105   HD11  LEU  10          HD11      LEU  10  38.066   5.271   1.895
  106   HD12  LEU  10          HD12      LEU  10  38.864   6.846   1.709
  107   HD13  LEU  10          HD13      LEU  10  37.605   6.632   2.944
  108   HD21  LEU  10          HD21      LEU  10  38.780   3.689   3.517
  109   HD22  LEU  10          HD22      LEU  10  38.064   4.759   4.748
  110   HD23  LEU  10          HD23      LEU  10  39.734   4.175   4.939
  111    H    LYS  11           HN       LYS  11  42.830   6.160   1.634
  112    HA   LYS  11           HA       LYS  11  44.717   4.096   1.125
  113    HB2  LYS  11           HB2      LYS  11  42.888   5.418  -0.644
  114    HB3  LYS  11           HB1      LYS  11  43.875   3.996  -1.104
  115    HG2  LYS  11           HG2      LYS  11  42.342   3.060   1.074
  116    HG3  LYS  11           HG1      LYS  11  41.206   4.088   0.168
  117    HD2  LYS  11           HD2      LYS  11  41.639   2.828  -1.884
  118    HD3  LYS  11           HD1      LYS  11  42.875   1.849  -1.056
  119    HE2  LYS  11           HE2      LYS  11  39.936   1.985  -0.253
  120    HE3  LYS  11           HE1      LYS  11  40.671   0.674  -1.207
  121    HZ1  LYS  11           HZ1      LYS  11  40.738   1.117   1.612
  122    HZ2  LYS  11           HZ2      LYS  11  42.310   0.990   0.979
  123    HZ3  LYS  11           HZ3      LYS  11  41.186  -0.259   0.727
  124    H    ASN  12           HN       ASN  12  43.780   6.608   1.709
  125    HA   ASN  12           HA       ASN  12  44.813   8.920   1.577
  126    HB2  ASN  12           HB2      ASN  12  46.909   7.520   2.042
  127    HB3  ASN  12           HB1      ASN  12  47.254   7.809   0.350
  128   HD21  ASN  12          HD21      ASN  12  45.770  10.481   0.502
  129   HD22  ASN  12          HD22      ASN  12  46.906  11.563   1.313
  130    H    GLU  13           HN       GLU  13  43.455   7.162  -0.256
  131    HA   GLU  13           HA       GLU  13  42.523   7.304  -2.399
  132    HB2  GLU  13           HB2      GLU  13  44.732   9.272  -3.150
  133    HB3  GLU  13           HB1      GLU  13  43.268   8.889  -4.073
  134    HG2  GLU  13           HG2      GLU  13  41.855   9.811  -2.255
  135    HG3  GLU  13           HG1      GLU  13  43.318  10.272  -1.355
  136    H    ILE  14           HN       ILE  14  44.616   5.465  -1.234
  137    HA   ILE  14           HA       ILE  14  45.870   3.735  -2.206
  138    HB   ILE  14           HB       ILE  14  46.091   5.189  -4.894
  139   HG12  ILE  14          HG12      ILE  14  44.000   3.178  -3.918
  140   HG13  ILE  14          HG11      ILE  14  43.687   4.812  -4.531
  141   HG21  ILE  14          HG21      ILE  14  47.701   3.321  -4.194
  142   HG22  ILE  14          HG22      ILE  14  46.819   3.066  -5.712
  143   HG23  ILE  14          HG23      ILE  14  46.297   2.232  -4.229
  144   HD11  ILE  14           HD1      ILE  14  44.588   2.363  -6.071
  145   HD12  ILE  14           HD2      ILE  14  44.837   4.002  -6.721
  146   HD13  ILE  14           HD3      ILE  14  43.191   3.419  -6.377
  147    H    LYS  15           HN       LYS  15  46.379   7.144  -2.530
  148    HA   LYS  15           HA       LYS  15  48.770   7.157  -1.070
  149    HB2  LYS  15           HB2      LYS  15  49.209   6.659  -3.944
  150    HB3  LYS  15           HB1      LYS  15  49.899   8.227  -3.405
  151    HG2  LYS  15           HG2      LYS  15  51.095   7.013  -1.571
  152    HG3  LYS  15           HG1      LYS  15  50.480   5.466  -2.191
  153    HD2  LYS  15           HD2      LYS  15  52.137   7.434  -3.832
  154    HD3  LYS  15           HD1      LYS  15  52.822   6.040  -2.968
  155    HE2  LYS  15           HE2      LYS  15  51.044   4.636  -4.310
  156    HE3  LYS  15           HE1      LYS  15  50.972   6.063  -5.372
  157    HZ1  LYS  15           HZ1      LYS  15  53.213   4.232  -4.855
  158    HZ2  LYS  15           HZ2      LYS  15  53.550   5.846  -5.266
  159    HZ3  LYS  15           HZ3      LYS  15  52.652   4.866  -6.324
  160    H    LYS  16           HN       LYS  16  49.285   9.234  -0.658
  161    HA   LYS  16           HA       LYS  16  48.188  11.284  -0.577
  162    HB2  LYS  16           HB2      LYS  16  50.577  11.026  -1.781
  163    HB3  LYS  16           HB1      LYS  16  49.805  12.519  -2.326
  164    HG2  LYS  16           HG2      LYS  16  51.171  13.100  -0.421
  165    HG3  LYS  16           HG1      LYS  16  49.498  13.092   0.170
  166    HD2  LYS  16           HD2      LYS  16  49.891  10.696   0.920
  167    HD3  LYS  16           HD1      LYS  16  51.607  10.924   0.513
  168    HE2  LYS  16           HE2      LYS  16  49.966  12.303   2.658
  169    HE3  LYS  16           HE1      LYS  16  51.537  11.482   2.811
  170    HZ1  LYS  16           HZ1      LYS  16  52.170  13.667   2.799
  171    HZ2  LYS  16           HZ2      LYS  16  50.922  14.160   1.758
  172    HZ3  LYS  16           HZ3      LYS  16  52.269  13.329   1.141
  173    H    LYS  17           HN       LYS  17  48.807  11.426  -3.262
  174    HA   LYS  17           HA       LYS  17  45.949  11.700  -4.198
  175    HB2  LYS  17           HB2      LYS  17  47.198  14.099  -3.704
  176    HB3  LYS  17           HB1      LYS  17  47.777  13.788  -5.349
  177    HG2  LYS  17           HG2      LYS  17  45.779  14.980  -5.740
  178    HG3  LYS  17           HG1      LYS  17  45.233  13.291  -5.872
  179    HD2  LYS  17           HD2      LYS  17  44.654  13.448  -3.361
  180    HD3  LYS  17           HD1      LYS  17  44.918  15.199  -3.518
  181    HE2  LYS  17           HE2      LYS  17  43.223  15.273  -5.345
  182    HE3  LYS  17           HE1      LYS  17  42.927  13.533  -5.119
  183    HZ1  LYS  17           HZ1      LYS  17  42.029  15.770  -3.544
  184    HZ2  LYS  17           HZ2      LYS  17  42.722  14.535  -2.607
  185    HZ3  LYS  17           HZ3      LYS  17  41.415  14.191  -3.637
  186    H    GLY  18           HN       GLY  18  48.496  10.287  -3.741
  187    HA2  GLY  18           HA1      GLY  18  48.845   8.348  -5.471
  188    HA3  GLY  18           HA2      GLY  18  48.998   9.600  -6.725
  189    H    ARG  19           HN       ARG  19  50.028  10.386  -3.637
  190    HA   ARG  19           HA       ARG  19  52.423   9.999  -2.795
  191    HB2  ARG  19           HB2      ARG  19  53.251   9.273  -5.159
  192    HB3  ARG  19           HB1      ARG  19  53.084  11.028  -5.652
  193    HG2  ARG  19           HG2      ARG  19  55.423  10.376  -5.003
  194    HG3  ARG  19           HG1      ARG  19  54.764  11.588  -3.891
  195    HD2  ARG  19           HD2      ARG  19  54.663  10.076  -2.106
  196    HD3  ARG  19           HD1      ARG  19  54.457   8.666  -3.175
  197    HE   ARG  19           HE       ARG  19  56.803   8.478  -3.246
  198   HH11  ARG  19          HH11      ARG  19  56.118  10.812  -1.014
  199   HH12  ARG  19          HH12      ARG  19  57.589  11.709  -1.199
  200   HH21  ARG  19          HH21      ARG  19  58.593   9.985  -4.035
  201   HH22  ARG  19          HH22      ARG  19  58.990  11.240  -2.910
  202    H    LYS  20           HN       LYS  20  50.805  11.878  -5.055
  203    HA   LYS  20           HA       LYS  20  50.786  13.926  -5.729
  204    HB2  LYS  20           HB2      LYS  20  50.241  15.602  -4.605
  205    HB3  LYS  20           HB1      LYS  20  49.446  14.247  -3.829
  206    HG2  LYS  20           HG2      LYS  20  51.615  14.415  -2.196
  207    HG3  LYS  20           HG1      LYS  20  51.546  16.100  -2.707
  208    HD2  LYS  20           HD2      LYS  20  49.128  14.647  -1.561
  209    HD3  LYS  20           HD1      LYS  20  50.281  15.555  -0.558
  210    HE2  LYS  20           HE2      LYS  20  48.380  16.993  -1.148
  211    HE3  LYS  20           HE1      LYS  20  49.855  17.584  -1.948
  212    HZ1  LYS  20           HZ1      LYS  20  48.189  15.640  -3.380
  213    HZ2  LYS  20           HZ2      LYS  20  49.126  16.921  -3.984
  214    HZ3  LYS  20           HZ3      LYS  20  47.619  17.233  -3.265
  215    H    ALA  21           HN       ALA  21  52.150  13.477  -6.407
  216    HA   ALA  21           HA       ALA  21  54.203  15.062  -6.904
  217    HB1  ALA  21           HB1      ALA  21  56.218  14.120  -6.108
  218    HB2  ALA  21           HB2      ALA  21  55.480  12.511  -5.947
  219    HB3  ALA  21           HB3      ALA  21  55.166  13.761  -4.720
  220    H    VAL  22           HN       VAL  22  51.865  13.209  -6.773
  221    HA   VAL  22           HA       VAL  22  52.459  12.365  -9.629
  222    HB   VAL  22           HB       VAL  22  50.795  10.826  -7.605
  223   HG11  VAL  22          HG11      VAL  22  50.622  10.894 -10.624
  224   HG12  VAL  22          HG12      VAL  22  49.304  10.890  -9.428
  225   HG13  VAL  22          HG13      VAL  22  50.214   9.399  -9.748
  226   HG21  VAL  22          HG21      VAL  22  52.982   9.965  -9.549
  227   HG22  VAL  22          HG22      VAL  22  52.117   8.873  -8.445
  228   HG23  VAL  22          HG23      VAL  22  53.178  10.141  -7.794
  229    H    ILE  23           HN       ILE  23  51.621  14.478  -7.543
  230    HA   ILE  23           HA       ILE  23  49.810  15.546  -9.470
  231    HB   ILE  23           HB       ILE  23  48.622  15.375  -6.691
  232   HG12  ILE  23          HG12      ILE  23  48.373  13.194  -8.053
  233   HG13  ILE  23          HG11      ILE  23  46.873  13.931  -7.508
  234   HG21  ILE  23          HG21      ILE  23  48.051  17.460  -7.677
  235   HG22  ILE  23          HG22      ILE  23  46.617  16.427  -7.887
  236   HG23  ILE  23          HG23      ILE  23  47.719  16.711  -9.257
  237   HD11  ILE  23           HD1      ILE  23  47.995  14.463 -10.282
  238   HD12  ILE  23           HD2      ILE  23  46.367  14.812  -9.668
  239   HD13  ILE  23           HD3      ILE  23  46.880  13.130  -9.926
  240    H    ALA  24           HN       ALA  24  51.555  15.486  -6.665
  241    HA   ALA  24           HA       ALA  24  51.865  18.381  -6.906
  242    HB1  ALA  24           HB1      ALA  24  53.332  18.364  -5.090
  243    HB2  ALA  24           HB2      ALA  24  53.864  16.709  -5.421
  244    HB3  ALA  24           HB3      ALA  24  52.278  17.002  -4.684
  245    H    TRP  25           HN       TRP  25  52.281  15.413  -8.330
  246    HA   TRP  25           HA       TRP  25  53.748  16.693 -10.524
  247    HB2  TRP  25           HB2      TRP  25  55.730  16.753  -9.073
  248    HB3  TRP  25           HB1      TRP  25  55.623  15.014  -8.797
  249    HD1  TRP  25           HD1      TRP  25  55.741  17.372 -11.877
  250    HE1  TRP  25           HE1      TRP  25  57.290  16.322 -13.683
  251    HE3  TRP  25           HE3      TRP  25  56.996  13.043  -9.446
  252    HZ2  TRP  25           HZ2      TRP  25  58.850  13.921 -13.997
  253    HZ3  TRP  25           HZ3      TRP  25  58.516  11.388 -10.518
  254    HH2  TRP  25           HH2      TRP  25  59.443  11.823 -12.789
  Start of MODEL    8
    1    H1   ALA   1           HT1      ALA   1  46.850   6.253   8.898
    2    H2   ALA   1           HT2      ALA   1  47.464   5.969  10.458
    3    H3   ALA   1           HT3      ALA   1  47.760   4.857   9.207
    4    HA   ALA   1           HA       ALA   1  49.696   6.172   9.671
    5    HB1  ALA   1           HB1      ALA   1  48.248   6.478   7.035
    6    HB2  ALA   1           HB2      ALA   1  49.609   5.409   7.439
    7    HB3  ALA   1           HB3      ALA   1  49.869   7.163   7.266
    8    H    TRP   2           HN       TRP   2  48.982   8.530   7.456
    9    HA   TRP   2           HA       TRP   2  48.126  10.542   9.328
   10    HB2  TRP   2           HB2      TRP   2  50.707  10.312   9.338
   11    HB3  TRP   2           HB1      TRP   2  50.551  11.134   7.785
   12    HD1  TRP   2           HD1      TRP   2  47.885  12.801   9.371
   13    HE1  TRP   2           HE1      TRP   2  48.576  14.925  10.676
   14    HE3  TRP   2           HE3      TRP   2  52.919  11.911   9.780
   15    HZ2  TRP   2           HZ2      TRP   2  50.986  16.071  11.745
   16    HZ3  TRP   2           HZ3      TRP   2  54.392  13.541  10.949
   17    HH2  TRP   2           HH2      TRP   2  53.431  15.620  11.931
   18    H    LYS   3           HN       LYS   3  48.255   9.092   6.418
   19    HA   LYS   3           HA       LYS   3  47.535   9.682   4.314
   20    HB2  LYS   3           HB2      LYS   3  45.601  10.766   4.396
   21    HB3  LYS   3           HB1      LYS   3  45.978  11.482   5.970
   22    HG2  LYS   3           HG2      LYS   3  47.258  13.309   4.820
   23    HG3  LYS   3           HG1      LYS   3  46.814  12.598   3.248
   24    HD2  LYS   3           HD2      LYS   3  44.505  13.065   3.567
   25    HD3  LYS   3           HD1      LYS   3  44.721  13.403   5.300
   26    HE2  LYS   3           HE2      LYS   3  45.882  15.457   4.844
   27    HE3  LYS   3           HE1      LYS   3  46.058  15.054   3.119
   28    HZ1  LYS   3           HZ1      LYS   3  43.336  15.082   4.141
   29    HZ2  LYS   3           HZ2      LYS   3  43.958  15.672   2.674
   30    HZ3  LYS   3           HZ3      LYS   3  44.108  16.592   4.095
   31    H    GLU   4           HN       GLU   4  49.689  10.637   6.301
   32    HA   GLU   4           HA       GLU   4  51.419  11.907   4.371
   33    HB2  GLU   4           HB2      GLU   4  50.400  13.390   6.569
   34    HB3  GLU   4           HB1      GLU   4  52.009  12.863   7.108
   35    HG2  GLU   4           HG2      GLU   4  52.918  13.760   4.892
   36    HG3  GLU   4           HG1      GLU   4  51.318  14.493   4.627
   37    H    LYS   5           HN       LYS   5  50.634   9.828   7.258
   38    HA   LYS   5           HA       LYS   5  53.467   8.714   6.814
   39    HB2  LYS   5           HB2      LYS   5  51.234   8.210   8.786
   40    HB3  LYS   5           HB1      LYS   5  52.070   6.768   8.204
   41    HG2  LYS   5           HG2      LYS   5  53.673   9.156   9.189
   42    HG3  LYS   5           HG1      LYS   5  52.964   8.020  10.360
   43    HD2  LYS   5           HD2      LYS   5  54.148   6.143   9.335
   44    HD3  LYS   5           HD1      LYS   5  54.774   7.194   8.044
   45    HE2  LYS   5           HE2      LYS   5  56.060   8.497   9.652
   46    HE3  LYS   5           HE1      LYS   5  55.335   7.605  11.011
   47    HZ1  LYS   5           HZ1      LYS   5  56.354   5.682   9.319
   48    HZ2  LYS   5           HZ2      LYS   5  57.008   6.182  10.805
   49    HZ3  LYS   5           HZ3      LYS   5  57.543   6.890   9.357
   50    H    ILE   6           HN       ILE   6  50.677   9.552   5.503
   51    HA   ILE   6           HA       ILE   6  49.361   8.850   3.716
   52    HB   ILE   6           HB       ILE   6  50.465   8.171   1.824
   53   HG12  ILE   6          HG12      ILE   6  51.840   5.947   3.417
   54   HG13  ILE   6          HG11      ILE   6  50.481   5.758   2.292
   55   HG21  ILE   6          HG21      ILE   6  52.976   8.165   3.532
   56   HG22  ILE   6          HG22      ILE   6  52.040   9.649   3.231
   57   HG23  ILE   6          HG23      ILE   6  52.757   8.758   1.870
   58   HD11  ILE   6           HD1      ILE   6  52.055   6.834   0.525
   59   HD12  ILE   6           HD2      ILE   6  52.380   5.154   1.011
   60   HD13  ILE   6           HD3      ILE   6  53.363   6.479   1.677
   61    H    ARG   7           HN       ARG   7  47.604   8.004   3.974
   62    HA   ARG   7           HA       ARG   7  46.259   6.009   3.605
   63    HB2  ARG   7           HB2      ARG   7  48.118   4.390   3.845
   64    HB3  ARG   7           HB1      ARG   7  48.009   4.598   5.607
   65    HG2  ARG   7           HG2      ARG   7  45.746   3.721   5.629
   66    HG3  ARG   7           HG1      ARG   7  45.666   3.749   3.852
   67    HD2  ARG   7           HD2      ARG   7  47.623   2.064   5.472
   68    HD3  ARG   7           HD1      ARG   7  46.102   1.459   4.774
   69    HE   ARG   7           HE       ARG   7  47.666   2.719   2.718
   70   HH11  ARG   7          HH11      ARG   7  46.949   0.570   1.427
   71   HH12  ARG   7          HH12      ARG   7  48.036  -0.731   1.780
   72   HH21  ARG   7          HH21      ARG   7  49.334   0.772   4.622
   73   HH22  ARG   7          HH22      ARG   7  49.385  -0.618   3.589
   74    H    LYS   8           HN       LYS   8  45.350   7.881   4.390
   75    HA   LYS   8           HA       LYS   8  43.937   7.060   6.742
   76    HB2  LYS   8           HB2      LYS   8  46.005   8.960   7.142
   77    HB3  LYS   8           HB1      LYS   8  44.535   9.949   7.046
   78    HG2  LYS   8           HG2      LYS   8  44.830   7.516   8.869
   79    HG3  LYS   8           HG1      LYS   8  45.146   9.188   9.386
   80    HD2  LYS   8           HD2      LYS   8  42.822   9.815   8.758
   81    HD3  LYS   8           HD1      LYS   8  42.503   8.130   8.285
   82    HE2  LYS   8           HE2      LYS   8  43.297   9.091  11.068
   83    HE3  LYS   8           HE1      LYS   8  41.681   8.537  10.570
   84    HZ1  LYS   8           HZ1      LYS   8  42.416   6.548  11.242
   85    HZ2  LYS   8           HZ2      LYS   8  44.052   7.003  11.195
   86    HZ3  LYS   8           HZ3      LYS   8  43.265   6.504   9.774
   87    H    LYS   9           HN       LYS   9  44.358   8.511   3.734
   88    HA   LYS   9           HA       LYS   9  41.604   9.794   3.929
   89    HB2  LYS   9           HB2      LYS   9  42.695   8.590   1.348
   90    HB3  LYS   9           HB1      LYS   9  41.398   9.769   1.546
   91    HG2  LYS   9           HG2      LYS   9  43.996  10.712   2.690
   92    HG3  LYS   9           HG1      LYS   9  44.016  10.481   0.938
   93    HD2  LYS   9           HD2      LYS   9  43.363  12.797   1.518
   94    HD3  LYS   9           HD1      LYS   9  42.049  11.944   0.684
   95    HE2  LYS   9           HE2      LYS   9  41.363  13.345   2.713
   96    HE3  LYS   9           HE1      LYS   9  40.805  11.664   2.727
   97    HZ1  LYS   9           HZ1      LYS   9  43.323  11.721   3.931
   98    HZ2  LYS   9           HZ2      LYS   9  41.824  11.427   4.667
   99    HZ3  LYS   9           HZ3      LYS   9  42.441  13.006   4.591
  100    H    LEU  10           HN       LEU  10  43.101   6.840   4.085
  101    HA   LEU  10           HA       LEU  10  41.483   4.906   4.780
  102    HB2  LEU  10           HB2      LEU  10  39.649   5.813   3.362
  103    HB3  LEU  10           HB1      LEU  10  40.763   5.634   1.933
  104    HG   LEU  10           HG       LEU  10  40.646   3.131   2.293
  105   HD11  LEU  10          HD11      LEU  10  40.478   2.811   4.625
  106   HD12  LEU  10          HD12      LEU  10  38.871   2.341   4.039
  107   HD13  LEU  10          HD13      LEU  10  39.111   3.941   4.778
  108   HD21  LEU  10          HD21      LEU  10  37.785   4.137   2.495
  109   HD22  LEU  10          HD22      LEU  10  38.418   2.779   1.534
  110   HD23  LEU  10          HD23      LEU  10  38.769   4.453   1.047
  111    H    LYS  11           HN       LYS  11  42.348   5.867   1.610
  112    HA   LYS  11           HA       LYS  11  44.191   3.737   1.039
  113    HB2  LYS  11           HB2      LYS  11  42.585   5.372  -0.676
  114    HB3  LYS  11           HB1      LYS  11  43.548   3.962  -1.237
  115    HG2  LYS  11           HG2      LYS  11  42.002   2.632   0.468
  116    HG3  LYS  11           HG1      LYS  11  40.912   4.019   0.223
  117    HD2  LYS  11           HD2      LYS  11  40.965   3.649  -2.217
  118    HD3  LYS  11           HD1      LYS  11  42.065   2.268  -1.986
  119    HE2  LYS  11           HE2      LYS  11  40.302   1.208  -0.513
  120    HE3  LYS  11           HE1      LYS  11  39.200   2.526  -0.979
  121    HZ1  LYS  11           HZ1      LYS  11  40.278   0.326  -2.605
  122    HZ2  LYS  11           HZ2      LYS  11  39.940   1.805  -3.369
  123    HZ3  LYS  11           HZ3      LYS  11  38.708   0.965  -2.556
  124    H    ASN  12           HN       ASN  12  43.466   6.264   1.810
  125    HA   ASN  12           HA       ASN  12  44.697   8.458   1.926
  126    HB2  ASN  12           HB2      ASN  12  47.171   8.485   0.916
  127    HB3  ASN  12           HB1      ASN  12  46.838   8.069   2.564
  128   HD21  ASN  12          HD21      ASN  12  49.071   7.306   0.548
  129   HD22  ASN  12          HD22      ASN  12  49.163   5.548   0.683
  130    H    GLU  13           HN       GLU  13  43.155   7.032   0.057
  131    HA   GLU  13           HA       GLU  13  42.260   7.228  -2.063
  132    HB2  GLU  13           HB2      GLU  13  44.252   9.514  -2.460
  133    HB3  GLU  13           HB1      GLU  13  42.945   9.068  -3.569
  134    HG2  GLU  13           HG2      GLU  13  41.247   9.670  -1.989
  135    HG3  GLU  13           HG1      GLU  13  42.429   9.810  -0.670
  136    H    ILE  14           HN       ILE  14  44.337   5.370  -1.149
  137    HA   ILE  14           HA       ILE  14  45.799   3.913  -2.218
  138    HB   ILE  14           HB       ILE  14  45.740   5.510  -4.828
  139   HG12  ILE  14          HG12      ILE  14  43.862   3.299  -3.859
  140   HG13  ILE  14          HG11      ILE  14  43.401   4.954  -4.302
  141   HG21  ILE  14          HG21      ILE  14  47.509   3.721  -4.332
  142   HG22  ILE  14          HG22      ILE  14  46.546   3.485  -5.807
  143   HG23  ILE  14          HG23      ILE  14  46.176   2.542  -4.343
  144   HD11  ILE  14           HD1      ILE  14  44.435   4.407  -6.632
  145   HD12  ILE  14           HD2      ILE  14  42.858   3.689  -6.227
  146   HD13  ILE  14           HD3      ILE  14  44.336   2.708  -6.111
  147    H    LYS  15           HN       LYS  15  46.006   7.363  -2.356
  148    HA   LYS  15           HA       LYS  15  48.239   7.822  -0.986
  149    HB2  LYS  15           HB2      LYS  15  49.049   6.876  -3.670
  150    HB3  LYS  15           HB1      LYS  15  49.614   8.533  -3.289
  151    HG2  LYS  15           HG2      LYS  15  50.579   7.648  -1.141
  152    HG3  LYS  15           HG1      LYS  15  50.122   6.002  -1.627
  153    HD2  LYS  15           HD2      LYS  15  51.870   7.809  -3.351
  154    HD3  LYS  15           HD1      LYS  15  52.542   6.705  -2.133
  155    HE2  LYS  15           HE2      LYS  15  51.204   4.837  -3.325
  156    HE3  LYS  15           HE1      LYS  15  50.989   6.006  -4.650
  157    HZ1  LYS  15           HZ1      LYS  15  52.945   4.577  -4.944
  158    HZ2  LYS  15           HZ2      LYS  15  53.613   5.191  -3.508
  159    HZ3  LYS  15           HZ3      LYS  15  53.363   6.217  -4.839
  160    H    LYS  16           HN       LYS  16  48.629   9.867  -0.836
  161    HA   LYS  16           HA       LYS  16  47.490  11.877  -1.139
  162    HB2  LYS  16           HB2      LYS  16  49.645  11.889  -2.919
  163    HB3  LYS  16           HB1      LYS  16  49.000  13.342  -2.176
  164    HG2  LYS  16           HG2      LYS  16  50.014  11.017  -0.497
  165    HG3  LYS  16           HG1      LYS  16  51.120  12.267  -1.094
  166    HD2  LYS  16           HD2      LYS  16  49.607  14.006  -0.020
  167    HD3  LYS  16           HD1      LYS  16  48.707  12.663   0.724
  168    HE2  LYS  16           HE2      LYS  16  50.383  13.478   2.307
  169    HE3  LYS  16           HE1      LYS  16  50.852  11.855   1.747
  170    HZ1  LYS  16           HZ1      LYS  16  52.688  12.661   0.812
  171    HZ2  LYS  16           HZ2      LYS  16  52.399  14.106   1.658
  172    HZ3  LYS  16           HZ3      LYS  16  51.863  13.935   0.055
  173    H    LYS  17           HN       LYS  17  48.374  11.652  -3.740
  174    HA   LYS  17           HA       LYS  17  45.677  11.737  -5.086
  175    HB2  LYS  17           HB2      LYS  17  47.859  13.814  -5.606
  176    HB3  LYS  17           HB1      LYS  17  46.535  13.454  -6.730
  177    HG2  LYS  17           HG2      LYS  17  45.499  15.201  -5.608
  178    HG3  LYS  17           HG1      LYS  17  45.055  13.909  -4.475
  179    HD2  LYS  17           HD2      LYS  17  47.212  14.457  -3.208
  180    HD3  LYS  17           HD1      LYS  17  47.353  15.896  -4.237
  181    HE2  LYS  17           HE2      LYS  17  46.221  16.622  -2.255
  182    HE3  LYS  17           HE1      LYS  17  44.962  16.482  -3.504
  183    HZ1  LYS  17           HZ1      LYS  17  44.180  14.508  -2.596
  184    HZ2  LYS  17           HZ2      LYS  17  44.531  15.440  -1.221
  185    HZ3  LYS  17           HZ3      LYS  17  45.597  14.213  -1.713
  186    H    GLY  18           HN       GLY  18  48.236  10.486  -4.073
  187    HA2  GLY  18           HA1      GLY  18  48.871   8.340  -5.430
  188    HA3  GLY  18           HA2      GLY  18  49.068   9.382  -6.848
  189    H    ARG  19           HN       ARG  19  49.887  10.277  -3.587
  190    HA   ARG  19           HA       ARG  19  52.265  10.138  -2.695
  191    HB2  ARG  19           HB2      ARG  19  53.192   9.339  -4.994
  192    HB3  ARG  19           HB1      ARG  19  53.011  11.090  -5.577
  193    HG2  ARG  19           HG2      ARG  19  54.681  11.786  -3.993
  194    HG3  ARG  19           HG1      ARG  19  54.553  10.334  -2.987
  195    HD2  ARG  19           HD2      ARG  19  55.963   9.096  -4.344
  196    HD3  ARG  19           HD1      ARG  19  55.416   9.890  -5.838
  197    HE   ARG  19           HE       ARG  19  56.840  11.811  -4.280
  198   HH11  ARG  19          HH11      ARG  19  59.166  11.111  -3.800
  199   HH12  ARG  19          HH12      ARG  19  59.991  10.468  -5.181
  200   HH21  ARG  19          HH21      ARG  19  57.092  10.014  -7.030
  201   HH22  ARG  19          HH22      ARG  19  58.817   9.848  -7.011
  202    H    LYS  20           HN       LYS  20  50.823  11.880  -5.137
  203    HA   LYS  20           HA       LYS  20  50.757  13.866  -5.894
  204    HB2  LYS  20           HB2      LYS  20  50.498  15.735  -4.826
  205    HB3  LYS  20           HB1      LYS  20  49.463  14.521  -4.105
  206    HG2  LYS  20           HG2      LYS  20  51.156  14.335  -2.188
  207    HG3  LYS  20           HG1      LYS  20  51.974  15.749  -2.876
  208    HD2  LYS  20           HD2      LYS  20  49.771  16.996  -2.723
  209    HD3  LYS  20           HD1      LYS  20  49.144  15.629  -1.777
  210    HE2  LYS  20           HE2      LYS  20  51.000  15.925  -0.143
  211    HE3  LYS  20           HE1      LYS  20  51.579  17.326  -1.077
  212    HZ1  LYS  20           HZ1      LYS  20  48.772  17.448  -0.445
  213    HZ2  LYS  20           HZ2      LYS  20  49.987  18.618  -0.234
  214    HZ3  LYS  20           HZ3      LYS  20  49.756  17.408   0.936
  215    H    ALA  21           HN       ALA  21  52.058  13.396  -6.678
  216    HA   ALA  21           HA       ALA  21  54.208  14.870  -7.252
  217    HB1  ALA  21           HB1      ALA  21  55.336  13.638  -5.251
  218    HB2  ALA  21           HB2      ALA  21  56.161  13.517  -6.822
  219    HB3  ALA  21           HB3      ALA  21  55.151  12.176  -6.246
  220    H    VAL  22           HN       VAL  22  51.782  13.116  -6.960
  221    HA   VAL  22           HA       VAL  22  52.098  12.274  -9.865
  222    HB   VAL  22           HB       VAL  22  50.465  10.941  -7.684
  223   HG11  VAL  22          HG11      VAL  22  50.046  10.942 -10.685
  224   HG12  VAL  22          HG12      VAL  22  48.836  11.101  -9.388
  225   HG13  VAL  22          HG13      VAL  22  49.580   9.521  -9.719
  226   HG21  VAL  22          HG21      VAL  22  52.368   9.830  -9.790
  227   HG22  VAL  22          HG22      VAL  22  51.559   8.878  -8.526
  228   HG23  VAL  22          HG23      VAL  22  52.779  10.097  -8.080
  229    H    ILE  23           HN       ILE  23  51.575  14.543  -7.863
  230    HA   ILE  23           HA       ILE  23  49.860  15.712  -9.791
  231    HB   ILE  23           HB       ILE  23  48.249  14.621  -7.723
  232   HG12  ILE  23          HG12      ILE  23  47.704  16.738  -9.841
  233   HG13  ILE  23          HG11      ILE  23  47.434  14.987  -9.971
  234   HG21  ILE  23          HG21      ILE  23  47.282  16.480  -6.527
  235   HG22  ILE  23          HG22      ILE  23  48.177  17.658  -7.514
  236   HG23  ILE  23          HG23      ILE  23  49.036  16.640  -6.344
  237   HD11  ILE  23           HD1      ILE  23  45.272  15.869  -9.559
  238   HD12  ILE  23           HD2      ILE  23  45.876  17.031  -8.355
  239   HD13  ILE  23           HD3      ILE  23  45.803  15.299  -7.962
  240    H    ALA  24           HN       ALA  24  51.586  15.531  -6.982
  241    HA   ALA  24           HA       ALA  24  52.203  18.377  -7.275
  242    HB1  ALA  24           HB1      ALA  24  54.069  16.578  -5.777
  243    HB2  ALA  24           HB2      ALA  24  52.501  16.919  -5.020
  244    HB3  ALA  24           HB3      ALA  24  53.602  18.248  -5.418
  245    H    TRP  25           HN       TRP  25  52.272  15.332  -8.592
  246    HA   TRP  25           HA       TRP  25  53.447  14.580 -10.507
  247    HB2  TRP  25           HB2      TRP  25  52.786  16.898 -11.319
  248    HB3  TRP  25           HB1      TRP  25  54.437  17.422 -10.919
  249    HD1  TRP  25           HD1      TRP  25  52.456  15.356 -13.406
  250    HE1  TRP  25           HE1      TRP  25  53.988  14.610 -15.370
  251    HE3  TRP  25           HE3      TRP  25  56.976  16.822 -11.503
  252    HZ2  TRP  25           HZ2      TRP  25  56.797  14.658 -15.998
  253    HZ3  TRP  25           HZ3      TRP  25  59.070  16.461 -12.802
  254    HH2  TRP  25           HH2      TRP  25  58.984  15.382 -15.046
  Start of MODEL    9
    1    H1   ALA   1           HT1      ALA   1  53.891   3.209   3.341
    2    H2   ALA   1           HT2      ALA   1  52.284   3.030   3.861
    3    H3   ALA   1           HT3      ALA   1  53.400   1.770   4.090
    4    HA   ALA   1           HA       ALA   1  54.602   2.954   5.677
    5    HB1  ALA   1           HB1      ALA   1  54.489   5.250   5.975
    6    HB2  ALA   1           HB2      ALA   1  52.759   5.334   5.540
    7    HB3  ALA   1           HB3      ALA   1  54.002   5.168   4.265
    8    H    TRP   2           HN       TRP   2  52.771   4.824   7.225
    9    HA   TRP   2           HA       TRP   2  51.624   2.992   8.907
   10    HB2  TRP   2           HB2      TRP   2  50.729   5.738   8.588
   11    HB3  TRP   2           HB1      TRP   2  50.522   4.739  10.028
   12    HD1  TRP   2           HD1      TRP   2  53.820   3.763   9.171
   13    HE1  TRP   2           HE1      TRP   2  55.673   5.166  10.313
   14    HE3  TRP   2           HE3      TRP   2  51.021   7.814  10.621
   15    HZ2  TRP   2           HZ2      TRP   2  55.896   7.686  11.666
   16    HZ3  TRP   2           HZ3      TRP   2  52.085   9.702  11.840
   17    HH2  TRP   2           HH2      TRP   2  54.518   9.642  12.363
   18    H    LYS   3           HN       LYS   3  50.652   3.879   5.894
   19    HA   LYS   3           HA       LYS   3  48.607   3.891   4.842
   20    HB2  LYS   3           HB2      LYS   3  46.937   2.201   6.454
   21    HB3  LYS   3           HB1      LYS   3  47.603   1.920   4.822
   22    HG2  LYS   3           HG2      LYS   3  49.796   1.222   6.052
   23    HG3  LYS   3           HG1      LYS   3  48.792   1.128   7.521
   24    HD2  LYS   3           HD2      LYS   3  47.270  -0.456   6.379
   25    HD3  LYS   3           HD1      LYS   3  48.283  -0.373   4.918
   26    HE2  LYS   3           HE2      LYS   3  48.869  -2.366   6.245
   27    HE3  LYS   3           HE1      LYS   3  50.225  -1.212   6.235
   28    HZ1  LYS   3           HZ1      LYS   3  48.407  -0.687   8.372
   29    HZ2  LYS   3           HZ2      LYS   3  50.080  -0.977   8.425
   30    HZ3  LYS   3           HZ3      LYS   3  48.989  -2.279   8.448
   31    H    GLU   4           HN       GLU   4  49.637   5.264   7.100
   32    HA   GLU   4           HA       GLU   4  47.433   7.008   7.597
   33    HB2  GLU   4           HB2      GLU   4  48.056   5.230   9.659
   34    HB3  GLU   4           HB1      GLU   4  49.095   6.615  10.044
   35    HG2  GLU   4           HG2      GLU   4  47.045   8.101   9.837
   36    HG3  GLU   4           HG1      GLU   4  46.069   6.617   9.716
   37    H    LYS   5           HN       LYS   5  50.912   5.945   7.529
   38    HA   LYS   5           HA       LYS   5  51.490   8.961   7.260
   39    HB2  LYS   5           HB2      LYS   5  53.141   6.513   7.466
   40    HB3  LYS   5           HB1      LYS   5  53.581   7.438   6.019
   41    HG2  LYS   5           HG2      LYS   5  53.306   8.775   8.738
   42    HG3  LYS   5           HG1      LYS   5  54.817   7.984   8.242
   43    HD2  LYS   5           HD2      LYS   5  54.876   9.413   6.197
   44    HD3  LYS   5           HD1      LYS   5  53.401  10.240   6.750
   45    HE2  LYS   5           HE2      LYS   5  54.518  11.106   8.703
   46    HE3  LYS   5           HE1      LYS   5  55.943  10.080   8.416
   47    HZ1  LYS   5           HZ1      LYS   5  56.293  11.281   6.319
   48    HZ2  LYS   5           HZ2      LYS   5  56.365  12.316   7.664
   49    HZ3  LYS   5           HZ3      LYS   5  54.983  12.298   6.676
   50    H    ILE   6           HN       ILE   6  49.690   6.527   6.162
   51    HA   ILE   6           HA       ILE   6  49.371   7.807   3.423
   52    HB   ILE   6           HB       ILE   6  49.790   4.769   3.499
   53   HG12  ILE   6          HG12      ILE   6  51.919   6.174   3.778
   54   HG13  ILE   6          HG11      ILE   6  51.904   5.008   2.470
   55   HG21  ILE   6          HG21      ILE   6  49.852   5.080   0.989
   56   HG22  ILE   6          HG22      ILE   6  49.253   6.720   1.274
   57   HG23  ILE   6          HG23      ILE   6  48.264   5.334   1.725
   58   HD11  ILE   6           HD1      ILE   6  51.224   7.955   2.100
   59   HD12  ILE   6           HD2      ILE   6  51.554   6.747   0.838
   60   HD13  ILE   6           HD3      ILE   6  52.859   7.295   1.908
   61    H    ARG   7           HN       ARG   7  47.555   4.945   3.175
   62    HA   ARG   7           HA       ARG   7  45.182   5.739   2.983
   63    HB2  ARG   7           HB2      ARG   7  45.010   3.541   3.351
   64    HB3  ARG   7           HB1      ARG   7  46.122   3.575   4.689
   65    HG2  ARG   7           HG2      ARG   7  44.427   4.037   6.288
   66    HG3  ARG   7           HG1      ARG   7  43.294   4.603   5.054
   67    HD2  ARG   7           HD2      ARG   7  44.186   1.758   5.676
   68    HD3  ARG   7           HD1      ARG   7  42.546   2.429   5.761
   69    HE   ARG   7           HE       ARG   7  43.552   2.572   3.058
   70   HH11  ARG   7          HH11      ARG   7  43.538   0.581   1.814
   71   HH12  ARG   7          HH12      ARG   7  42.390  -0.628   2.288
   72   HH21  ARG   7          HH21      ARG   7  41.556   0.951   5.261
   73   HH22  ARG   7          HH22      ARG   7  41.269  -0.418   4.239
   74    H    LYS   8           HN       LYS   8  45.353   7.900   3.425
   75    HA   LYS   8           HA       LYS   8  43.980   8.451   5.944
   76    HB2  LYS   8           HB2      LYS   8  46.308   9.321   6.218
   77    HB3  LYS   8           HB1      LYS   8  46.079  10.268   4.735
   78    HG2  LYS   8           HG2      LYS   8  45.736  11.696   6.694
   79    HG3  LYS   8           HG1      LYS   8  44.207  11.506   5.812
   80    HD2  LYS   8           HD2      LYS   8  43.287  10.064   7.451
   81    HD3  LYS   8           HD1      LYS   8  44.884   9.639   8.115
   82    HE2  LYS   8           HE2      LYS   8  43.654  12.426   8.273
   83    HE3  LYS   8           HE1      LYS   8  43.537  11.212   9.569
   84    HZ1  LYS   8           HZ1      LYS   8  45.917  11.167   9.741
   85    HZ2  LYS   8           HZ2      LYS   8  45.401  12.782   9.856
   86    HZ3  LYS   8           HZ3      LYS   8  46.094  12.209   8.415
   87    H    LYS   9           HN       LYS   9  44.537   8.887   2.648
   88    HA   LYS   9           HA       LYS   9  42.117  10.736   2.574
   89    HB2  LYS   9           HB2      LYS   9  43.825  10.791   0.594
   90    HB3  LYS   9           HB1      LYS   9  43.105   9.213   0.125
   91    HG2  LYS   9           HG2      LYS   9  41.790  10.712  -1.107
   92    HG3  LYS   9           HG1      LYS   9  40.811  10.555   0.362
   93    HD2  LYS   9           HD2      LYS   9  41.782  12.644   1.258
   94    HD3  LYS   9           HD1      LYS   9  42.826  12.784  -0.176
   95    HE2  LYS   9           HE2      LYS   9  40.873  14.212  -0.486
   96    HE3  LYS   9           HE1      LYS   9  40.760  12.835  -1.609
   97    HZ1  LYS   9           HZ1      LYS   9  38.922  12.114  -0.609
   98    HZ2  LYS   9           HZ2      LYS   9  38.857  13.610   0.194
   99    HZ3  LYS   9           HZ3      LYS   9  39.585  12.271   0.945
  100    H    LEU  10           HN       LEU  10  43.269   7.527   2.855
  101    HA   LEU  10           HA       LEU  10  41.085   6.078   3.688
  102    HB2  LEU  10           HB2      LEU  10  39.752   6.973   1.764
  103    HB3  LEU  10           HB1      LEU  10  41.102   6.465   0.672
  104    HG   LEU  10           HG       LEU  10  40.530   4.057   1.339
  105   HD11  LEU  10          HD11      LEU  10  38.495   5.470   3.090
  106   HD12  LEU  10          HD12      LEU  10  39.680   4.220   3.544
  107   HD13  LEU  10          HD13      LEU  10  38.263   3.787   2.564
  108   HD21  LEU  10          HD21      LEU  10  39.327   5.359  -0.579
  109   HD22  LEU  10          HD22      LEU  10  37.945   5.442   0.535
  110   HD23  LEU  10          HD23      LEU  10  38.567   3.862   0.004
  111    H    LYS  11           HN       LYS  11  42.852   6.612   0.920
  112    HA   LYS  11           HA       LYS  11  44.572   4.360   0.999
  113    HB2  LYS  11           HB2      LYS  11  43.426   5.668  -1.280
  114    HB3  LYS  11           HB1      LYS  11  44.389   4.160  -1.363
  115    HG2  LYS  11           HG2      LYS  11  42.411   3.265   0.233
  116    HG3  LYS  11           HG1      LYS  11  41.514   4.543  -0.619
  117    HD2  LYS  11           HD2      LYS  11  42.292   3.546  -2.801
  118    HD3  LYS  11           HD1      LYS  11  42.979   2.191  -1.873
  119    HE2  LYS  11           HE2      LYS  11  40.066   3.005  -2.146
  120    HE3  LYS  11           HE1      LYS  11  40.817   1.435  -2.518
  121    HZ1  LYS  11           HZ1      LYS  11  41.444   1.600   0.026
  122    HZ2  LYS  11           HZ2      LYS  11  39.950   0.975  -0.485
  123    HZ3  LYS  11           HZ3      LYS  11  40.058   2.577   0.072
  124    H    ASN  12           HN       ASN  12  43.787   6.988   1.143
  125    HA   ASN  12           HA       ASN  12  45.075   9.168   1.138
  126    HB2  ASN  12           HB2      ASN  12  47.013   7.332   1.967
  127    HB3  ASN  12           HB1      ASN  12  47.723   8.161   0.590
  128   HD21  ASN  12          HD21      ASN  12  46.703  10.756   0.802
  129   HD22  ASN  12          HD22      ASN  12  47.258  11.476   2.317
  130    H    GLU  13           HN       GLU  13  43.922   7.483  -0.776
  131    HA   GLU  13           HA       GLU  13  43.568   7.471  -3.078
  132    HB2  GLU  13           HB2      GLU  13  44.543   9.914  -2.937
  133    HB3  GLU  13           HB1      GLU  13  46.062   9.154  -3.493
  134    HG2  GLU  13           HG2      GLU  13  44.901   9.907  -5.474
  135    HG3  GLU  13           HG1      GLU  13  44.698   8.141  -5.411
  136    H    ILE  14           HN       ILE  14  45.235   5.632  -1.324
  137    HA   ILE  14           HA       ILE  14  46.572   3.822  -1.842
  138    HB   ILE  14           HB       ILE  14  45.829   4.492  -4.500
  139   HG12  ILE  14          HG12      ILE  14  47.581   2.190  -3.537
  140   HG13  ILE  14          HG11      ILE  14  45.806   2.249  -3.448
  141   HG21  ILE  14          HG21      ILE  14  47.779   4.366  -5.892
  142   HG22  ILE  14          HG22      ILE  14  48.838   4.006  -4.509
  143   HG23  ILE  14          HG23      ILE  14  48.143   5.629  -4.700
  144   HD11  ILE  14           HD1      ILE  14  47.582   2.023  -5.896
  145   HD12  ILE  14           HD2      ILE  14  45.938   2.691  -6.044
  146   HD13  ILE  14           HD3      ILE  14  46.177   1.035  -5.437
  147    H    LYS  15           HN       LYS  15  47.498   7.197  -2.201
  148    HA   LYS  15           HA       LYS  15  50.027   6.418  -0.922
  149    HB2  LYS  15           HB2      LYS  15  49.974   6.814  -3.759
  150    HB3  LYS  15           HB1      LYS  15  50.937   8.104  -3.009
  151    HG2  LYS  15           HG2      LYS  15  52.314   6.400  -1.843
  152    HG3  LYS  15           HG1      LYS  15  51.345   5.107  -2.587
  153    HD2  LYS  15           HD2      LYS  15  52.017   5.914  -4.842
  154    HD3  LYS  15           HD1      LYS  15  53.016   7.176  -4.081
  155    HE2  LYS  15           HE2      LYS  15  54.302   5.377  -2.892
  156    HE3  LYS  15           HE1      LYS  15  53.365   4.161  -3.791
  157    HZ1  LYS  15           HZ1      LYS  15  55.135   4.396  -5.176
  158    HZ2  LYS  15           HZ2      LYS  15  55.426   6.014  -4.746
  159    HZ3  LYS  15           HZ3      LYS  15  54.158   5.630  -5.811
  160    H    LYS  16           HN       LYS  16  48.533   9.219  -2.480
  161    HA   LYS  16           HA       LYS  16  48.753  10.615  -0.166
  162    HB2  LYS  16           HB2      LYS  16  50.477  11.542  -2.255
  163    HB3  LYS  16           HB1      LYS  16  50.085  12.519  -0.821
  164    HG2  LYS  16           HG2      LYS  16  51.060  10.616   0.583
  165    HG3  LYS  16           HG1      LYS  16  51.723   9.965  -0.939
  166    HD2  LYS  16           HD2      LYS  16  52.851  12.167  -1.331
  167    HD3  LYS  16           HD1      LYS  16  52.263  12.715   0.256
  168    HE2  LYS  16           HE2      LYS  16  53.464  10.853   1.356
  169    HE3  LYS  16           HE1      LYS  16  54.047  10.289  -0.229
  170    HZ1  LYS  16           HZ1      LYS  16  55.007  12.600  -0.481
  171    HZ2  LYS  16           HZ2      LYS  16  55.765  11.595   0.659
  172    HZ3  LYS  16           HZ3      LYS  16  54.707  12.820   1.173
  173    H    LYS  17           HN       LYS  17  48.928  10.892  -2.902
  174    HA   LYS  17           HA       LYS  17  46.061  11.582  -3.438
  175    HB2  LYS  17           HB2      LYS  17  48.253  13.458  -4.382
  176    HB3  LYS  17           HB1      LYS  17  46.604  13.436  -5.028
  177    HG2  LYS  17           HG2      LYS  17  47.298  13.944  -2.092
  178    HG3  LYS  17           HG1      LYS  17  46.911  15.206  -3.273
  179    HD2  LYS  17           HD2      LYS  17  44.706  13.734  -3.654
  180    HD3  LYS  17           HD1      LYS  17  45.089  13.141  -2.020
  181    HE2  LYS  17           HE2      LYS  17  44.637  16.037  -2.854
  182    HE3  LYS  17           HE1      LYS  17  43.591  15.042  -1.813
  183    HZ1  LYS  17           HZ1      LYS  17  46.298  16.102  -1.235
  184    HZ2  LYS  17           HZ2      LYS  17  45.643  14.805  -0.352
  185    HZ3  LYS  17           HZ3      LYS  17  44.866  16.316  -0.349
  186    H    GLY  18           HN       GLY  18  48.579   9.916  -3.407
  187    HA2  GLY  18           HA1      GLY  18  48.378   7.964  -5.140
  188    HA3  GLY  18           HA2      GLY  18  48.564   9.241  -6.377
  189    H    ARG  19           HN       ARG  19  50.095  10.673  -4.247
  190    HA   ARG  19           HA       ARG  19  52.579   9.576  -3.553
  191    HB2  ARG  19           HB2      ARG  19  52.636   9.201  -6.209
  192    HB3  ARG  19           HB1      ARG  19  52.787  10.994  -6.279
  193    HG2  ARG  19           HG2      ARG  19  54.886  10.890  -5.084
  194    HG3  ARG  19           HG1      ARG  19  54.620   9.232  -4.531
  195    HD2  ARG  19           HD2      ARG  19  54.651   9.543  -7.506
  196    HD3  ARG  19           HD1      ARG  19  56.200   9.850  -6.686
  197    HE   ARG  19           HE       ARG  19  55.066   7.446  -5.631
  198   HH11  ARG  19          HH11      ARG  19  56.730   5.837  -6.028
  199   HH12  ARG  19          HH12      ARG  19  57.230   5.617  -7.672
  200   HH21  ARG  19          HH21      ARG  19  55.577   8.438  -8.830
  201   HH22  ARG  19          HH22      ARG  19  56.578   7.091  -9.259
  202    H    LYS  20           HN       LYS  20  50.554  11.875  -4.927
  203    HA   LYS  20           HA       LYS  20  50.523  14.088  -5.232
  204    HB2  LYS  20           HB2      LYS  20  52.097  14.430  -2.751
  205    HB3  LYS  20           HB1      LYS  20  51.411  15.610  -3.889
  206    HG2  LYS  20           HG2      LYS  20  49.217  15.247  -3.209
  207    HG3  LYS  20           HG1      LYS  20  49.565  13.632  -2.606
  208    HD2  LYS  20           HD2      LYS  20  49.177  15.047  -0.682
  209    HD3  LYS  20           HD1      LYS  20  50.921  14.705  -0.738
  210    HE2  LYS  20           HE2      LYS  20  49.686  17.195  -1.988
  211    HE3  LYS  20           HE1      LYS  20  50.295  17.144  -0.317
  212    HZ1  LYS  20           HZ1      LYS  20  52.278  16.011  -1.851
  213    HZ2  LYS  20           HZ2      LYS  20  52.285  17.565  -1.166
  214    HZ3  LYS  20           HZ3      LYS  20  51.750  17.339  -2.763
  215    H    ALA  21           HN       ALA  21  51.569  13.250  -6.476
  216    HA   ALA  21           HA       ALA  21  53.628  14.653  -7.564
  217    HB1  ALA  21           HB1      ALA  21  54.709  11.866  -7.218
  218    HB2  ALA  21           HB2      ALA  21  55.024  13.038  -5.917
  219    HB3  ALA  21           HB3      ALA  21  55.600  13.360  -7.565
  220    H    VAL  22           HN       VAL  22  51.358  13.315  -6.613
  221    HA   VAL  22           HA       VAL  22  50.522  12.522  -9.450
  222    HB   VAL  22           HB       VAL  22  49.566  11.221  -6.860
  223   HG11  VAL  22          HG11      VAL  22  47.566  11.710  -8.140
  224   HG12  VAL  22          HG12      VAL  22  47.955  10.017  -8.498
  225   HG13  VAL  22          HG13      VAL  22  48.364  11.289  -9.668
  226   HG21  VAL  22          HG21      VAL  22  50.484   9.919  -9.467
  227   HG22  VAL  22          HG22      VAL  22  50.321   9.156  -7.872
  228   HG23  VAL  22          HG23      VAL  22  51.624  10.320  -8.168
  229    H    ILE  23           HN       ILE  23  50.944  14.646  -7.119
  230    HA   ILE  23           HA       ILE  23  48.798  16.129  -8.318
  231    HB   ILE  23           HB       ILE  23  47.982  15.177  -5.791
  232   HG12  ILE  23          HG12      ILE  23  46.993  17.709  -7.163
  233   HG13  ILE  23          HG11      ILE  23  46.549  16.064  -7.666
  234   HG21  ILE  23          HG21      ILE  23  48.611  18.135  -5.489
  235   HG22  ILE  23          HG22      ILE  23  49.666  16.867  -4.833
  236   HG23  ILE  23          HG23      ILE  23  48.001  17.024  -4.247
  237   HD11  ILE  23           HD1      ILE  23  44.763  16.774  -6.271
  238   HD12  ILE  23           HD2      ILE  23  45.865  17.485  -5.070
  239   HD13  ILE  23           HD3      ILE  23  45.747  15.717  -5.237
  240    H    ALA  24           HN       ALA  24  51.408  15.664  -6.348
  241    HA   ALA  24           HA       ALA  24  52.248  18.405  -6.936
  242    HB1  ALA  24           HB1      ALA  24  54.205  18.030  -5.722
  243    HB2  ALA  24           HB2      ALA  24  54.247  16.312  -6.149
  244    HB3  ALA  24           HB3      ALA  24  53.125  16.889  -4.897
  245    H    TRP  25           HN       TRP  25  51.421  15.422  -8.128
  246    HA   TRP  25           HA       TRP  25  51.770  14.534 -10.300
  247    HB2  TRP  25           HB2      TRP  25  50.997  16.835 -10.915
  248    HB3  TRP  25           HB1      TRP  25  52.702  17.324 -11.060
  249    HD1  TRP  25           HD1      TRP  25  54.130  16.245 -13.037
  250    HE1  TRP  25           HE1      TRP  25  53.456  15.151 -15.297
  251    HE3  TRP  25           HE3      TRP  25  49.175  15.390 -12.074
  252    HZ2  TRP  25           HZ2      TRP  25  51.075  14.061 -16.495
  253    HZ3  TRP  25           HZ3      TRP  25  47.720  14.323 -13.791
  254    HH2  TRP  25           HH2      TRP  25  48.666  13.659 -15.999
  Start of MODEL   10
    1    H1   ALA   1           HT1      ALA   1  45.181   6.639   9.253
    2    H2   ALA   1           HT2      ALA   1  45.740   5.726  10.572
    3    H3   ALA   1           HT3      ALA   1  45.899   5.127   8.990
    4    HA   ALA   1           HA       ALA   1  47.874   6.228  10.251
    5    HB1  ALA   1           HB1      ALA   1  47.075   6.383   7.335
    6    HB2  ALA   1           HB2      ALA   1  48.246   5.294   8.114
    7    HB3  ALA   1           HB3      ALA   1  48.646   7.017   7.885
    8    H    TRP   2           HN       TRP   2  47.815   8.416   7.778
    9    HA   TRP   2           HA       TRP   2  46.642  10.621   9.193
   10    HB2  TRP   2           HB2      TRP   2  49.131  10.248   9.928
   11    HB3  TRP   2           HB1      TRP   2  49.432  11.003   8.357
   12    HD1  TRP   2           HD1      TRP   2  46.614  12.905   8.929
   13    HE1  TRP   2           HE1      TRP   2  46.967  15.043  10.346
   14    HE3  TRP   2           HE3      TRP   2  51.082  11.695  11.135
   15    HZ2  TRP   2           HZ2      TRP   2  48.926  16.073  12.180
   16    HZ3  TRP   2           HZ3      TRP   2  52.171  13.279  12.716
   17    HH2  TRP   2           HH2      TRP   2  51.098  15.465  13.240
   18    H    LYS   3           HN       LYS   3  47.195   8.891   6.562
   19    HA   LYS   3           HA       LYS   3  47.379   9.292   4.322
   20    HB2  LYS   3           HB2      LYS   3  46.153  10.997   3.239
   21    HB3  LYS   3           HB1      LYS   3  45.179  10.380   4.567
   22    HG2  LYS   3           HG2      LYS   3  45.486  12.344   5.885
   23    HG3  LYS   3           HG1      LYS   3  46.855  12.901   4.889
   24    HD2  LYS   3           HD2      LYS   3  45.376  13.333   3.008
   25    HD3  LYS   3           HD1      LYS   3  43.998  12.613   3.876
   26    HE2  LYS   3           HE2      LYS   3  43.991  15.117   3.970
   27    HE3  LYS   3           HE1      LYS   3  44.104  14.371   5.582
   28    HZ1  LYS   3           HZ1      LYS   3  46.404  15.385   3.983
   29    HZ2  LYS   3           HZ2      LYS   3  46.490  14.706   5.539
   30    HZ3  LYS   3           HZ3      LYS   3  45.692  16.187   5.297
   31    H    GLU   4           HN       GLU   4  48.965  10.218   6.602
   32    HA   GLU   4           HA       GLU   4  51.126  11.408   5.173
   33    HB2  GLU   4           HB2      GLU   4  49.589  13.067   6.929
   34    HB3  GLU   4           HB1      GLU   4  51.060  12.649   7.830
   35    HG2  GLU   4           HG2      GLU   4  52.447  13.460   5.937
   36    HG3  GLU   4           HG1      GLU   4  50.970  13.878   5.035
   37    H    LYS   5           HN       LYS   5  49.555   9.636   7.921
   38    HA   LYS   5           HA       LYS   5  52.366   8.453   8.335
   39    HB2  LYS   5           HB2      LYS   5  49.651   8.065   9.649
   40    HB3  LYS   5           HB1      LYS   5  50.729   6.671   9.541
   41    HG2  LYS   5           HG2      LYS   5  52.515   8.009  10.660
   42    HG3  LYS   5           HG1      LYS   5  51.369   9.361  10.825
   43    HD2  LYS   5           HD2      LYS   5  49.851   7.917  12.149
   44    HD3  LYS   5           HD1      LYS   5  50.998   6.565  11.988
   45    HE2  LYS   5           HE2      LYS   5  51.364   7.631  14.148
   46    HE3  LYS   5           HE1      LYS   5  52.750   7.999  13.094
   47    HZ1  LYS   5           HZ1      LYS   5  50.953   9.994  12.580
   48    HZ2  LYS   5           HZ2      LYS   5  52.333  10.119  13.563
   49    HZ3  LYS   5           HZ3      LYS   5  50.821   9.772  14.257
   50    H    ILE   6           HN       ILE   6  50.003   9.208   6.306
   51    HA   ILE   6           HA       ILE   6  49.369   8.371   4.200
   52    HB   ILE   6           HB       ILE   6  51.293   6.035   4.587
   53   HG12  ILE   6          HG12      ILE   6  51.841   8.893   3.659
   54   HG13  ILE   6          HG11      ILE   6  52.531   8.087   5.083
   55   HG21  ILE   6          HG21      ILE   6  50.636   7.506   2.015
   56   HG22  ILE   6          HG22      ILE   6  49.596   6.189   2.596
   57   HG23  ILE   6          HG23      ILE   6  51.305   5.876   2.224
   58   HD11  ILE   6           HD1      ILE   6  53.055   7.480   2.153
   59   HD12  ILE   6           HD2      ILE   6  53.481   6.337   3.451
   60   HD13  ILE   6           HD3      ILE   6  54.225   7.953   3.407
   61    H    ARG   7           HN       ARG   7  47.498   7.583   3.724
   62    HA   ARG   7           HA       ARG   7  45.982   5.788   3.345
   63    HB2  ARG   7           HB2      ARG   7  47.849   4.170   4.149
   64    HB3  ARG   7           HB1      ARG   7  46.987   4.219   5.699
   65    HG2  ARG   7           HG2      ARG   7  44.861   3.672   4.299
   66    HG3  ARG   7           HG1      ARG   7  46.002   3.225   3.008
   67    HD2  ARG   7           HD2      ARG   7  45.386   1.240   4.342
   68    HD3  ARG   7           HD1      ARG   7  47.112   1.622   4.545
   69    HE   ARG   7           HE       ARG   7  46.660   2.010   6.825
   70   HH11  ARG   7          HH11      ARG   7  45.325   3.514   8.151
   71   HH12  ARG   7          HH12      ARG   7  43.617   3.229   8.096
   72   HH21  ARG   7          HH21      ARG   7  43.792   1.110   5.357
   73   HH22  ARG   7          HH22      ARG   7  42.750   1.867   6.514
   74    H    LYS   8           HN       LYS   8  45.499   8.092   4.637
   75    HA   LYS   8           HA       LYS   8  43.448   7.090   6.538
   76    HB2  LYS   8           HB2      LYS   8  45.272   8.351   7.784
   77    HB3  LYS   8           HB1      LYS   8  44.848   9.779   6.825
   78    HG2  LYS   8           HG2      LYS   8  42.552   8.412   8.223
   79    HG3  LYS   8           HG1      LYS   8  43.726   9.222   9.277
   80    HD2  LYS   8           HD2      LYS   8  42.632  10.692   6.852
   81    HD3  LYS   8           HD1      LYS   8  41.656  10.581   8.334
   82    HE2  LYS   8           HE2      LYS   8  43.525  11.565   9.638
   83    HE3  LYS   8           HE1      LYS   8  44.498  11.688   8.154
   84    HZ1  LYS   8           HZ1      LYS   8  41.918  12.829   7.786
   85    HZ2  LYS   8           HZ2      LYS   8  43.448  13.543   7.595
   86    HZ3  LYS   8           HZ3      LYS   8  42.693  13.538   9.118
   87    H    LYS   9           HN       LYS   9  44.392   8.696   3.743
   88    HA   LYS   9           HA       LYS   9  41.989  10.372   3.553
   89    HB2  LYS   9           HB2      LYS   9  44.027  10.288   1.896
   90    HB3  LYS   9           HB1      LYS   9  43.131   8.923   1.146
   91    HG2  LYS   9           HG2      LYS   9  42.001  11.737   1.633
   92    HG3  LYS   9           HG1      LYS   9  42.721  11.197   0.103
   93    HD2  LYS   9           HD2      LYS   9  40.891   9.177   0.484
   94    HD3  LYS   9           HD1      LYS   9  40.053  10.512   1.310
   95    HE2  LYS   9           HE2      LYS   9  40.403  11.920  -0.756
   96    HE3  LYS   9           HE1      LYS   9  41.041  10.472  -1.571
   97    HZ1  LYS   9           HZ1      LYS   9  38.522  11.071  -1.723
   98    HZ2  LYS   9           HZ2      LYS   9  38.438  10.321  -0.202
   99    HZ3  LYS   9           HZ3      LYS   9  39.003   9.454  -1.550
  100    H    LEU  10           HN       LEU  10  42.945   7.083   3.319
  101    HA   LEU  10           HA       LEU  10  40.527   5.756   3.829
  102    HB2  LEU  10           HB2      LEU  10  39.649   6.937   1.755
  103    HB3  LEU  10           HB1      LEU  10  41.063   6.296   0.863
  104    HG   LEU  10           HG       LEU  10  40.111   3.947   1.472
  105   HD11  LEU  10          HD11      LEU  10  38.668   4.439   3.325
  106   HD12  LEU  10          HD12      LEU  10  37.614   3.969   1.975
  107   HD13  LEU  10          HD13      LEU  10  37.797   5.685   2.402
  108   HD21  LEU  10          HD21      LEU  10  38.548   3.954  -0.357
  109   HD22  LEU  10          HD22      LEU  10  39.772   5.183  -0.748
  110   HD23  LEU  10          HD23      LEU  10  38.184   5.679  -0.121
  111    H    LYS  11           HN       LYS  11  42.741   6.222   1.338
  112    HA   LYS  11           HA       LYS  11  44.268   3.823   1.564
  113    HB2  LYS  11           HB2      LYS  11  42.995   4.999  -0.674
  114    HB3  LYS  11           HB1      LYS  11  44.160   3.655  -0.849
  115    HG2  LYS  11           HG2      LYS  11  42.105   2.831   1.039
  116    HG3  LYS  11           HG1      LYS  11  41.316   3.431  -0.436
  117    HD2  LYS  11           HD2      LYS  11  42.563   1.876  -1.815
  118    HD3  LYS  11           HD1      LYS  11  43.565   1.379  -0.430
  119    HE2  LYS  11           HE2      LYS  11  41.650   0.396   0.689
  120    HE3  LYS  11           HE1      LYS  11  40.536   1.056  -0.532
  121    HZ1  LYS  11           HZ1      LYS  11  41.247  -0.435  -2.110
  122    HZ2  LYS  11           HZ2      LYS  11  41.362  -1.387  -0.707
  123    HZ3  LYS  11           HZ3      LYS  11  42.757  -0.688  -1.379
  124    H    ASN  12           HN       ASN  12  43.728   6.500   1.567
  125    HA   ASN  12           HA       ASN  12  45.262   8.529   1.754
  126    HB2  ASN  12           HB2      ASN  12  47.344   6.975   2.053
  127    HB3  ASN  12           HB1      ASN  12  47.409   6.946   0.308
  128   HD21  ASN  12          HD21      ASN  12  49.571   8.075   0.668
  129   HD22  ASN  12          HD22      ASN  12  49.538   9.828   0.884
  130    H    GLU  13           HN       GLU  13  43.444   7.016   0.133
  131    HA   GLU  13           HA       GLU  13  42.583   6.921  -2.016
  132    HB2  GLU  13           HB2      GLU  13  43.201   9.508  -1.968
  133    HB3  GLU  13           HB1      GLU  13  44.620   9.009  -2.924
  134    HG2  GLU  13           HG2      GLU  13  43.016   7.852  -4.522
  135    HG3  GLU  13           HG1      GLU  13  41.678   8.620  -3.634
  136    H    ILE  14           HN       ILE  14  44.737   5.235  -0.741
  137    HA   ILE  14           HA       ILE  14  46.278   3.686  -1.616
  138    HB   ILE  14           HB       ILE  14  46.255   4.945  -4.403
  139   HG12  ILE  14          HG12      ILE  14  44.439   2.793  -3.207
  140   HG13  ILE  14          HG11      ILE  14  43.924   4.351  -3.886
  141   HG21  ILE  14          HG21      ILE  14  48.081   3.317  -3.630
  142   HG22  ILE  14          HG22      ILE  14  47.183   2.855  -5.092
  143   HG23  ILE  14          HG23      ILE  14  46.801   2.085  -3.533
  144   HD11  ILE  14           HD1      ILE  14  45.023   1.929  -5.343
  145   HD12  ILE  14           HD2      ILE  14  45.059   3.546  -6.087
  146   HD13  ILE  14           HD3      ILE  14  43.505   2.808  -5.633
  147    H    LYS  15           HN       LYS  15  46.554   7.113  -2.512
  148    HA   LYS  15           HA       LYS  15  48.989   7.439  -1.051
  149    HB2  LYS  15           HB2      LYS  15  49.342   6.722  -3.899
  150    HB3  LYS  15           HB1      LYS  15  50.004   8.340  -3.477
  151    HG2  LYS  15           HG2      LYS  15  51.475   7.409  -1.836
  152    HG3  LYS  15           HG1      LYS  15  50.634   5.844  -1.824
  153    HD2  LYS  15           HD2      LYS  15  51.403   5.342  -4.078
  154    HD3  LYS  15           HD1      LYS  15  52.098   6.973  -4.247
  155    HE2  LYS  15           HE2      LYS  15  53.711   6.517  -2.463
  156    HE3  LYS  15           HE1      LYS  15  52.970   4.927  -2.160
  157    HZ1  LYS  15           HZ1      LYS  15  55.051   5.180  -3.713
  158    HZ2  LYS  15           HZ2      LYS  15  53.878   5.556  -4.883
  159    HZ3  LYS  15           HZ3      LYS  15  53.827   4.063  -4.074
  160    H    LYS  16           HN       LYS  16  49.462   9.444  -0.815
  161    HA   LYS  16           HA       LYS  16  48.379  11.505  -0.740
  162    HB2  LYS  16           HB2      LYS  16  50.229  11.667  -2.852
  163    HB3  LYS  16           HB1      LYS  16  49.790  13.025  -1.823
  164    HG2  LYS  16           HG2      LYS  16  51.028  10.449  -0.770
  165    HG3  LYS  16           HG1      LYS  16  51.989  11.867  -1.242
  166    HD2  LYS  16           HD2      LYS  16  50.498  13.218   0.390
  167    HD3  LYS  16           HD1      LYS  16  49.945  11.642   1.004
  168    HE2  LYS  16           HE2      LYS  16  52.399  11.034   1.336
  169    HE3  LYS  16           HE1      LYS  16  52.784  12.737   0.989
  170    HZ1  LYS  16           HZ1      LYS  16  52.153  11.743   3.425
  171    HZ2  LYS  16           HZ2      LYS  16  50.666  12.387   2.915
  172    HZ3  LYS  16           HZ3      LYS  16  52.046  13.376   2.981
  173    H    LYS  17           HN       LYS  17  48.868  11.526  -3.451
  174    HA   LYS  17           HA       LYS  17  46.040  11.961  -4.403
  175    HB2  LYS  17           HB2      LYS  17  48.357  13.743  -5.280
  176    HB3  LYS  17           HB1      LYS  17  46.654  13.877  -5.743
  177    HG2  LYS  17           HG2      LYS  17  46.030  14.404  -3.413
  178    HG3  LYS  17           HG1      LYS  17  47.727  14.240  -2.912
  179    HD2  LYS  17           HD2      LYS  17  48.384  16.132  -4.285
  180    HD3  LYS  17           HD1      LYS  17  46.754  16.237  -4.989
  181    HE2  LYS  17           HE2      LYS  17  45.794  16.824  -2.832
  182    HE3  LYS  17           HE1      LYS  17  47.355  16.554  -2.021
  183    HZ1  LYS  17           HZ1      LYS  17  46.557  18.938  -2.840
  184    HZ2  LYS  17           HZ2      LYS  17  47.336  18.428  -4.262
  185    HZ3  LYS  17           HZ3      LYS  17  48.192  18.490  -2.796
  186    H    GLY  18           HN       GLY  18  48.615  10.387  -3.869
  187    HA2  GLY  18           HA1      GLY  18  48.914   8.348  -5.470
  188    HA3  GLY  18           HA2      GLY  18  48.929   9.495  -6.822
  189    H    ARG  19           HN       ARG  19  50.335  10.158  -3.726
  190    HA   ARG  19           HA       ARG  19  52.818   9.826  -3.274
  191    HB2  ARG  19           HB2      ARG  19  53.314   9.234  -5.758
  192    HB3  ARG  19           HB1      ARG  19  53.038  11.017  -6.159
  193    HG2  ARG  19           HG2      ARG  19  55.482  10.280  -5.854
  194    HG3  ARG  19           HG1      ARG  19  54.981  11.570  -4.744
  195    HD2  ARG  19           HD2      ARG  19  55.095  10.158  -2.871
  196    HD3  ARG  19           HD1      ARG  19  54.809   8.687  -3.835
  197    HE   ARG  19           HE       ARG  19  57.306   9.874  -4.612
  198   HH11  ARG  19          HH11      ARG  19  58.979   9.844  -2.839
  199   HH12  ARG  19          HH12      ARG  19  59.009   8.385  -1.907
  200   HH21  ARG  19          HH21      ARG  19  55.939   7.267  -3.067
  201   HH22  ARG  19          HH22      ARG  19  57.287   6.926  -2.035
  202    H    LYS  20           HN       LYS  20  51.046  11.799  -5.266
  203    HA   LYS  20           HA       LYS  20  50.872  13.840  -5.813
  204    HB2  LYS  20           HB2      LYS  20  50.797  15.606  -4.575
  205    HB3  LYS  20           HB1      LYS  20  49.934  14.322  -3.744
  206    HG2  LYS  20           HG2      LYS  20  51.967  14.031  -2.216
  207    HG3  LYS  20           HG1      LYS  20  52.633  15.506  -2.948
  208    HD2  LYS  20           HD2      LYS  20  50.639  16.780  -2.234
  209    HD3  LYS  20           HD1      LYS  20  49.988  15.320  -1.457
  210    HE2  LYS  20           HE2      LYS  20  51.093  16.619   0.260
  211    HE3  LYS  20           HE1      LYS  20  52.122  15.208  -0.085
  212    HZ1  LYS  20           HZ1      LYS  20  52.482  17.885  -1.335
  213    HZ2  LYS  20           HZ2      LYS  20  53.520  16.545  -1.462
  214    HZ3  LYS  20           HZ3      LYS  20  53.342  17.348   0.025
  215    H    ALA  21           HN       ALA  21  52.011  13.444  -6.863
  216    HA   ALA  21           HA       ALA  21  54.049  14.939  -7.660
  217    HB1  ALA  21           HB1      ALA  21  55.455  13.514  -5.968
  218    HB2  ALA  21           HB2      ALA  21  56.036  13.583  -7.648
  219    HB3  ALA  21           HB3      ALA  21  55.117  12.173  -7.084
  220    H    VAL  22           HN       VAL  22  51.673  13.197  -7.109
  221    HA   VAL  22           HA       VAL  22  51.490  12.556 -10.067
  222    HB   VAL  22           HB       VAL  22  50.234  11.111  -7.717
  223   HG11  VAL  22          HG11      VAL  22  48.873   9.884  -9.579
  224   HG12  VAL  22          HG12      VAL  22  49.233  11.317 -10.573
  225   HG13  VAL  22          HG13      VAL  22  48.313  11.490  -9.058
  226   HG21  VAL  22          HG21      VAL  22  51.024   9.090  -8.946
  227   HG22  VAL  22          HG22      VAL  22  52.365  10.214  -8.611
  228   HG23  VAL  22          HG23      VAL  22  51.648  10.143 -10.238
  229    H    ILE  23           HN       ILE  23  51.341  14.693  -7.837
  230    HA   ILE  23           HA       ILE  23  49.424  16.063  -9.426
  231    HB   ILE  23           HB       ILE  23  48.388  15.617  -6.592
  232   HG12  ILE  23          HG12      ILE  23  47.327  15.093  -9.405
  233   HG13  ILE  23          HG11      ILE  23  47.403  13.979  -8.027
  234   HG21  ILE  23          HG21      ILE  23  48.444  18.078  -7.169
  235   HG22  ILE  23          HG22      ILE  23  46.798  17.480  -6.993
  236   HG23  ILE  23          HG23      ILE  23  47.477  17.725  -8.615
  237   HD11  ILE  23           HD1      ILE  23  45.096  14.539  -8.313
  238   HD12  ILE  23           HD2      ILE  23  45.457  16.266  -8.520
  239   HD13  ILE  23           HD3      ILE  23  45.622  15.510  -6.924
  240    H    ALA  24           HN       ALA  24  51.527  15.599  -6.921
  241    HA   ALA  24           HA       ALA  24  52.204  18.437  -7.085
  242    HB1  ALA  24           HB1      ALA  24  52.789  16.779  -5.034
  243    HB2  ALA  24           HB2      ALA  24  53.853  18.126  -5.479
  244    HB3  ALA  24           HB3      ALA  24  54.219  16.490  -6.046
  245    H    TRP  25           HN       TRP  25  51.970  15.515  -8.642
  246    HA   TRP  25           HA       TRP  25  52.800  14.925 -10.784
  247    HB2  TRP  25           HB2      TRP  25  52.100  17.325 -11.262
  248    HB3  TRP  25           HB1      TRP  25  53.812  17.772 -11.096
  249    HD1  TRP  25           HD1      TRP  25  55.342  17.370 -13.113
  250    HE1  TRP  25           HE1      TRP  25  55.081  16.297 -15.467
  251    HE3  TRP  25           HE3      TRP  25  50.706  15.278 -12.536
  252    HZ2  TRP  25           HZ2      TRP  25  53.109  14.745 -16.879
  253    HZ3  TRP  25           HZ3      TRP  25  49.654  14.005 -14.400
  254    HH2  TRP  25           HH2      TRP  25  50.851  13.736 -16.568