*HEADER    ANTIMICROBIAL PROTEIN                   11-MAR-19   6O8P              
*TITLE     SYN-SAFENCIN 8                                                        
*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 6O8P    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    5 LYS  HN      A    4 GLU   HA     A    0.000   5.000 100.0 1.0 1.0
   2  1    5 LYS  HN      A    2 GLY   HA1    A    0.000   5.000 100.0 1.0 1.0
   2  1    5 LYS  HN      A    2 GLY   HA2    A    0.000   5.000 100.0 1.0 1.0
   3  1    5 LYS  HN      A    4 GLU   HB1    A    0.000   5.000 100.0 1.0 1.0
   3  1    5 LYS  HN      A    4 GLU   HB2    A    0.000   5.000 100.0 1.0 1.0
   4  1    2 GLY  HN      A    1 ALA   HA     A    0.000   2.700 100.0 1.0 1.0
   5  1    2 GLY  HN      A    1 ALA   HB1    A    0.000   2.700 100.0 1.0 1.0
   5  1    2 GLY  HN      A    1 ALA   HB2    A    0.000   2.700 100.0 1.0 1.0
   5  1    2 GLY  HN      A    1 ALA   HB3    A    0.000   2.700 100.0 1.0 1.0
   6  1    3 LYS  HN      A    2 GLY   HA1    A    0.000   3.300 100.0 1.0 1.0
   6  2    3 LYS  HN      A    2 GLY   HA2    A    0.000   3.300 100.0 1.0 1.0
   7  1    3 LYS  HN      A    1 ALA   HB1    A    0.000   3.300 100.0 1.0 1.0
   7  1    3 LYS  HN      A    1 ALA   HB2    A    0.000   3.300 100.0 1.0 1.0
   7  1    3 LYS  HN      A    1 ALA   HB3    A    0.000   3.300 100.0 1.0 1.0
   8  1   20 LYS  HN      A   18 GLY   HA1    A    0.000   5.000 100.0 1.0 1.0
   8  2   20 LYS  HN      A   18 GLY   HA2    A    0.000   5.000 100.0 1.0 1.0
   9  1   20 LYS  HN      A   17 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
   9  1   20 LYS  HN      A   17 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
  10  1    9 LYS  HN      A    5 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
  11  1    9 LYS  HN      A    5 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  11  1    9 LYS  HN      A    5 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0
  12  1   18 GLY  HN      A   16 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
  13  1   18 GLY  HN      A   16 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  13  1   18 GLY  HN      A   16 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  14  1   18 GLY  HN      A   15 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  14  1   18 GLY  HN      A   15 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0
  15  1    7 ARG  HN      A    4 GLU   HA     A    0.000   3.300 100.0 1.0 1.0
  16  1    7 ARG  HN      A    6 ILE   HA     A    0.000   3.300 100.0 1.0 1.0
  17  1    7 ARG  HN      A    4 GLU   HB1    A    0.000   5.000 100.0 1.0 1.0   
  17  1    7 ARG  HN      A    4 GLU   HB2    A    0.000   5.000 100.0 1.0 1.0   
  18  1    6 ILE  HN      A    4 GLU   HA     A    0.000   3.300 100.0 1.0 1.0
  19  1    6 ILE  HN      A    4 GLU   HB1    A    0.000   5.000 100.0 1.0 1.0
  19  1    6 ILE  HN      A    4 GLU   HB2    A    0.000   5.000 100.0 1.0 1.0
  20  1    8 LYS  HN      A    4 GLU   HA     A    0.000   3.300 100.0 1.0 1.0
  21  1    8 LYS  HN      A    7 ARG   HA     A    0.000   5.000 100.0 1.0 1.0
  22  1    8 LYS  HN      A    6 ILE   HA     A    0.000   5.000 100.0 1.0 1.0
  23  1    8 LYS  HN      A    4 GLU   HB1    A    0.000   5.000 100.0 1.0 1.0
  23  1    8 LYS  HN      A    4 GLU   HB2    A    0.000   5.000 100.0 1.0 1.0
  24  1    8 LYS  HN      A    7 ARG   HB1    A    0.000   5.000 100.0 1.0 1.0
  24  1    8 LYS  HN      A    7 ARG   HB2    A    0.000   5.000 100.0 1.0 1.0
  25  1    8 LYS  HN      A    6 ILE   HB1    A    0.000   3.300 100.0 1.0 1.0
  26  1   19 ARG  HN      A   14 ILE   HA     A    0.000   5.000 100.0 1.0 1.0
  27  1   19 ARG  HN      A   18 GLY   HA1    A    0.000   3.300 100.0 1.0 1.0
  27  1   19 ARG  HN      A   18 GLY   HA2    A    0.000   3.300 100.0 1.0 1.0
  28  1   19 ARG  HN      A   17 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  28  1   19 ARG  HN      A   17 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0
  29  1   19 ARG  HN      A   16 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0
  29  1   19 ARG  HN      A   16 LYS   HB2    A    0.000   2.700 100.0 1.0 1.0
  30  1   13 GLU  HN      A   11 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0
  30  2   13 GLU  HN      A   11 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0
  31  1   13 GLU  HN      A   11 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
  32  1   16 LYS  HN      A   15 LYS   HA     A    0.000   2.700 100.0 1.0 1.0 
  33  1   16 LYS  HN      A   15 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0 
  33  2   16 LYS  HN      A   15 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0 
  34  1   11 LYS  HN      A    7 ARG   HA     A    0.000   3.300 100.0 1.0 1.0
  35  1   11 LYS  HN      A    6 ILE   HA     A    0.000   5.000 100.0 1.0 1.0
  36  1   11 LYS  HN      A    7 ARG   HB1    A    0.000   2.700 100.0 1.0 1.0
  36  1   11 LYS  HN      A    7 ARG   HB2    A    0.000   2.700 100.0 1.0 1.0
  37  1   11 LYS  HN      A    9 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0
  37  1   11 LYS  HN      A    9 LYS   HB2    A    0.000   2.700 100.0 1.0 1.0
  38  1   12 ASN  HN      A   10 LEU   HA     A    0.000   5.000 100.0 1.0 1.0
  39  1   12 ASN  HN      A   11 LYS   HB1    A    0.000   3.300 100.0 1.0 1.0
  39  1   12 ASN  HN      A   11 LYS   HB2    A    0.000   3.300 100.0 1.0 1.0
  40  1   12 ASN  HN      A   10 LEU   HB1    A    0.000   5.000 100.0 1.0 1.0
  40  1   12 ASN  HN      A   10 LEU   HB2    A    0.000   5.000 100.0 1.0 1.0
  41  1   14 ILE  HN      A   12 ASN   HA     A    0.000   5.000 100.0 1.0 1.0
  42  1   14 ILE  HN      A   14 ILE   HA1    A    0.000   3.300 100.0 1.0 1.0
  43  1   14 ILE  HN      A   10 LEU   HA     A    0.000   2.700 100.0 1.0 1.0
  44  1   14 ILE  HN      A   12 ASN   HB1    A    0.000   5.000 100.0 1.0 1.0
  44  2   14 ILE  HN      A   12 ASN   HB2    A    0.000   5.000 100.0 1.0 1.0
  45  1   14 ILE  HN      A   11 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
  45  1   14 ILE  HN      A   11 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
  46  1   14 ILE  HN      A   10 LEU   HB1    A    0.000   5.000 100.0 1.0 1.0
  46  1   14 ILE  HN      A   10 LEU   HB2    A    0.000   5.000 100.0 1.0 1.0
  47  1   24 ALA  HN      A   23 ILE   HA     A    0.000   2.700 100.0 1.0 1.0
  48  1   24 ALA  HN      A   22 VAL   HA     A    0.000   3.300 100.0 1.0 1.0
  49  1   24 ALA  HN      A   23 ILE   HB1    A    0.000   5.000 100.0 1.0 1.0
  50  1   23 ILE  HN      A   21 ALA   HA     A    0.000   2.700 100.0 1.0 1.0
  51  1   23 ILE  HN      A   22 VAL   HA     A    0.000   2.700 100.0 1.0 1.0
  52  1   23 ILE  HN      A   21 ALA   HB1    A    0.000   2.700 100.0 1.0 1.0
  52  1   23 ILE  HN      A   21 ALA   HB2    A    0.000   2.700 100.0 1.0 1.0
  52  1   23 ILE  HN      A   21 ALA   HB3    A    0.000   2.700 100.0 1.0 1.0
  53  1   21 ALA  HN      A   17 LYS   HA     A    0.000   2.700 100.0 1.0 1.0
  54  1   21 ALA  HN      A   18 GLY   HA1    A    0.000   5.000 100.0 1.0 1.0
  54  1   21 ALA  HN      A   18 GLY   HA2    A    0.000   5.000 100.0 1.0 1.0
  55  1   21 ALA  HN      A   19 ARG   HB1    A    0.000   3.300 100.0 1.0 1.0
  55  1   21 ALA  HN      A   19 ARG   HB2    A    0.000   3.300 100.0 1.0 1.0
  56  1   21 ALA  HN      A   17 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
  56  2   21 ALA  HN      A   17 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
  57  1   22 VAL  HN      A   21 ALA   HB1    A    0.000   3.300 100.0 1.0 1.0
  57  1   22 VAL  HN      A   21 ALA   HB2    A    0.000   3.300 100.0 1.0 1.0
  58  1   22 VAL  HN      A   18 GLY   HA1    A    0.000   3.300 100.0 1.0 1.0
  58  1   22 VAL  HN      A   18 GLY   HA2    A    0.000   3.300 100.0 1.0 1.0
  59  1   22 VAL  HN      A   19 ARG   HB1    A    0.000   2.700 100.0 1.0 1.0
  59  1   22 VAL  HN      A   19 ARG   HB2    A    0.000   2.700 100.0 1.0 1.0
  60  1   22 VAL  HN      A   20 LYS   HB1    A    0.000   5.000 100.0 1.0 1.0
  60  1   22 VAL  HN      A   20 LYS   HB2    A    0.000   5.000 100.0 1.0 1.0
  61  1   22 VAL  HN      A   21 ALA   HB1    A    0.000   3.300 100.0 1.0 1.0
  61  1   22 VAL  HN      A   21 ALA   HB2    A    0.000   3.300 100.0 1.0 1.0
  61  1   22 VAL  HN      A   21 ALA   HB3    A    0.000   3.300 100.0 1.0 1.0
  62  1   17 LYS  HN      A   16 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
  63  1   17 LYS  HN      A   16 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0
  63  1   17 LYS  HN      A   16 LYS   HB2    A    0.000   2.700 100.0 1.0 1.0
  64  1   15 LYS  HN      A   14 ILE   HA     A    0.000   5.000 100.0 1.0 1.0
  65  1   15 LYS  HN      A   14 ILE   HB1    A    0.000   3.300 100.0 1.0 1.0
  66  1   10 LEU  HN      A    8 LYS   HA     A    0.000   2.700 100.0 1.0 1.0
  67  1   10 LEU  HN      A    6 ILE   HA     A    0.000   5.000 100.0 1.0 1.0
  68  1   10 LEU  HN      A    7 ARG   HB1    A    0.000   3.300 100.0 1.0 1.0
  68  1   10 LEU  HN      A    7 ARG   HB2    A    0.000   3.300 100.0 1.0 1.0
  69  1   10 LEU  HN      A    6 ILE   HB1    A    0.000   5.000 100.0 1.0 1.0
  70  1   10 LEU  HN      A    8 LYS   HB1    A    0.000   2.700 100.0 1.0 1.0
  70  1   10 LEU  HN      A    8 LYS   HB2    A    0.000   2.700 100.0 1.0 1.0
  71  1   25 TRP  HN      A   21 ALA   HA     A    0.000   2.700 100.0 1.0 1.0
  72  1   25 TRP  HN      A   22 VAL   HB1    A    0.000   3.300 100.0 1.0 1.0  
  72  1   25 TRP  HN      A   22 VAL   HB2    A    0.000   3.300 100.0 1.0 1.0
  73  1    4 GLU  HN      A    3 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  74  1    5 LYS  HN      A    3 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  75  1    2 GLY  HN      A    3 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  76  1    5 LYS  HN      A    6 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
  77  1    4 GLU  HN      A    6 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
  78  1    3 LYS  HN      A    7 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  79  1   20 LYS  HN      A   16 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  80  1    9 LYS  HN      A   13 GLU   HN     A    0.000   5.000 100.0 1.0 1.0
  81  1    9 LYS  HN      A   11 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  82  1   20 LYS  HN      A   24 ALA   HN     A    0.000   5.000 100.0 1.0 1.0
  83  1    9 LYS  HN      A   10 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  84  1    9 LYS  HN      A   12 ASN   HN     A    0.000   5.000 100.0 1.0 1.0
  85  1   18 GLY  HN      A   13 GLU   HN     A    0.000   5.000 100.0 1.0 1.0 
  86  1   18 GLY  HN      A   19 ARG   HN     A    0.000   5.000 100.0 1.0 1.0
  87  1   18 GLY  HN      A   14 ILE   HN     A    0.000   5.000 100.0 1.0 1.0
  88  1    7 ARG  HN      A   12 ASN   HN     A    0.000   5.000 100.0 1.0 1.0
  89  1   18 GLY  HN      A   17 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  90  1    7 ARG  HN      A    8 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  91  1    7 ARG  HN      A   13 GLU   HN     A    0.000   5.000 100.0 1.0 1.0
  92  1    8 LYS  HN      A   11 LYS   HN     A    0.000   5.000 100.0 1.0 1.0 
  93  1   19 ARG  HN      A   16 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  94  1   13 GLU  HN      A   11 LYS   HN     A    0.000   5.000 100.0 1.0 1.0
  95  1   13 GLU  HN      A   10 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  96  1    8 LYS  HN      A   10 LEU   HN     A    0.000   5.000 100.0 1.0 1.0
  97  1   16 LYS  HN      A   15 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
  98  1   16 LYS  HN      A   21 ALA   HA     A    0.000   5.000 100.0 1.0 1.0
  99  1   11 LYS  HN      A   15 LYS   HA     A    0.000   5.000 100.0 1.0 1.0
 100  1   24 ALA  HN      A   25 TRP   HA     A    0.000   5.000 100.0 1.0 1.0
 101  1   23 ILE  HN      A   25 TRP   HA     A    0.000   5.000 100.0 1.0 1.0
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           HT1      ALA   1  48.109  18.905  -7.139
    2    H2   ALA   1           HT2      ALA   1  47.503  20.428  -7.588
    3    H3   ALA   1           HT3      ALA   1  47.781  19.238  -8.769
    4    HA   ALA   1           HA       ALA   1  45.412  19.729  -7.815
    5    HB1  ALA   1           HB1      ALA   1  46.287  16.859  -8.238
    6    HB2  ALA   1           HB2      ALA   1  46.254  18.037  -9.574
    7    HB3  ALA   1           HB3      ALA   1  44.756  17.640  -8.697
    8    H    GLY   2           HN       GLY   2  44.184  17.542  -6.808
    9    HA2  GLY   2           HA1      GLY   2  45.339  16.785  -4.227
   10    HA3  GLY   2           HA2      GLY   2  43.994  17.938  -4.103
   11    H    LYS   3           HN       LYS   3  44.953  14.833  -5.677
   12    HA   LYS   3           HA       LYS   3  42.697  13.317  -4.734
   13    HB2  LYS   3           HB2      LYS   3  41.356  14.907  -6.235
   14    HB3  LYS   3           HB1      LYS   3  42.303  14.296  -7.607
   15    HG2  LYS   3           HG2      LYS   3  41.555  11.941  -6.889
   16    HG3  LYS   3           HG1      LYS   3  40.400  12.750  -5.803
   17    HD2  LYS   3           HD2      LYS   3  40.572  13.195  -8.817
   18    HD3  LYS   3           HD1      LYS   3  39.378  12.155  -8.007
   19    HE2  LYS   3           HE2      LYS   3  38.774  14.272  -6.612
   20    HE3  LYS   3           HE1      LYS   3  39.666  15.174  -7.861
   21    HZ1  LYS   3           HZ1      LYS   3  37.086  14.566  -8.049
   22    HZ2  LYS   3           HZ2      LYS   3  37.748  13.206  -8.823
   23    HZ3  LYS   3           HZ3      LYS   3  38.093  14.766  -9.398
   24    H    GLU   4           HN       GLU   4  44.817  14.374  -7.133
   25    HA   GLU   4           HA       GLU   4  46.327  11.891  -7.183
   26    HB2  GLU   4           HB2      GLU   4  45.320  13.057  -9.819
   27    HB3  GLU   4           HB1      GLU   4  46.319  11.605  -9.578
   28    HG2  GLU   4           HG2      GLU   4  44.385  10.604  -8.269
   29    HG3  GLU   4           HG1      GLU   4  43.399  11.991  -8.796
   30    H    LYS   5           HN       LYS   5  46.904  13.866  -5.888
   31    HA   LYS   5           HA       LYS   5  48.223  16.066  -7.140
   32    HB2  LYS   5           HB2      LYS   5  47.605  15.999  -4.756
   33    HB3  LYS   5           HB1      LYS   5  48.668  14.579  -4.526
   34    HG2  LYS   5           HG2      LYS   5  50.607  15.874  -4.506
   35    HG3  LYS   5           HG1      LYS   5  49.996  17.018  -5.722
   36    HD2  LYS   5           HD2      LYS   5  48.517  18.021  -3.949
   37    HD3  LYS   5           HD1      LYS   5  49.282  16.948  -2.761
   38    HE2  LYS   5           HE2      LYS   5  51.477  17.924  -3.223
   39    HE3  LYS   5           HE1      LYS   5  50.784  18.934  -4.515
   40    HZ1  LYS   5           HZ1      LYS   5  50.996  19.583  -1.848
   41    HZ2  LYS   5           HZ2      LYS   5  49.348  19.235  -2.070
   42    HZ3  LYS   5           HZ3      LYS   5  50.106  20.417  -3.027
   43    H    ILE   6           HN       ILE   6  48.607  13.097  -7.904
   44    HA   ILE   6           HA       ILE   6  50.256  11.820  -8.724
   45    HB   ILE   6           HB       ILE   6  52.334  13.994  -8.209
   46   HG12  ILE   6          HG12      ILE   6  50.297  13.868 -10.486
   47   HG13  ILE   6          HG11      ILE   6  50.552  15.208  -9.349
   48   HG21  ILE   6          HG21      ILE   6  52.864  11.598  -9.066
   49   HG22  ILE   6          HG22      ILE   6  53.519  12.954 -10.005
   50   HG23  ILE   6          HG23      ILE   6  52.071  12.094 -10.577
   51   HD11  ILE   6           HD1      ILE   6  51.667  15.896 -11.331
   52   HD12  ILE   6           HD2      ILE   6  52.366  14.282 -11.599
   53   HD13  ILE   6           HD3      ILE   6  52.970  15.306 -10.273
   54    H    ARG   7           HN       ARG   7  49.320  12.374  -5.866
   55    HA   ARG   7           HA       ARG   7  51.327  10.672  -4.802
   56    HB2  ARG   7           HB2      ARG   7  50.626  13.124  -3.534
   57    HB3  ARG   7           HB1      ARG   7  51.643  11.820  -2.897
   58    HG2  ARG   7           HG2      ARG   7  53.273  12.309  -4.830
   59    HG3  ARG   7           HG1      ARG   7  52.292  13.745  -5.190
   60    HD2  ARG   7           HD2      ARG   7  52.689  14.530  -2.831
   61    HD3  ARG   7           HD1      ARG   7  53.807  13.161  -2.614
   62    HE   ARG   7           HE       ARG   7  54.712  14.459  -4.915
   63   HH11  ARG   7          HH11      ARG   7  54.288  17.077  -4.343
   64   HH12  ARG   7          HH12      ARG   7  55.386  17.530  -3.083
   65   HH21  ARG   7          HH21      ARG   7  56.037  14.264  -2.114
   66   HH22  ARG   7          HH22      ARG   7  56.377  15.937  -1.821
   67    H    LYS   8           HN       LYS   8  48.549  12.318  -4.776
   68    HA   LYS   8           HA       LYS   8  47.346  11.086  -2.335
   69    HB2  LYS   8           HB2      LYS   8  47.190  13.375  -3.111
   70    HB3  LYS   8           HB1      LYS   8  46.697  12.630  -4.634
   71    HG2  LYS   8           HG2      LYS   8  44.516  12.171  -3.863
   72    HG3  LYS   8           HG1      LYS   8  45.073  11.854  -2.214
   73    HD2  LYS   8           HD2      LYS   8  45.089  14.688  -3.293
   74    HD3  LYS   8           HD1      LYS   8  43.588  13.981  -2.664
   75    HE2  LYS   8           HE2      LYS   8  44.487  13.709  -0.486
   76    HE3  LYS   8           HE1      LYS   8  46.163  13.894  -1.052
   77    HZ1  LYS   8           HZ1      LYS   8  44.628  15.868  -0.004
   78    HZ2  LYS   8           HZ2      LYS   8  44.478  16.148  -1.674
   79    HZ3  LYS   8           HZ3      LYS   8  46.015  16.105  -0.951
   80    H    LYS   9           HN       LYS   9  48.217  11.359  -5.440
   81    HA   LYS   9           HA       LYS   9  46.534   9.538  -7.000
   82    HB2  LYS   9           HB2      LYS   9  48.483  10.925  -7.886
   83    HB3  LYS   9           HB1      LYS   9  49.596   9.980  -6.798
   84    HG2  LYS   9           HG2      LYS   9  48.999   7.918  -7.996
   85    HG3  LYS   9           HG1      LYS   9  47.793   8.769  -8.991
   86    HD2  LYS   9           HD2      LYS   9  49.499  10.054 -10.110
   87    HD3  LYS   9           HD1      LYS   9  50.748   9.506  -8.967
   88    HE2  LYS   9           HE2      LYS   9  50.543   7.206  -9.781
   89    HE3  LYS   9           HE1      LYS   9  49.193   7.673 -10.844
   90    HZ1  LYS   9           HZ1      LYS   9  50.597   8.471 -12.359
   91    HZ2  LYS   9           HZ2      LYS   9  51.834   7.665 -11.518
   92    HZ3  LYS   9           HZ3      LYS   9  51.525   9.307 -11.211
   93    H    LEU  10           HN       LEU  10  48.411  10.296  -4.322
   94    HA   LEU  10           HA       LEU  10  48.611   8.585  -2.378
   95    HB2  LEU  10           HB2      LEU  10  46.897   7.073  -3.784
   96    HB3  LEU  10           HB1      LEU  10  48.348   6.133  -4.185
   97    HG   LEU  10           HG       LEU  10  48.627   6.417  -1.446
   98   HD11  LEU  10          HD11      LEU  10  46.353   7.477  -1.296
   99   HD12  LEU  10          HD12      LEU  10  46.447   5.942  -0.404
  100   HD13  LEU  10          HD13      LEU  10  45.654   6.003  -1.993
  101   HD21  LEU  10          HD21      LEU  10  47.330   4.261  -3.148
  102   HD22  LEU  10          HD22      LEU  10  47.526   4.039  -1.395
  103   HD23  LEU  10          HD23      LEU  10  48.956   4.278  -2.427
  104    H    LYS  11           HN       LYS  11  50.737   9.575  -4.336
  105    HA   LYS  11           HA       LYS  11  52.731   7.477  -4.753
  106    HB2  LYS  11           HB2      LYS  11  53.047   9.892  -5.470
  107    HB3  LYS  11           HB1      LYS  11  53.154  10.342  -3.684
  108    HG2  LYS  11           HG2      LYS  11  55.233   9.035  -3.548
  109    HG3  LYS  11           HG1      LYS  11  54.990   8.310  -5.146
  110    HD2  LYS  11           HD2      LYS  11  55.244  10.527  -6.201
  111    HD3  LYS  11           HD1      LYS  11  55.459  11.274  -4.599
  112    HE2  LYS  11           HE2      LYS  11  57.624  10.786  -5.829
  113    HE3  LYS  11           HE1      LYS  11  57.507  10.041  -4.217
  114    HZ1  LYS  11           HZ1      LYS  11  58.267   8.616  -6.210
  115    HZ2  LYS  11           HZ2      LYS  11  56.618   8.562  -6.615
  116    HZ3  LYS  11           HZ3      LYS  11  57.149   7.960  -5.117
  117    H    ASN  12           HN       ASN  12  51.894   9.821  -2.401
  118    HA   ASN  12           HA       ASN  12  52.445   8.173  -0.090
  119    HB2  ASN  12           HB2      ASN  12  54.872   9.178  -1.339
  120    HB3  ASN  12           HB1      ASN  12  54.700   9.902   0.253
  121   HD21  ASN  12          HD21      ASN  12  55.537   6.995  -1.494
  122   HD22  ASN  12          HD22      ASN  12  55.803   5.981  -0.073
  123    H    GLU  13           HN       GLU  13  51.390  10.690  -1.630
  124    HA   GLU  13           HA       GLU  13  51.627  12.739   0.519
  125    HB2  GLU  13           HB2      GLU  13  50.755  13.714  -1.463
  126    HB3  GLU  13           HB1      GLU  13  49.475  12.484  -1.616
  127    HG2  GLU  13           HG2      GLU  13  48.193  13.415   0.130
  128    HG3  GLU  13           HG1      GLU  13  49.593  14.233   0.859
  129    H    ILE  14           HN       ILE  14  49.736   9.999  -0.356
  130    HA   ILE  14           HA       ILE  14  49.169   9.601   2.449
  131    HB   ILE  14           HB       ILE  14  46.701   9.037   1.997
  132   HG12  ILE  14          HG12      ILE  14  46.750  11.163  -0.155
  133   HG13  ILE  14          HG11      ILE  14  47.220   9.514  -0.616
  134   HG21  ILE  14          HG21      ILE  14  45.955  11.323   2.504
  135   HG22  ILE  14          HG22      ILE  14  47.486  11.991   1.893
  136   HG23  ILE  14          HG23      ILE  14  47.476  10.996   3.361
  137   HD11  ILE  14           HD1      ILE  14  44.802   9.857  -0.965
  138   HD12  ILE  14           HD2      ILE  14  44.610  10.323   0.742
  139   HD13  ILE  14           HD3      ILE  14  45.076   8.658   0.320
  140    H    LYS  15           HN       LYS  15  50.968   8.317   1.292
  141    HA   LYS  15           HA       LYS  15  50.769   6.439  -0.439
  142    HB2  LYS  15           HB2      LYS  15  52.790   6.445   0.952
  143    HB3  LYS  15           HB1      LYS  15  51.793   5.748   2.226
  144    HG2  LYS  15           HG2      LYS  15  51.660   3.649   1.158
  145    HG3  LYS  15           HG1      LYS  15  52.046   4.322  -0.442
  146    HD2  LYS  15           HD2      LYS  15  53.927   2.993   0.579
  147    HD3  LYS  15           HD1      LYS  15  54.367   4.674   0.199
  148    HE2  LYS  15           HE2      LYS  15  54.230   5.337   2.491
  149    HE3  LYS  15           HE1      LYS  15  53.378   3.844   2.954
  150    HZ1  LYS  15           HZ1      LYS  15  56.108   3.804   1.795
  151    HZ2  LYS  15           HZ2      LYS  15  55.306   2.578   2.654
  152    HZ3  LYS  15           HZ3      LYS  15  55.845   3.971   3.462
  153    H    LYS  16           HN       LYS  16  49.607   6.505   2.065
  154    HA   LYS  16           HA       LYS  16  47.354   4.492   1.658
  155    HB2  LYS  16           HB2      LYS  16  49.266   3.113   2.290
  156    HB3  LYS  16           HB1      LYS  16  49.765   4.372   3.486
  157    HG2  LYS  16           HG2      LYS  16  48.080   3.724   5.025
  158    HG3  LYS  16           HG1      LYS  16  47.048   2.994   3.773
  159    HD2  LYS  16           HD2      LYS  16  48.038   1.223   5.141
  160    HD3  LYS  16           HD1      LYS  16  48.743   1.159   3.509
  161    HE2  LYS  16           HE2      LYS  16  50.735   2.365   4.284
  162    HE3  LYS  16           HE1      LYS  16  50.018   2.556   5.902
  163    HZ1  LYS  16           HZ1      LYS  16  49.843  -0.005   5.800
  164    HZ2  LYS  16           HZ2      LYS  16  51.349   0.705   6.144
  165    HZ3  LYS  16           HZ3      LYS  16  51.022   0.112   4.586
  166    H    LYS  17           HN       LYS  17  49.072   6.927   2.705
  167    HA   LYS  17           HA       LYS  17  48.044   8.847   3.964
  168    HB2  LYS  17           HB2      LYS  17  47.617   6.579   5.857
  169    HB3  LYS  17           HB1      LYS  17  47.625   8.275   6.308
  170    HG2  LYS  17           HG2      LYS  17  45.647   8.821   5.269
  171    HG3  LYS  17           HG1      LYS  17  45.747   7.490   4.111
  172    HD2  LYS  17           HD2      LYS  17  45.362   5.882   6.037
  173    HD3  LYS  17           HD1      LYS  17  45.113   7.295   7.089
  174    HE2  LYS  17           HE2      LYS  17  43.510   6.682   4.568
  175    HE3  LYS  17           HE1      LYS  17  42.958   6.384   6.233
  176    HZ1  LYS  17           HZ1      LYS  17  42.167   8.511   5.296
  177    HZ2  LYS  17           HZ2      LYS  17  43.776   9.045   5.177
  178    HZ3  LYS  17           HZ3      LYS  17  43.097   8.718   6.700
  179    H    GLY  18           HN       GLY  18  50.261   7.904   2.406
  180    HA2  GLY  18           HA1      GLY  18  52.597   8.040   2.735
  181    HA3  GLY  18           HA2      GLY  18  52.212   8.929   4.276
  182    H    ARG  19           HN       ARG  19  50.489   6.519   4.902
  183    HA   ARG  19           HA       ARG  19  51.695   4.231   5.803
  184    HB2  ARG  19           HB2      ARG  19  53.635   5.593   6.513
  185    HB3  ARG  19           HB1      ARG  19  52.470   6.809   7.199
  186    HG2  ARG  19           HG2      ARG  19  53.736   5.192   8.860
  187    HG3  ARG  19           HG1      ARG  19  51.974   5.296   9.044
  188    HD2  ARG  19           HD2      ARG  19  51.634   3.180   8.006
  189    HD3  ARG  19           HD1      ARG  19  53.256   3.177   7.275
  190    HE   ARG  19           HE       ARG  19  53.369   3.223  10.183
  191   HH11  ARG  19          HH11      ARG  19  55.318   1.718   8.553
  192   HH12  ARG  19          HH12      ARG  19  54.825   0.072   8.780
  193   HH21  ARG  19          HH21      ARG  19  51.678   0.903   9.977
  194   HH22  ARG  19          HH22      ARG  19  52.764  -0.389   9.586
  195    H    LYS  20           HN       LYS  20  50.746   7.552   6.841
  196    HA   LYS  20           HA       LYS  20  48.088   6.817   7.953
  197    HB2  LYS  20           HB2      LYS  20  49.656   5.678   9.662
  198    HB3  LYS  20           HB1      LYS  20  50.255   7.309  10.046
  199    HG2  LYS  20           HG2      LYS  20  47.787   7.961  10.412
  200    HG3  LYS  20           HG1      LYS  20  47.428   6.220  10.363
  201    HD2  LYS  20           HD2      LYS  20  49.425   7.536  12.260
  202    HD3  LYS  20           HD1      LYS  20  47.765   7.070  12.695
  203    HE2  LYS  20           HE2      LYS  20  49.045   5.222  13.425
  204    HE3  LYS  20           HE1      LYS  20  48.461   4.684  11.833
  205    HZ1  LYS  20           HZ1      LYS  20  50.771   6.059  11.301
  206    HZ2  LYS  20           HZ2      LYS  20  50.593   4.370  11.339
  207    HZ3  LYS  20           HZ3      LYS  20  51.135   5.202  12.718
  208    H    ALA  21           HN       ALA  21  49.567   8.211   6.147
  209    HA   ALA  21           HA       ALA  21  49.828  10.319   5.316
  210    HB1  ALA  21           HB1      ALA  21  49.462  12.257   6.507
  211    HB2  ALA  21           HB2      ALA  21  48.886  11.283   7.871
  212    HB3  ALA  21           HB3      ALA  21  47.965  11.298   6.359
  213    H    VAL  22           HN       VAL  22  51.348   8.800   7.532
  214    HA   VAL  22           HA       VAL  22  53.032  10.723   8.557
  215    HB   VAL  22           HB       VAL  22  53.159   8.053   8.923
  216   HG11  VAL  22          HG11      VAL  22  54.390   7.992   6.542
  217   HG12  VAL  22          HG12      VAL  22  54.940   6.951   7.869
  218   HG13  VAL  22          HG13      VAL  22  55.810   8.449   7.502
  219   HG21  VAL  22          HG21      VAL  22  55.459  10.012   9.316
  220   HG22  VAL  22          HG22      VAL  22  55.303   8.442  10.139
  221   HG23  VAL  22          HG23      VAL  22  54.104   9.724  10.434
  222    H    ILE  23           HN       ILE  23  52.170  11.420   6.089
  223    HA   ILE  23           HA       ILE  23  54.795  12.307   5.124
  224    HB   ILE  23           HB       ILE  23  52.629  11.190   3.372
  225   HG12  ILE  23          HG12      ILE  23  54.681   9.799   4.236
  226   HG13  ILE  23          HG11      ILE  23  54.262   9.693   2.524
  227   HG21  ILE  23          HG21      ILE  23  54.782  13.209   2.650
  228   HG22  ILE  23          HG22      ILE  23  53.034  13.295   2.342
  229   HG23  ILE  23          HG23      ILE  23  54.042  12.158   1.421
  230   HD11  ILE  23           HD1      ILE  23  56.079  11.099   1.870
  231   HD12  ILE  23           HD2      ILE  23  56.755  10.011   3.100
  232   HD13  ILE  23           HD3      ILE  23  56.335  11.681   3.528
  233    H    ALA  24           HN       ALA  24  52.455  12.285   6.527
  234    HA   ALA  24           HA       ALA  24  52.187  15.222   6.829
  235    HB1  ALA  24           HB1      ALA  24  49.418  14.554   6.619
  236    HB2  ALA  24           HB2      ALA  24  50.188  13.938   5.133
  237    HB3  ALA  24           HB3      ALA  24  50.340  15.650   5.566
  238    H    TRP  25           HN       TRP  25  50.702  11.944   7.341
  239    HA   TRP  25           HA       TRP  25  50.770  10.752   9.325
  240    HB2  TRP  25           HB2      TRP  25  52.270  11.239  10.988
  241    HB3  TRP  25           HB1      TRP  25  52.764  12.578   9.946
  242    HD1  TRP  25           HD1      TRP  25  52.806  14.837  11.128
  243    HE1  TRP  25           HE1      TRP  25  51.683  15.909  13.211
  244    HE3  TRP  25           HE3      TRP  25  49.769  10.949  12.507
  245    HZ2  TRP  25           HZ2      TRP  25  49.739  15.153  15.195
  246    HZ3  TRP  25           HZ3      TRP  25  48.295  11.146  14.502
  247    HH2  TRP  25           HH2      TRP  25  48.277  13.242  15.848
  Start of MODEL    2
    1    H1   ALA   1           HT1      ALA   1  43.656  16.194   0.642
    2    H2   ALA   1           HT2      ALA   1  42.900  17.356  -0.341
    3    H3   ALA   1           HT3      ALA   1  44.136  17.818   0.731
    4    HA   ALA   1           HA       ALA   1  45.651  17.475  -0.775
    5    HB1  ALA   1           HB1      ALA   1  45.853  15.212  -0.022
    6    HB2  ALA   1           HB2      ALA   1  45.840  15.160  -1.805
    7    HB3  ALA   1           HB3      ALA   1  44.376  14.727  -0.885
    8    H    GLY   2           HN       GLY   2  45.888  16.406  -3.194
    9    HA2  GLY   2           HA1      GLY   2  44.092  18.054  -4.785
   10    HA3  GLY   2           HA2      GLY   2  45.390  16.998  -5.383
   11    H    LYS   3           HN       LYS   3  44.975  14.584  -5.129
   12    HA   LYS   3           HA       LYS   3  42.717  13.138  -4.841
   13    HB2  LYS   3           HB2      LYS   3  41.117  14.509  -5.953
   14    HB3  LYS   3           HB1      LYS   3  42.241  14.907  -7.275
   15    HG2  LYS   3           HG2      LYS   3  42.018  12.718  -8.242
   16    HG3  LYS   3           HG1      LYS   3  41.237  12.072  -6.778
   17    HD2  LYS   3           HD2      LYS   3  39.275  13.514  -7.164
   18    HD3  LYS   3           HD1      LYS   3  40.060  14.223  -8.595
   19    HE2  LYS   3           HE2      LYS   3  38.510  12.488  -9.333
   20    HE3  LYS   3           HE1      LYS   3  40.175  11.922  -9.605
   21    HZ1  LYS   3           HZ1      LYS   3  40.016  10.386  -7.962
   22    HZ2  LYS   3           HZ2      LYS   3  38.369  10.454  -8.374
   23    HZ3  LYS   3           HZ3      LYS   3  38.946  11.307  -7.022
   24    H    GLU   4           HN       GLU   4  45.097  14.362  -6.810
   25    HA   GLU   4           HA       GLU   4  46.502  11.916  -7.152
   26    HB2  GLU   4           HB2      GLU   4  46.474  11.984  -9.712
   27    HB3  GLU   4           HB1      GLU   4  44.963  11.388  -8.986
   28    HG2  GLU   4           HG2      GLU   4  43.991  13.678  -9.182
   29    HG3  GLU   4           HG1      GLU   4  45.490  14.227  -9.972
   30    H    LYS   5           HN       LYS   5  46.993  13.885  -5.848
   31    HA   LYS   5           HA       LYS   5  48.296  16.122  -7.055
   32    HB2  LYS   5           HB2      LYS   5  47.522  15.927  -4.693
   33    HB3  LYS   5           HB1      LYS   5  48.734  14.637  -4.446
   34    HG2  LYS   5           HG2      LYS   5  50.447  16.166  -4.171
   35    HG3  LYS   5           HG1      LYS   5  49.957  17.110  -5.592
   36    HD2  LYS   5           HD2      LYS   5  48.401  17.295  -2.981
   37    HD3  LYS   5           HD1      LYS   5  49.863  18.266  -3.253
   38    HE2  LYS   5           HE2      LYS   5  48.894  19.396  -5.122
   39    HE3  LYS   5           HE1      LYS   5  47.561  18.223  -5.243
   40    HZ1  LYS   5           HZ1      LYS   5  47.037  20.419  -4.144
   41    HZ2  LYS   5           HZ2      LYS   5  47.991  19.906  -2.835
   42    HZ3  LYS   5           HZ3      LYS   5  46.602  19.031  -3.272
   43    H    ILE   6           HN       ILE   6  48.832  13.210  -7.882
   44    HA   ILE   6           HA       ILE   6  50.588  11.997  -8.593
   45    HB   ILE   6           HB       ILE   6  52.486  14.261  -7.830
   46   HG12  ILE   6          HG12      ILE   6  50.783  15.346  -9.167
   47   HG13  ILE   6          HG11      ILE   6  52.186  15.085 -10.218
   48   HG21  ILE   6          HG21      ILE   6  52.609  11.860  -9.686
   49   HG22  ILE   6          HG22      ILE   6  53.773  12.402  -8.464
   50   HG23  ILE   6          HG23      ILE   6  53.630  13.279  -9.998
   51   HD11  ILE   6           HD1      ILE   6  51.043  12.935 -11.013
   52   HD12  ILE   6           HD2      ILE   6  50.239  14.447 -11.481
   53   HD13  ILE   6           HD3      ILE   6  49.596  13.482 -10.135
   54    H    ARG   7           HN       ARG   7  49.456  12.431  -5.762
   55    HA   ARG   7           HA       ARG   7  51.487  10.653  -4.675
   56    HB2  ARG   7           HB2      ARG   7  50.726  12.954  -3.157
   57    HB3  ARG   7           HB1      ARG   7  51.868  11.672  -2.742
   58    HG2  ARG   7           HG2      ARG   7  53.389  12.506  -4.590
   59    HG3  ARG   7           HG1      ARG   7  52.250  13.842  -4.872
   60    HD2  ARG   7           HD2      ARG   7  52.570  14.538  -2.478
   61    HD3  ARG   7           HD1      ARG   7  53.829  13.289  -2.329
   62    HE   ARG   7           HE       ARG   7  54.448  14.927  -4.586
   63   HH11  ARG   7          HH11      ARG   7  53.423  16.486  -1.944
   64   HH12  ARG   7          HH12      ARG   7  54.959  17.081  -1.408
   65   HH21  ARG   7          HH21      ARG   7  56.786  15.067  -3.561
   66   HH22  ARG   7          HH22      ARG   7  56.864  16.278  -2.324
   67    H    LYS   8           HN       LYS   8  48.674  12.194  -4.676
   68    HA   LYS   8           HA       LYS   8  47.329  10.933  -2.309
   69    HB2  LYS   8           HB2      LYS   8  47.383  13.250  -3.156
   70    HB3  LYS   8           HB1      LYS   8  46.809  12.536  -4.650
   71    HG2  LYS   8           HG2      LYS   8  45.336  12.863  -1.981
   72    HG3  LYS   8           HG1      LYS   8  44.816  13.491  -3.540
   73    HD2  LYS   8           HD2      LYS   8  44.409  11.151  -4.329
   74    HD3  LYS   8           HD1      LYS   8  44.885  10.554  -2.724
   75    HE2  LYS   8           HE2      LYS   8  42.814  12.657  -2.534
   76    HE3  LYS   8           HE1      LYS   8  42.275  11.247  -3.477
   77    HZ1  LYS   8           HZ1      LYS   8  42.881  11.468  -0.660
   78    HZ2  LYS   8           HZ2      LYS   8  43.553  10.096  -1.406
   79    HZ3  LYS   8           HZ3      LYS   8  41.878  10.372  -1.479
   80    H    LYS   9           HN       LYS   9  48.342  11.405  -5.384
   81    HA   LYS   9           HA       LYS   9  46.847   9.588  -7.122
   82    HB2  LYS   9           HB2      LYS   9  48.825  11.143  -7.718
   83    HB3  LYS   9           HB1      LYS   9  49.885  10.047  -6.737
   84    HG2  LYS   9           HG2      LYS   9  50.162   9.207  -8.940
   85    HG3  LYS   9           HG1      LYS   9  48.871   8.159  -8.314
   86    HD2  LYS   9           HD2      LYS   9  47.170   9.539  -9.444
   87    HD3  LYS   9           HD1      LYS   9  48.429  10.664 -10.007
   88    HE2  LYS   9           HE2      LYS   9  47.865   9.104 -11.811
   89    HE3  LYS   9           HE1      LYS   9  49.517   8.775 -11.235
   90    HZ1  LYS   9           HZ1      LYS   9  48.873   6.706 -10.839
   91    HZ2  LYS   9           HZ2      LYS   9  47.263   7.061 -11.251
   92    HZ3  LYS   9           HZ3      LYS   9  47.801   7.271  -9.653
   93    H    LEU  10           HN       LEU  10  48.608  10.239  -4.340
   94    HA   LEU  10           HA       LEU  10  48.656   8.473  -2.516
   95    HB2  LEU  10           HB2      LEU  10  47.948   6.298  -2.572
   96    HB3  LEU  10           HB1      LEU  10  47.128   6.940  -3.987
   97    HG   LEU  10           HG       LEU  10  49.456   6.041  -5.186
   98   HD11  LEU  10          HD11      LEU  10  50.680   4.621  -3.876
   99   HD12  LEU  10          HD12      LEU  10  49.297   3.519  -3.814
  100   HD13  LEU  10          HD13      LEU  10  49.509   4.735  -2.553
  101   HD21  LEU  10          HD21      LEU  10  47.142   4.147  -4.534
  102   HD22  LEU  10          HD22      LEU  10  48.178   4.128  -5.976
  103   HD23  LEU  10          HD23      LEU  10  47.009   5.439  -5.742
  104    H    LYS  11           HN       LYS  11  50.974   9.496  -4.280
  105    HA   LYS  11           HA       LYS  11  52.953   7.316  -4.152
  106    HB2  LYS  11           HB2      LYS  11  53.333  10.322  -3.845
  107    HB3  LYS  11           HB1      LYS  11  54.673   9.151  -3.969
  108    HG2  LYS  11           HG2      LYS  11  52.564   9.427  -6.176
  109    HG3  LYS  11           HG1      LYS  11  54.152  10.232  -6.190
  110    HD2  LYS  11           HD2      LYS  11  55.090   7.785  -5.802
  111    HD3  LYS  11           HD1      LYS  11  53.499   7.277  -6.413
  112    HE2  LYS  11           HE2      LYS  11  55.597   8.956  -7.836
  113    HE3  LYS  11           HE1      LYS  11  54.939   7.375  -8.323
  114    HZ1  LYS  11           HZ1      LYS  11  54.043   9.770  -9.198
  115    HZ2  LYS  11           HZ2      LYS  11  52.937   9.425  -7.956
  116    HZ3  LYS  11           HZ3      LYS  11  53.152   8.328  -9.234
  117    H    ASN  12           HN       ASN  12  51.870   9.972  -2.130
  118    HA   ASN  12           HA       ASN  12  52.748   8.489   0.330
  119    HB2  ASN  12           HB2      ASN  12  54.135  11.108  -0.288
  120    HB3  ASN  12           HB1      ASN  12  54.417  10.008   1.077
  121   HD21  ASN  12          HD21      ASN  12  55.359  10.786  -2.174
  122   HD22  ASN  12          HD22      ASN  12  56.413   9.390  -2.418
  123    H    GLU  13           HN       GLU  13  51.291  11.112  -1.352
  124    HA   GLU  13           HA       GLU  13  50.622  12.634   1.086
  125    HB2  GLU  13           HB2      GLU  13  50.453  13.694  -1.117
  126    HB3  GLU  13           HB1      GLU  13  49.073  12.636  -1.526
  127    HG2  GLU  13           HG2      GLU  13  47.770  13.600   0.305
  128    HG3  GLU  13           HG1      GLU  13  49.183  14.504   0.890
  129    H    ILE  14           HN       ILE  14  49.278   9.949  -0.586
  130    HA   ILE  14           HA       ILE  14  47.619   9.279   1.757
  131    HB   ILE  14           HB       ILE  14  46.327   9.222  -1.006
  132   HG12  ILE  14          HG12      ILE  14  46.670  11.616  -0.173
  133   HG13  ILE  14          HG11      ILE  14  45.001  11.140  -0.465
  134   HG21  ILE  14          HG21      ILE  14  45.320   8.729   1.824
  135   HG22  ILE  14          HG22      ILE  14  45.345   7.587   0.467
  136   HG23  ILE  14          HG23      ILE  14  44.228   8.964   0.446
  137   HD11  ILE  14           HD1      ILE  14  45.458  12.443   1.705
  138   HD12  ILE  14           HD2      ILE  14  46.217  10.960   2.311
  139   HD13  ILE  14           HD3      ILE  14  44.504  10.951   1.847
  140    H    LYS  15           HN       LYS  15  50.096   8.235   0.985
  141    HA   LYS  15           HA       LYS  15  49.688   6.184  -0.758
  142    HB2  LYS  15           HB2      LYS  15  51.964   6.614  -0.583
  143    HB3  LYS  15           HB1      LYS  15  51.829   6.490   1.177
  144    HG2  LYS  15           HG2      LYS  15  51.642   4.088   1.068
  145    HG3  LYS  15           HG1      LYS  15  51.412   4.127  -0.696
  146    HD2  LYS  15           HD2      LYS  15  53.719   5.061  -0.946
  147    HD3  LYS  15           HD1      LYS  15  53.943   4.919   0.815
  148    HE2  LYS  15           HE2      LYS  15  53.571   2.482   0.679
  149    HE3  LYS  15           HE1      LYS  15  53.310   2.611  -1.078
  150    HZ1  LYS  15           HZ1      LYS  15  55.805   3.123   0.448
  151    HZ2  LYS  15           HZ2      LYS  15  55.592   3.659  -1.150
  152    HZ3  LYS  15           HZ3      LYS  15  55.548   1.999  -0.794
  153    H    LYS  16           HN       LYS  16  49.240   6.640   1.931
  154    HA   LYS  16           HA       LYS  16  47.267   4.473   2.406
  155    HB2  LYS  16           HB2      LYS  16  49.376   3.200   2.701
  156    HB3  LYS  16           HB1      LYS  16  49.983   4.511   3.764
  157    HG2  LYS  16           HG2      LYS  16  48.449   3.955   5.501
  158    HG3  LYS  16           HG1      LYS  16  47.382   3.044   4.409
  159    HD2  LYS  16           HD2      LYS  16  49.069   1.277   4.174
  160    HD3  LYS  16           HD1      LYS  16  50.207   2.193   5.187
  161    HE2  LYS  16           HE2      LYS  16  47.462   1.251   6.115
  162    HE3  LYS  16           HE1      LYS  16  48.983   0.390   6.446
  163    HZ1  LYS  16           HZ1      LYS  16  48.127   3.063   7.397
  164    HZ2  LYS  16           HZ2      LYS  16  49.765   2.612   7.388
  165    HZ3  LYS  16           HZ3      LYS  16  48.643   1.728   8.307
  166    H    LYS  17           HN       LYS  17  49.209   6.953   2.695
  167    HA   LYS  17           HA       LYS  17  48.668   9.080   3.626
  168    HB2  LYS  17           HB2      LYS  17  47.647   7.532   5.930
  169    HB3  LYS  17           HB1      LYS  17  47.717   9.273   5.853
  170    HG2  LYS  17           HG2      LYS  17  46.032   9.457   4.266
  171    HG3  LYS  17           HG1      LYS  17  46.154   7.767   3.775
  172    HD2  LYS  17           HD2      LYS  17  45.258   7.033   5.949
  173    HD3  LYS  17           HD1      LYS  17  45.193   8.726   6.498
  174    HE2  LYS  17           HE2      LYS  17  43.630   9.252   4.629
  175    HE3  LYS  17           HE1      LYS  17  43.659   7.540   4.144
  176    HZ1  LYS  17           HZ1      LYS  17  42.900   7.024   6.457
  177    HZ2  LYS  17           HZ2      LYS  17  41.765   7.858   5.507
  178    HZ3  LYS  17           HZ3      LYS  17  42.653   8.684   6.697
  179    H    GLY  18           HN       GLY  18  50.590   7.928   2.451
  180    HA2  GLY  18           HA1      GLY  18  52.953   7.741   2.734
  181    HA3  GLY  18           HA2      GLY  18  52.711   8.816   4.162
  182    H    ARG  19           HN       ARG  19  50.606   6.455   4.606
  183    HA   ARG  19           HA       ARG  19  51.408   4.144   5.734
  184    HB2  ARG  19           HB2      ARG  19  53.460   5.235   6.591
  185    HB3  ARG  19           HB1      ARG  19  52.383   6.546   7.245
  186    HG2  ARG  19           HG2      ARG  19  51.925   5.285   9.153
  187    HG3  ARG  19           HG1      ARG  19  51.707   3.784   8.230
  188    HD2  ARG  19           HD2      ARG  19  53.994   3.221   8.354
  189    HD3  ARG  19           HD1      ARG  19  54.499   4.895   8.682
  190    HE   ARG  19           HE       ARG  19  52.795   3.821  10.789
  191   HH11  ARG  19          HH11      ARG  19  55.176   1.921  10.231
  192   HH12  ARG  19          HH12      ARG  19  56.314   2.499  11.402
  193   HH21  ARG  19          HH21      ARG  19  54.606   5.459  11.988
  194   HH22  ARG  19          HH22      ARG  19  55.991   4.503  12.397
  195    H    LYS  20           HN       LYS  20  50.682   7.598   6.648
  196    HA   LYS  20           HA       LYS  20  47.990   6.994   7.778
  197    HB2  LYS  20           HB2      LYS  20  49.549   5.854   9.518
  198    HB3  LYS  20           HB1      LYS  20  50.148   7.484   9.868
  199    HG2  LYS  20           HG2      LYS  20  48.421   7.309  11.446
  200    HG3  LYS  20           HG1      LYS  20  47.556   8.077  10.097
  201    HD2  LYS  20           HD2      LYS  20  46.684   5.890   9.373
  202    HD3  LYS  20           HD1      LYS  20  47.629   5.070  10.637
  203    HE2  LYS  20           HE2      LYS  20  45.306   5.354  11.383
  204    HE3  LYS  20           HE1      LYS  20  46.388   6.364  12.372
  205    HZ1  LYS  20           HZ1      LYS  20  44.214   7.339  11.305
  206    HZ2  LYS  20           HZ2      LYS  20  45.214   7.529   9.944
  207    HZ3  LYS  20           HZ3      LYS  20  45.626   8.272  11.416
  208    H    ALA  21           HN       ALA  21  49.763   8.319   6.018
  209    HA   ALA  21           HA       ALA  21  49.940  10.433   5.152
  210    HB1  ALA  21           HB1      ALA  21  49.162  11.422   7.710
  211    HB2  ALA  21           HB2      ALA  21  48.188  11.502   6.257
  212    HB3  ALA  21           HB3      ALA  21  49.725  12.410   6.377
  213    H    VAL  22           HN       VAL  22  51.439   8.863   7.283
  214    HA   VAL  22           HA       VAL  22  53.356  10.534   8.194
  215    HB   VAL  22           HB       VAL  22  54.110   7.807   7.113
  216   HG11  VAL  22          HG11      VAL  22  55.863   8.232   9.145
  217   HG12  VAL  22          HG12      VAL  22  55.638   9.916   8.621
  218   HG13  VAL  22          HG13      VAL  22  56.227   8.693   7.469
  219   HG21  VAL  22          HG21      VAL  22  52.252   8.093   8.963
  220   HG22  VAL  22          HG22      VAL  22  53.601   8.588  10.012
  221   HG23  VAL  22          HG23      VAL  22  53.587   6.967   9.287
  222    H    ILE  23           HN       ILE  23  52.363  11.431   5.837
  223    HA   ILE  23           HA       ILE  23  54.993  12.429   5.038
  224    HB   ILE  23           HB       ILE  23  53.600  10.935   3.051
  225   HG12  ILE  23          HG12      ILE  23  55.341  12.075   1.486
  226   HG13  ILE  23          HG11      ILE  23  55.841  13.004   2.908
  227   HG21  ILE  23          HG21      ILE  23  52.066  12.945   2.885
  228   HG22  ILE  23          HG22      ILE  23  52.925  12.541   1.378
  229   HG23  ILE  23          HG23      ILE  23  53.476  13.900   2.371
  230   HD11  ILE  23           HD1      ILE  23  57.123  10.787   2.360
  231   HD12  ILE  23           HD2      ILE  23  55.701   9.969   3.046
  232   HD13  ILE  23           HD3      ILE  23  56.649  11.094   4.044
  233    H    ALA  24           HN       ALA  24  52.684  12.226   6.475
  234    HA   ALA  24           HA       ALA  24  52.570  15.110   7.087
  235    HB1  ALA  24           HB1      ALA  24  50.777  15.834   5.902
  236    HB2  ALA  24           HB2      ALA  24  49.759  14.668   6.772
  237    HB3  ALA  24           HB3      ALA  24  50.527  14.212   5.227
  238    H    TRP  25           HN       TRP  25  50.933  11.824   7.303
  239    HA   TRP  25           HA       TRP  25  50.852  10.566   9.302
  240    HB2  TRP  25           HB2      TRP  25  52.936  11.619  10.197
  241    HB3  TRP  25           HB1      TRP  25  51.967  12.920  10.900
  242    HD1  TRP  25           HD1      TRP  25  51.503   9.060  10.972
  243    HE1  TRP  25           HE1      TRP  25  51.089   8.336  13.428
  244    HE3  TRP  25           HE3      TRP  25  51.890  13.635  13.228
  245    HZ2  TRP  25           HZ2      TRP  25  50.950   9.600  16.012
  246    HZ3  TRP  25           HZ3      TRP  25  51.614  13.853  15.693
  247    HH2  TRP  25           HH2      TRP  25  51.145  11.842  17.085
  Start of MODEL    3
    1    H1   ALA   1           HT1      ALA   1  50.483  19.837  -2.401
    2    H2   ALA   1           HT2      ALA   1  50.353  18.189  -2.798
    3    H3   ALA   1           HT3      ALA   1  50.119  18.701  -1.195
    4    HA   ALA   1           HA       ALA   1  48.178  19.941  -1.845
    5    HB1  ALA   1           HB1      ALA   1  47.462  20.120  -4.039
    6    HB2  ALA   1           HB2      ALA   1  48.177  18.562  -4.521
    7    HB3  ALA   1           HB3      ALA   1  49.215  19.997  -4.317
    8    H    GLY   2           HN       GLY   2  46.207  18.603  -3.120
    9    HA2  GLY   2           HA1      GLY   2  46.274  15.762  -2.311
   10    HA3  GLY   2           HA2      GLY   2  45.177  16.808  -1.381
   11    H    LYS   3           HN       LYS   3  46.075  15.853  -4.735
   12    HA   LYS   3           HA       LYS   3  43.302  15.339  -5.411
   13    HB2  LYS   3           HB2      LYS   3  43.242  17.865  -5.364
   14    HB3  LYS   3           HB1      LYS   3  44.474  17.862  -6.651
   15    HG2  LYS   3           HG2      LYS   3  42.988  16.690  -8.167
   16    HG3  LYS   3           HG1      LYS   3  41.796  16.423  -6.875
   17    HD2  LYS   3           HD2      LYS   3  41.058  18.293  -8.271
   18    HD3  LYS   3           HD1      LYS   3  41.515  18.903  -6.664
   19    HE2  LYS   3           HE2      LYS   3  43.525  19.864  -7.464
   20    HE3  LYS   3           HE1      LYS   3  43.538  18.856  -8.932
   21    HZ1  LYS   3           HZ1      LYS   3  41.977  21.269  -8.334
   22    HZ2  LYS   3           HZ2      LYS   3  41.277  20.091  -9.339
   23    HZ3  LYS   3           HZ3      LYS   3  42.756  20.810  -9.768
   24    H    GLU   4           HN       GLU   4  44.867  13.492  -5.807
   25    HA   GLU   4           HA       GLU   4  46.261  12.251  -7.245
   26    HB2  GLU   4           HB2      GLU   4  45.127  13.918  -9.522
   27    HB3  GLU   4           HB1      GLU   4  45.680  12.227  -9.534
   28    HG2  GLU   4           HG2      GLU   4  43.784  11.641  -7.999
   29    HG3  GLU   4           HG1      GLU   4  43.206  13.321  -8.120
   30    H    LYS   5           HN       LYS   5  47.229  14.183  -5.905
   31    HA   LYS   5           HA       LYS   5  48.799  16.089  -7.251
   32    HB2  LYS   5           HB2      LYS   5  48.290  16.013  -4.821
   33    HB3  LYS   5           HB1      LYS   5  49.199  14.481  -4.714
   34    HG2  LYS   5           HG2      LYS   5  50.360  16.723  -3.952
   35    HG3  LYS   5           HG1      LYS   5  51.294  15.582  -4.929
   36    HD2  LYS   5           HD2      LYS   5  50.982  16.918  -6.928
   37    HD3  LYS   5           HD1      LYS   5  49.752  17.924  -6.135
   38    HE2  LYS   5           HE2      LYS   5  52.013  19.024  -6.284
   39    HE3  LYS   5           HE1      LYS   5  51.411  18.858  -4.618
   40    HZ1  LYS   5           HZ1      LYS   5  52.832  17.058  -4.222
   41    HZ2  LYS   5           HZ2      LYS   5  53.799  18.174  -5.062
   42    HZ3  LYS   5           HZ3      LYS   5  53.165  16.819  -5.868
   43    H    ILE   6           HN       ILE   6  48.674  13.062  -8.036
   44    HA   ILE   6           HA       ILE   6  50.115  11.520  -8.870
   45    HB   ILE   6           HB       ILE   6  52.461  13.457  -8.618
   46   HG12  ILE   6          HG12      ILE   6  50.325  13.436 -10.806
   47   HG13  ILE   6          HG11      ILE   6  50.707  14.783  -9.714
   48   HG21  ILE   6          HG21      ILE   6  51.825  11.480 -10.847
   49   HG22  ILE   6          HG22      ILE   6  52.648  10.975  -9.354
   50   HG23  ILE   6          HG23      ILE   6  53.397  12.190 -10.412
   51   HD11  ILE   6           HD1      ILE   6  53.111  14.652 -10.687
   52   HD12  ILE   6           HD2      ILE   6  51.836  15.330 -11.728
   53   HD13  ILE   6           HD3      ILE   6  52.389  13.657 -11.973
   54    H    ARG   7           HN       ARG   7  49.373  12.347  -6.119
   55    HA   ARG   7           HA       ARG   7  51.153  10.399  -4.977
   56    HB2  ARG   7           HB2      ARG   7  50.928  12.927  -3.632
   57    HB3  ARG   7           HB1      ARG   7  51.815  11.479  -3.156
   58    HG2  ARG   7           HG2      ARG   7  53.369  11.853  -5.147
   59    HG3  ARG   7           HG1      ARG   7  52.496  13.352  -5.489
   60    HD2  ARG   7           HD2      ARG   7  53.177  14.299  -3.353
   61    HD3  ARG   7           HD1      ARG   7  53.943  12.764  -2.880
   62    HE   ARG   7           HE       ARG   7  55.109  14.782  -4.605
   63   HH11  ARG   7          HH11      ARG   7  56.179  13.725  -6.547
   64   HH12  ARG   7          HH12      ARG   7  57.111  12.318  -6.155
   65   HH21  ARG   7          HH21      ARG   7  55.736  11.961  -2.992
   66   HH22  ARG   7          HH22      ARG   7  56.860  11.321  -4.144
   67    H    LYS   8           HN       LYS   8  48.644  12.462  -5.014
   68    HA   LYS   8           HA       LYS   8  47.288  11.705  -2.467
   69    HB2  LYS   8           HB2      LYS   8  47.151  13.757  -3.794
   70    HB3  LYS   8           HB1      LYS   8  46.817  12.636  -5.117
   71    HG2  LYS   8           HG2      LYS   8  44.984  12.701  -2.674
   72    HG3  LYS   8           HG1      LYS   8  44.754  13.933  -3.913
   73    HD2  LYS   8           HD2      LYS   8  44.734  11.722  -5.526
   74    HD3  LYS   8           HD1      LYS   8  44.156  10.988  -4.017
   75    HE2  LYS   8           HE2      LYS   8  42.841  13.082  -5.739
   76    HE3  LYS   8           HE1      LYS   8  42.130  11.664  -4.940
   77    HZ1  LYS   8           HZ1      LYS   8  42.290  14.319  -4.000
   78    HZ2  LYS   8           HZ2      LYS   8  43.159  13.313  -2.940
   79    HZ3  LYS   8           HZ3      LYS   8  41.528  12.983  -3.284
   80    H    LYS   9           HN       LYS   9  48.190  11.388  -5.634
   81    HA   LYS   9           HA       LYS   9  46.414   9.412  -6.864
   82    HB2  LYS   9           HB2      LYS   9  48.344  10.487  -8.059
   83    HB3  LYS   9           HB1      LYS   9  49.481   9.750  -6.863
   84    HG2  LYS   9           HG2      LYS   9  48.897   7.523  -7.627
   85    HG3  LYS   9           HG1      LYS   9  47.572   8.139  -8.643
   86    HD2  LYS   9           HD2      LYS   9  49.239   9.399 -10.010
   87    HD3  LYS   9           HD1      LYS   9  50.547   8.697  -9.026
   88    HE2  LYS   9           HE2      LYS   9  48.503   7.030 -10.552
   89    HE3  LYS   9           HE1      LYS   9  50.100   7.472 -11.202
   90    HZ1  LYS   9           HZ1      LYS   9  50.206   5.316 -10.166
   91    HZ2  LYS   9           HZ2      LYS   9  49.563   5.924  -8.715
   92    HZ3  LYS   9           HZ3      LYS   9  51.103   6.416  -9.237
   93    H    LEU  10           HN       LEU  10  48.365  10.334  -4.333
   94    HA   LEU  10           HA       LEU  10  48.490   8.887  -2.271
   95    HB2  LEU  10           HB2      LEU  10  47.277   7.019  -1.882
   96    HB3  LEU  10           HB1      LEU  10  46.548   7.437  -3.422
   97    HG   LEU  10           HG       LEU  10  48.616   5.834  -4.323
   98   HD11  LEU  10          HD11      LEU  10  48.719   5.363  -1.502
   99   HD12  LEU  10          HD12      LEU  10  49.471   4.377  -2.766
  100   HD13  LEU  10          HD13      LEU  10  47.856   3.962  -2.161
  101   HD21  LEU  10          HD21      LEU  10  46.161   5.596  -4.840
  102   HD22  LEU  10          HD22      LEU  10  45.941   4.782  -3.279
  103   HD23  LEU  10          HD23      LEU  10  46.951   4.033  -4.537
  104    H    LYS  11           HN       LYS  11  50.600   9.297  -4.409
  105    HA   LYS  11           HA       LYS  11  52.281   6.870  -4.281
  106    HB2  LYS  11           HB2      LYS  11  52.913   9.832  -4.298
  107    HB3  LYS  11           HB1      LYS  11  54.172   8.559  -4.493
  108    HG2  LYS  11           HG2      LYS  11  51.840   8.926  -6.463
  109    HG3  LYS  11           HG1      LYS  11  53.536   9.393  -6.732
  110    HD2  LYS  11           HD2      LYS  11  54.026   6.850  -6.144
  111    HD3  LYS  11           HD1      LYS  11  52.316   6.625  -6.582
  112    HE2  LYS  11           HE2      LYS  11  52.771   7.766  -8.769
  113    HE3  LYS  11           HE1      LYS  11  54.496   7.838  -8.335
  114    HZ1  LYS  11           HZ1      LYS  11  54.761   5.683  -8.794
  115    HZ2  LYS  11           HZ2      LYS  11  53.275   5.778  -9.612
  116    HZ3  LYS  11           HZ3      LYS  11  53.332   5.223  -8.006
  117    H    ASN  12           HN       ASN  12  51.842   9.858  -2.552
  118    HA   ASN  12           HA       ASN  12  52.821   8.702  -0.019
  119    HB2  ASN  12           HB2      ASN  12  54.733  10.231  -1.771
  120    HB3  ASN  12           HB1      ASN  12  54.848  10.441  -0.011
  121   HD21  ASN  12          HD21      ASN  12  55.886   8.502  -2.630
  122   HD22  ASN  12          HD22      ASN  12  56.441   7.114  -1.687
  123    H    GLU  13           HN       GLU  13  51.060  10.736  -1.688
  124    HA   GLU  13           HA       GLU  13  51.311  13.034   0.323
  125    HB2  GLU  13           HB2      GLU  13  49.406  12.582  -1.953
  126    HB3  GLU  13           HB1      GLU  13  48.754  13.454  -0.580
  127    HG2  GLU  13           HG2      GLU  13  51.431  14.247  -1.785
  128    HG3  GLU  13           HG1      GLU  13  49.904  14.841  -2.478
  129    H    ILE  14           HN       ILE  14  49.933  10.091  -0.331
  130    HA   ILE  14           HA       ILE  14  49.322   9.602   2.386
  131    HB   ILE  14           HB       ILE  14  46.905   8.789   1.880
  132   HG12  ILE  14          HG12      ILE  14  47.391  10.622  -0.492
  133   HG13  ILE  14          HG11      ILE  14  46.919   8.918  -0.540
  134   HG21  ILE  14          HG21      ILE  14  45.951  10.860   2.560
  135   HG22  ILE  14          HG22      ILE  14  47.159  11.820   1.677
  136   HG23  ILE  14          HG23      ILE  14  47.618  10.964   3.165
  137   HD11  ILE  14           HD1      ILE  14  44.900  10.105  -0.945
  138   HD12  ILE  14           HD2      ILE  14  45.253  11.299   0.327
  139   HD13  ILE  14           HD3      ILE  14  44.811   9.632   0.769
  140    H    LYS  15           HN       LYS  15  51.248   8.404   1.473
  141    HA   LYS  15           HA       LYS  15  51.152   6.609  -0.433
  142    HB2  LYS  15           HB2      LYS  15  53.219   6.878   0.947
  143    HB3  LYS  15           HB1      LYS  15  52.402   5.826   2.110
  144    HG2  LYS  15           HG2      LYS  15  52.453   3.963   0.607
  145    HG3  LYS  15           HG1      LYS  15  52.918   4.993  -0.769
  146    HD2  LYS  15           HD2      LYS  15  55.088   5.471   0.296
  147    HD3  LYS  15           HD1      LYS  15  54.623   4.500   1.713
  148    HE2  LYS  15           HE2      LYS  15  56.069   3.229   0.111
  149    HE3  LYS  15           HE1      LYS  15  54.468   2.483   0.327
  150    HZ1  LYS  15           HZ1      LYS  15  53.727   3.540  -1.703
  151    HZ2  LYS  15           HZ2      LYS  15  55.120   2.618  -2.012
  152    HZ3  LYS  15           HZ3      LYS  15  55.225   4.309  -1.900
  153    H    LYS  16           HN       LYS  16  49.843   6.611   1.994
  154    HA   LYS  16           HA       LYS  16  47.845   4.415   1.474
  155    HB2  LYS  16           HB2      LYS  16  49.784   3.150   2.257
  156    HB3  LYS  16           HB1      LYS  16  50.092   4.419   3.501
  157    HG2  LYS  16           HG2      LYS  16  48.313   3.656   4.874
  158    HG3  LYS  16           HG1      LYS  16  47.462   2.861   3.528
  159    HD2  LYS  16           HD2      LYS  16  49.193   1.111   3.439
  160    HD3  LYS  16           HD1      LYS  16  50.107   1.926   4.731
  161    HE2  LYS  16           HE2      LYS  16  48.233   1.608   6.293
  162    HE3  LYS  16           HE1      LYS  16  47.264   0.854   5.004
  163    HZ1  LYS  16           HZ1      LYS  16  49.044  -0.398   6.717
  164    HZ2  LYS  16           HZ2      LYS  16  49.810  -0.388   5.200
  165    HZ3  LYS  16           HZ3      LYS  16  48.265  -1.076   5.370
  166    H    LYS  17           HN       LYS  17  49.313   6.937   2.673
  167    HA   LYS  17           HA       LYS  17  48.096   8.800   3.864
  168    HB2  LYS  17           HB2      LYS  17  47.641   6.495   5.706
  169    HB3  LYS  17           HB1      LYS  17  47.507   8.197   6.145
  170    HG2  LYS  17           HG2      LYS  17  45.575   8.600   4.965
  171    HG3  LYS  17           HG1      LYS  17  45.851   7.285   3.817
  172    HD2  LYS  17           HD2      LYS  17  45.431   5.642   5.699
  173    HD3  LYS  17           HD1      LYS  17  45.028   7.023   6.744
  174    HE2  LYS  17           HE2      LYS  17  42.942   6.195   5.878
  175    HE3  LYS  17           HE1      LYS  17  43.297   7.696   4.990
  176    HZ1  LYS  17           HZ1      LYS  17  43.303   6.555   3.106
  177    HZ2  LYS  17           HZ2      LYS  17  42.886   5.140   3.949
  178    HZ3  LYS  17           HZ3      LYS  17  44.519   5.520   3.678
  179    H    GLY  18           HN       GLY  18  50.385   7.983   2.467
  180    HA2  GLY  18           HA1      GLY  18  52.715   8.034   2.925
  181    HA3  GLY  18           HA2      GLY  18  52.255   9.063   4.333
  182    H    ARG  19           HN       ARG  19  50.517   6.340   4.607
  183    HA   ARG  19           HA       ARG  19  51.500   4.188   5.804
  184    HB2  ARG  19           HB2      ARG  19  53.438   5.467   6.693
  185    HB3  ARG  19           HB1      ARG  19  52.236   6.648   7.386
  186    HG2  ARG  19           HG2      ARG  19  51.879   5.267   9.237
  187    HG3  ARG  19           HG1      ARG  19  51.820   3.791   8.254
  188    HD2  ARG  19           HD2      ARG  19  54.156   3.464   8.368
  189    HD3  ARG  19           HD1      ARG  19  54.479   5.159   8.797
  190    HE   ARG  19           HE       ARG  19  53.726   3.019  10.655
  191   HH11  ARG  19          HH11      ARG  19  51.902   4.392  11.982
  192   HH12  ARG  19          HH12      ARG  19  52.657   5.735  12.775
  193   HH21  ARG  19          HH21      ARG  19  55.520   5.620  10.824
  194   HH22  ARG  19          HH22      ARG  19  54.705   6.430  12.119
  195    H    LYS  20           HN       LYS  20  50.608   7.522   6.872
  196    HA   LYS  20           HA       LYS  20  47.864   6.825   7.837
  197    HB2  LYS  20           HB2      LYS  20  49.358   5.641   9.607
  198    HB3  LYS  20           HB1      LYS  20  49.914   7.268  10.047
  199    HG2  LYS  20           HG2      LYS  20  48.115   7.043  11.526
  200    HG3  LYS  20           HG1      LYS  20  47.286   7.798  10.147
  201    HD2  LYS  20           HD2      LYS  20  46.776   5.397   9.339
  202    HD3  LYS  20           HD1      LYS  20  47.324   4.855  10.941
  203    HE2  LYS  20           HE2      LYS  20  45.102   6.883  10.438
  204    HE3  LYS  20           HE1      LYS  20  44.855   5.173  10.867
  205    HZ1  LYS  20           HZ1      LYS  20  44.912   5.913  12.958
  206    HZ2  LYS  20           HZ2      LYS  20  45.612   7.401  12.534
  207    HZ3  LYS  20           HZ3      LYS  20  46.592   6.032  12.757
  208    H    ALA  21           HN       ALA  21  49.484   8.201   6.147
  209    HA   ALA  21           HA       ALA  21  49.746  10.336   5.349
  210    HB1  ALA  21           HB1      ALA  21  49.489  12.267   6.580
  211    HB2  ALA  21           HB2      ALA  21  48.891  11.287   7.930
  212    HB3  ALA  21           HB3      ALA  21  47.947  11.380   6.438
  213    H    VAL  22           HN       VAL  22  51.254   8.719   7.536
  214    HA   VAL  22           HA       VAL  22  53.071  10.537   8.476
  215    HB   VAL  22           HB       VAL  22  54.013   7.798   7.567
  216   HG11  VAL  22          HG11      VAL  22  56.032   8.824   8.064
  217   HG12  VAL  22          HG12      VAL  22  55.555   8.403   9.719
  218   HG13  VAL  22          HG13      VAL  22  55.279  10.050   9.111
  219   HG21  VAL  22          HG21      VAL  22  53.186   8.651  10.372
  220   HG22  VAL  22          HG22      VAL  22  53.376   7.004   9.736
  221   HG23  VAL  22          HG23      VAL  22  51.991   7.998   9.234
  222    H    ILE  23           HN       ILE  23  52.148  11.350   6.064
  223    HA   ILE  23           HA       ILE  23  54.799  12.217   5.139
  224    HB   ILE  23           HB       ILE  23  52.608  11.384   3.230
  225   HG12  ILE  23          HG12      ILE  23  54.490   9.741   3.985
  226   HG13  ILE  23          HG11      ILE  23  54.183   9.891   2.246
  227   HG21  ILE  23          HG21      ILE  23  54.775  13.476   2.935
  228   HG22  ILE  23          HG22      ILE  23  53.144  13.429   2.232
  229   HG23  ILE  23          HG23      ILE  23  54.446  12.455   1.518
  230   HD11  ILE  23           HD1      ILE  23  56.265  11.731   3.435
  231   HD12  ILE  23           HD2      ILE  23  56.220  10.961   1.838
  232   HD13  ILE  23           HD3      ILE  23  56.685  10.015   3.266
  233    H    ALA  24           HN       ALA  24  52.521  12.180   6.633
  234    HA   ALA  24           HA       ALA  24  52.355  15.090   7.082
  235    HB1  ALA  24           HB1      ALA  24  50.531  15.672   5.849
  236    HB2  ALA  24           HB2      ALA  24  49.558  14.558   6.832
  237    HB3  ALA  24           HB3      ALA  24  50.306  13.995   5.314
  238    H    TRP  25           HN       TRP  25  50.710  11.842   7.428
  239    HA   TRP  25           HA       TRP  25  50.667  10.600   9.392
  240    HB2  TRP  25           HB2      TRP  25  52.225  10.916  11.043
  241    HB3  TRP  25           HB1      TRP  25  52.803  12.248  10.034
  242    HD1  TRP  25           HD1      TRP  25  53.053  14.442  11.289
  243    HE1  TRP  25           HE1      TRP  25  52.040  15.543  13.413
  244    HE3  TRP  25           HE3      TRP  25  49.687  10.796  12.568
  245    HZ2  TRP  25           HZ2      TRP  25  50.045  14.902  15.385
  246    HZ3  TRP  25           HZ3      TRP  25  48.245  11.062  14.578
  247    HH2  TRP  25           HH2      TRP  25  48.420  13.108  15.987
  Start of MODEL    4
    1    H1   ALA   1           HT1      ALA   1  46.526  21.398  -6.315
    2    H2   ALA   1           HT2      ALA   1  47.778  20.258  -6.175
    3    H3   ALA   1           HT3      ALA   1  46.814  20.636  -4.829
    4    HA   ALA   1           HA       ALA   1  45.013  19.891  -6.693
    5    HB1  ALA   1           HB1      ALA   1  46.514  18.935  -8.230
    6    HB2  ALA   1           HB2      ALA   1  46.053  17.525  -7.244
    7    HB3  ALA   1           HB3      ALA   1  47.604  18.350  -6.957
    8    H    GLY   2           HN       GLY   2  44.655  17.263  -6.193
    9    HA2  GLY   2           HA1      GLY   2  45.146  16.203  -3.670
   10    HA3  GLY   2           HA2      GLY   2  43.739  17.269  -3.462
   11    H    LYS   3           HN       LYS   3  45.108  14.669  -5.605
   12    HA   LYS   3           HA       LYS   3  42.654  13.083  -5.416
   13    HB2  LYS   3           HB2      LYS   3  41.826  13.398  -7.757
   14    HB3  LYS   3           HB1      LYS   3  41.588  14.859  -6.772
   15    HG2  LYS   3           HG2      LYS   3  43.843  15.679  -7.698
   16    HG3  LYS   3           HG1      LYS   3  43.736  14.340  -8.865
   17    HD2  LYS   3           HD2      LYS   3  41.725  16.608  -8.506
   18    HD3  LYS   3           HD1      LYS   3  42.825  16.373  -9.884
   19    HE2  LYS   3           HE2      LYS   3  40.788  15.482 -10.679
   20    HE3  LYS   3           HE1      LYS   3  41.648  14.030 -10.114
   21    HZ1  LYS   3           HZ1      LYS   3  40.172  13.721  -8.483
   22    HZ2  LYS   3           HZ2      LYS   3  39.165  14.784  -9.343
   23    HZ3  LYS   3           HZ3      LYS   3  40.117  15.362  -8.061
   24    H    GLU   4           HN       GLU   4  45.447  14.306  -6.727
   25    HA   GLU   4           HA       GLU   4  46.616  11.693  -7.179
   26    HB2  GLU   4           HB2      GLU   4  46.358  13.770  -9.381
   27    HB3  GLU   4           HB1      GLU   4  47.567  12.464  -9.400
   28    HG2  GLU   4           HG2      GLU   4  45.699  10.796  -9.220
   29    HG3  GLU   4           HG1      GLU   4  44.535  12.137  -9.349
   30    H    LYS   5           HN       LYS   5  47.103  15.197  -7.526
   31    HA   LYS   5           HA       LYS   5  49.058  16.198  -6.857
   32    HB2  LYS   5           HB2      LYS   5  48.343  14.523  -4.527
   33    HB3  LYS   5           HB1      LYS   5  49.778  15.551  -4.439
   34    HG2  LYS   5           HG2      LYS   5  47.121  16.728  -5.288
   35    HG3  LYS   5           HG1      LYS   5  47.466  16.475  -3.566
   36    HD2  LYS   5           HD2      LYS   5  49.516  17.907  -5.293
   37    HD3  LYS   5           HD1      LYS   5  48.092  18.792  -4.707
   38    HE2  LYS   5           HE2      LYS   5  48.709  18.562  -2.444
   39    HE3  LYS   5           HE1      LYS   5  49.763  17.167  -2.764
   40    HZ1  LYS   5           HZ1      LYS   5  50.887  19.379  -2.353
   41    HZ2  LYS   5           HZ2      LYS   5  50.320  19.858  -3.881
   42    HZ3  LYS   5           HZ3      LYS   5  51.376  18.535  -3.742
   43    H    ILE   6           HN       ILE   6  49.165  13.523  -8.209
   44    HA   ILE   6           HA       ILE   6  50.673  11.875  -8.602
   45    HB   ILE   6           HB       ILE   6  51.915  13.760  -9.722
   46   HG12  ILE   6          HG12      ILE   6  54.077  12.084  -8.409
   47   HG13  ILE   6          HG11      ILE   6  52.813  11.240  -9.323
   48   HG21  ILE   6          HG21      ILE   6  53.952  14.659  -8.469
   49   HG22  ILE   6          HG22      ILE   6  53.229  14.021  -6.983
   50   HG23  ILE   6          HG23      ILE   6  52.382  15.276  -7.924
   51   HD11  ILE   6           HD1      ILE   6  54.537  13.507 -10.416
   52   HD12  ILE   6           HD2      ILE   6  53.301  12.598 -11.316
   53   HD13  ILE   6           HD3      ILE   6  54.772  11.776 -10.747
   54    H    ARG   7           HN       ARG   7  49.572  12.385  -5.852
   55    HA   ARG   7           HA       ARG   7  51.567  10.657  -4.664
   56    HB2  ARG   7           HB2      ARG   7  50.764  13.138  -3.441
   57    HB3  ARG   7           HB1      ARG   7  51.574  11.776  -2.675
   58    HG2  ARG   7           HG2      ARG   7  53.441  12.252  -4.558
   59    HG3  ARG   7           HG1      ARG   7  52.720  13.858  -4.562
   60    HD2  ARG   7           HD2      ARG   7  53.051  13.956  -2.068
   61    HD3  ARG   7           HD1      ARG   7  53.964  12.434  -2.186
   62    HE   ARG   7           HE       ARG   7  55.771  13.677  -3.048
   63   HH11  ARG   7          HH11      ARG   7  52.838  15.479  -3.086
   64   HH12  ARG   7          HH12      ARG   7  53.551  16.883  -3.807
   65   HH21  ARG   7          HH21      ARG   7  56.697  15.457  -4.111
   66   HH22  ARG   7          HH22      ARG   7  55.735  16.871  -4.387
   67    H    LYS   8           HN       LYS   8  48.691  12.292  -4.671
   68    HA   LYS   8           HA       LYS   8  47.424  10.958  -2.308
   69    HB2  LYS   8           HB2      LYS   8  47.127  13.222  -3.143
   70    HB3  LYS   8           HB1      LYS   8  46.897  12.407  -4.696
   71    HG2  LYS   8           HG2      LYS   8  44.618  12.736  -4.171
   72    HG3  LYS   8           HG1      LYS   8  44.857  11.223  -3.302
   73    HD2  LYS   8           HD2      LYS   8  45.400  12.568  -1.245
   74    HD3  LYS   8           HD1      LYS   8  44.998  14.043  -2.153
   75    HE2  LYS   8           HE2      LYS   8  43.105  11.696  -1.699
   76    HE3  LYS   8           HE1      LYS   8  43.069  13.229  -0.798
   77    HZ1  LYS   8           HZ1      LYS   8  43.110  13.922  -3.469
   78    HZ2  LYS   8           HZ2      LYS   8  41.784  14.011  -2.411
   79    HZ3  LYS   8           HZ3      LYS   8  42.016  12.630  -3.372
   80    H    LYS   9           HN       LYS   9  48.431  11.405  -5.471
   81    HA   LYS   9           HA       LYS   9  46.973   9.445  -7.124
   82    HB2  LYS   9           HB2      LYS   9  48.925  10.902  -7.859
   83    HB3  LYS   9           HB1      LYS   9  50.000   9.952  -6.733
   84    HG2  LYS   9           HG2      LYS   9  49.540   7.916  -8.008
   85    HG3  LYS   9           HG1      LYS   9  48.316   8.727  -9.012
   86    HD2  LYS   9           HD2      LYS   9  50.001  10.138 -10.043
   87    HD3  LYS   9           HD1      LYS   9  51.249   9.534  -8.925
   88    HE2  LYS   9           HE2      LYS   9  49.711   7.787 -10.892
   89    HE3  LYS   9           HE1      LYS   9  51.336   8.447 -11.191
   90    HZ1  LYS   9           HZ1      LYS   9  51.778   7.358  -8.854
   91    HZ2  LYS   9           HZ2      LYS   9  51.870   6.444 -10.283
   92    HZ3  LYS   9           HZ3      LYS   9  50.481   6.365  -9.309
   93    H    LEU  10           HN       LEU  10  48.659  10.141  -4.354
   94    HA   LEU  10           HA       LEU  10  48.745   8.350  -2.530
   95    HB2  LEU  10           HB2      LEU  10  48.029   6.172  -2.609
   96    HB3  LEU  10           HB1      LEU  10  47.247   6.789  -4.052
   97    HG   LEU  10           HG       LEU  10  49.622   5.937  -5.177
   98   HD11  LEU  10          HD11      LEU  10  49.671   4.697  -2.530
   99   HD12  LEU  10          HD12      LEU  10  50.838   4.527  -3.847
  100   HD13  LEU  10          HD13      LEU  10  49.453   3.430  -3.745
  101   HD21  LEU  10          HD21      LEU  10  48.417   3.966  -5.962
  102   HD22  LEU  10          HD22      LEU  10  47.227   5.274  -5.814
  103   HD23  LEU  10          HD23      LEU  10  47.318   4.017  -4.568
  104    H    LYS  11           HN       LYS  11  50.972   9.506  -4.206
  105    HA   LYS  11           HA       LYS  11  53.160   7.542  -4.207
  106    HB2  LYS  11           HB2      LYS  11  53.499   9.939  -4.999
  107    HB3  LYS  11           HB1      LYS  11  53.266  10.467  -3.257
  108    HG2  LYS  11           HG2      LYS  11  55.307   9.382  -2.616
  109    HG3  LYS  11           HG1      LYS  11  55.396   8.422  -4.113
  110    HD2  LYS  11           HD2      LYS  11  55.807  10.472  -5.423
  111    HD3  LYS  11           HD1      LYS  11  55.665  11.457  -3.948
  112    HE2  LYS  11           HE2      LYS  11  58.051  10.937  -4.623
  113    HE3  LYS  11           HE1      LYS  11  57.626  10.411  -2.977
  114    HZ1  LYS  11           HZ1      LYS  11  57.676   8.234  -3.564
  115    HZ2  LYS  11           HZ2      LYS  11  58.794   8.811  -4.706
  116    HZ3  LYS  11           HZ3      LYS  11  57.185   8.513  -5.163
  117    H    ASN  12           HN       ASN  12  51.838   9.957  -2.093
  118    HA   ASN  12           HA       ASN  12  52.274   8.350   0.359
  119    HB2  ASN  12           HB2      ASN  12  54.298  10.485  -0.303
  120    HB3  ASN  12           HB1      ASN  12  53.958   9.977   1.362
  121   HD21  ASN  12          HD21      ASN  12  53.595   7.173   0.992
  122   HD22  ASN  12          HD22      ASN  12  55.141   6.495   0.475
  123    H    GLU  13           HN       GLU  13  51.351  11.073  -1.419
  124    HA   GLU  13           HA       GLU  13  50.625  12.744   0.889
  125    HB2  GLU  13           HB2      GLU  13  50.495  13.769  -1.305
  126    HB3  GLU  13           HB1      GLU  13  49.222  12.630  -1.797
  127    HG2  GLU  13           HG2      GLU  13  48.334  14.880  -1.157
  128    HG3  GLU  13           HG1      GLU  13  47.671  13.563  -0.170
  129    H    ILE  14           HN       ILE  14  49.405   9.846  -0.381
  130    HA   ILE  14           HA       ILE  14  47.713   9.483   1.909
  131    HB   ILE  14           HB       ILE  14  46.325  10.878   0.086
  132   HG12  ILE  14          HG12      ILE  14  45.194   8.511   1.642
  133   HG13  ILE  14          HG11      ILE  14  45.476  10.149   2.278
  134   HG21  ILE  14          HG21      ILE  14  46.753   8.832  -1.576
  135   HG22  ILE  14          HG22      ILE  14  45.209   9.688  -1.572
  136   HG23  ILE  14          HG23      ILE  14  45.358   8.133  -0.738
  137   HD11  ILE  14           HD1      ILE  14  43.491   9.296   0.136
  138   HD12  ILE  14           HD2      ILE  14  43.937  10.997   0.411
  139   HD13  ILE  14           HD3      ILE  14  43.150  10.063   1.704
  140    H    LYS  15           HN       LYS  15  50.097   8.309   0.741
  141    HA   LYS  15           HA       LYS  15  49.471   6.209  -0.750
  142    HB2  LYS  15           HB2      LYS  15  51.798   6.448  -0.634
  143    HB3  LYS  15           HB1      LYS  15  51.679   6.301   1.133
  144    HG2  LYS  15           HG2      LYS  15  51.317   3.949   1.022
  145    HG3  LYS  15           HG1      LYS  15  50.968   4.004  -0.718
  146    HD2  LYS  15           HD2      LYS  15  53.326   4.708  -1.148
  147    HD3  LYS  15           HD1      LYS  15  53.661   4.568   0.595
  148    HE2  LYS  15           HE2      LYS  15  52.954   2.163   0.494
  149    HE3  LYS  15           HE1      LYS  15  52.761   2.327  -1.267
  150    HZ1  LYS  15           HZ1      LYS  15  54.996   2.478  -1.587
  151    HZ2  LYS  15           HZ2      LYS  15  55.005   1.507  -0.194
  152    HZ3  LYS  15           HZ3      LYS  15  55.303   3.175  -0.072
  153    H    LYS  16           HN       LYS  16  49.136   6.697   1.953
  154    HA   LYS  16           HA       LYS  16  47.084   4.588   2.481
  155    HB2  LYS  16           HB2      LYS  16  49.166   3.263   2.716
  156    HB3  LYS  16           HB1      LYS  16  49.849   4.559   3.739
  157    HG2  LYS  16           HG2      LYS  16  48.331   4.085   5.528
  158    HG3  LYS  16           HG1      LYS  16  47.267   3.109   4.493
  159    HD2  LYS  16           HD2      LYS  16  50.153   2.241   4.889
  160    HD3  LYS  16           HD1      LYS  16  48.967   1.922   6.172
  161    HE2  LYS  16           HE2      LYS  16  48.382   1.145   3.293
  162    HE3  LYS  16           HE1      LYS  16  49.326   0.084   4.362
  163    HZ1  LYS  16           HZ1      LYS  16  47.030  -0.507   4.511
  164    HZ2  LYS  16           HZ2      LYS  16  46.566   1.097   4.826
  165    HZ3  LYS  16           HZ3      LYS  16  47.472   0.230   5.972
  166    H    LYS  17           HN       LYS  17  49.096   7.029   2.727
  167    HA   LYS  17           HA       LYS  17  48.613   9.145   3.708
  168    HB2  LYS  17           HB2      LYS  17  47.656   7.585   6.024
  169    HB3  LYS  17           HB1      LYS  17  47.733   9.319   5.961
  170    HG2  LYS  17           HG2      LYS  17  45.962   9.559   4.516
  171    HG3  LYS  17           HG1      LYS  17  46.100   7.922   3.874
  172    HD2  LYS  17           HD2      LYS  17  44.128   8.154   5.360
  173    HD3  LYS  17           HD1      LYS  17  45.298   6.997   6.033
  174    HE2  LYS  17           HE2      LYS  17  46.143   8.631   7.593
  175    HE3  LYS  17           HE1      LYS  17  45.240   9.942   6.799
  176    HZ1  LYS  17           HZ1      LYS  17  43.694   7.649   7.743
  177    HZ2  LYS  17           HZ2      LYS  17  43.305   9.303   7.749
  178    HZ3  LYS  17           HZ3      LYS  17  44.343   8.667   8.935
  179    H    GLY  18           HN       GLY  18  50.441   7.973   2.409
  180    HA2  GLY  18           HA1      GLY  18  52.801   7.736   2.532
  181    HA3  GLY  18           HA2      GLY  18  52.686   8.824   3.952
  182    H    ARG  19           HN       ARG  19  50.599   6.502   4.607
  183    HA   ARG  19           HA       ARG  19  51.523   4.171   5.621
  184    HB2  ARG  19           HB2      ARG  19  53.588   5.362   6.409
  185    HB3  ARG  19           HB1      ARG  19  52.481   6.570   7.174
  186    HG2  ARG  19           HG2      ARG  19  53.613   4.732   8.694
  187    HG3  ARG  19           HG1      ARG  19  51.867   4.971   8.878
  188    HD2  ARG  19           HD2      ARG  19  51.364   2.981   7.662
  189    HD3  ARG  19           HD1      ARG  19  53.000   2.892   6.970
  190    HE   ARG  19           HE       ARG  19  53.033   2.719   9.874
  191   HH11  ARG  19          HH11      ARG  19  51.915   0.544  10.452
  192   HH12  ARG  19          HH12      ARG  19  52.565  -0.793   9.565
  193   HH21  ARG  19          HH21      ARG  19  54.125   1.199   7.194
  194   HH22  ARG  19          HH22      ARG  19  53.817  -0.423   7.719
  195    H    LYS  20           HN       LYS  20  50.750   7.606   6.625
  196    HA   LYS  20           HA       LYS  20  48.103   6.885   7.793
  197    HB2  LYS  20           HB2      LYS  20  49.743   5.770   9.479
  198    HB3  LYS  20           HB1      LYS  20  50.264   7.421   9.877
  199    HG2  LYS  20           HG2      LYS  20  47.926   8.022  10.454
  200    HG3  LYS  20           HG1      LYS  20  47.390   6.390   9.999
  201    HD2  LYS  20           HD2      LYS  20  47.612   6.162  12.326
  202    HD3  LYS  20           HD1      LYS  20  49.204   5.596  11.775
  203    HE2  LYS  20           HE2      LYS  20  49.427   7.187  13.659
  204    HE3  LYS  20           HE1      LYS  20  50.140   7.867  12.179
  205    HZ1  LYS  20           HZ1      LYS  20  48.256   9.063  13.742
  206    HZ2  LYS  20           HZ2      LYS  20  47.341   8.453  12.448
  207    HZ3  LYS  20           HZ3      LYS  20  48.644   9.501  12.150
  208    H    ALA  21           HN       ALA  21  49.808   8.322   6.034
  209    HA   ALA  21           HA       ALA  21  49.835  10.453   5.223
  210    HB1  ALA  21           HB1      ALA  21  49.684  12.389   6.551
  211    HB2  ALA  21           HB2      ALA  21  49.169  11.352   7.874
  212    HB3  ALA  21           HB3      ALA  21  48.143  11.517   6.446
  213    H    VAL  22           HN       VAL  22  51.566   8.862   7.129
  214    HA   VAL  22           HA       VAL  22  53.483  10.553   7.979
  215    HB   VAL  22           HB       VAL  22  54.138   7.876   6.729
  216   HG11  VAL  22          HG11      VAL  22  56.273   8.840   6.719
  217   HG12  VAL  22          HG12      VAL  22  56.215   8.196   8.371
  218   HG13  VAL  22          HG13      VAL  22  55.901   9.922   8.085
  219   HG21  VAL  22          HG21      VAL  22  53.989   7.033   8.963
  220   HG22  VAL  22          HG22      VAL  22  52.612   8.154   8.861
  221   HG23  VAL  22          HG23      VAL  22  54.109   8.655   9.676
  222    H    ILE  23           HN       ILE  23  52.274  11.514   5.749
  223    HA   ILE  23           HA       ILE  23  54.767  12.738   4.843
  224    HB   ILE  23           HB       ILE  23  53.003  11.481   2.857
  225   HG12  ILE  23          HG12      ILE  23  54.877  12.074   1.320
  226   HG13  ILE  23          HG11      ILE  23  55.564  13.119   2.573
  227   HG21  ILE  23          HG21      ILE  23  52.813  13.378   1.294
  228   HG22  ILE  23          HG22      ILE  23  53.523  14.468   2.496
  229   HG23  ILE  23          HG23      ILE  23  51.924  13.737   2.792
  230   HD11  ILE  23           HD1      ILE  23  56.341  10.515   2.247
  231   HD12  ILE  23           HD2      ILE  23  55.022  10.281   3.418
  232   HD13  ILE  23           HD3      ILE  23  56.387  11.347   3.817
  233    H    ALA  24           HN       ALA  24  52.650  12.279   6.499
  234    HA   ALA  24           HA       ALA  24  52.491  15.071   7.396
  235    HB1  ALA  24           HB1      ALA  24  49.666  14.581   7.224
  236    HB2  ALA  24           HB2      ALA  24  50.342  14.356   5.588
  237    HB3  ALA  24           HB3      ALA  24  50.597  15.883   6.452
  238    H    TRP  25           HN       TRP  25  50.922  11.735   7.394
  239    HA   TRP  25           HA       TRP  25  50.914  10.348   9.291
  240    HB2  TRP  25           HB2      TRP  25  52.622  10.486  10.812
  241    HB3  TRP  25           HB1      TRP  25  53.149  11.886   9.869
  242    HD1  TRP  25           HD1      TRP  25  53.549  13.971  11.257
  243    HE1  TRP  25           HE1      TRP  25  52.752  14.921  13.538
  244    HE3  TRP  25           HE3      TRP  25  50.243  10.281  12.568
  245    HZ2  TRP  25           HZ2      TRP  25  50.935  14.161  15.629
  246    HZ3  TRP  25           HZ3      TRP  25  48.993  10.417  14.717
  247    HH2  TRP  25           HH2      TRP  25  49.338  12.350  16.248
  Start of MODEL    5
    1    H1   ALA   1           HT1      ALA   1  42.993  17.909  -0.670
    2    H2   ALA   1           HT2      ALA   1  43.980  17.225   0.532
    3    H3   ALA   1           HT3      ALA   1  42.947  16.237  -0.388
    4    HA   ALA   1           HA       ALA   1  45.438  17.567  -1.170
    5    HB1  ALA   1           HB1      ALA   1  45.797  15.256  -2.165
    6    HB2  ALA   1           HB2      ALA   1  44.301  14.762  -1.333
    7    HB3  ALA   1           HB3      ALA   1  45.702  15.321  -0.387
    8    H    GLY   2           HN       GLY   2  45.844  16.433  -3.564
    9    HA2  GLY   2           HA1      GLY   2  44.075  18.004  -5.277
   10    HA3  GLY   2           HA2      GLY   2  45.471  17.031  -5.780
   11    H    LYS   3           HN       LYS   3  45.178  14.583  -5.525
   12    HA   LYS   3           HA       LYS   3  43.006  13.001  -5.415
   13    HB2  LYS   3           HB2      LYS   3  41.399  14.271  -6.629
   14    HB3  LYS   3           HB1      LYS   3  42.585  14.776  -7.852
   15    HG2  LYS   3           HG2      LYS   3  42.586  12.632  -8.894
   16    HG3  LYS   3           HG1      LYS   3  41.805  11.855  -7.500
   17    HD2  LYS   3           HD2      LYS   3  40.347  14.079  -8.978
   18    HD3  LYS   3           HD1      LYS   3  40.378  12.445  -9.674
   19    HE2  LYS   3           HE2      LYS   3  39.475  11.548  -7.501
   20    HE3  LYS   3           HE1      LYS   3  39.327  13.222  -6.915
   21    HZ1  LYS   3           HZ1      LYS   3  38.092  12.298  -9.451
   22    HZ2  LYS   3           HZ2      LYS   3  37.764  13.720  -8.580
   23    HZ3  LYS   3           HZ3      LYS   3  37.285  12.212  -7.961
   24    H    GLU   4           HN       GLU   4  45.334  14.431  -7.398
   25    HA   GLU   4           HA       GLU   4  46.878  11.997  -7.658
   26    HB2  GLU   4           HB2      GLU   4  47.054  12.241 -10.198
   27    HB3  GLU   4           HB1      GLU   4  45.493  11.597  -9.637
   28    HG2  GLU   4           HG2      GLU   4  44.491  13.849  -9.797
   29    HG3  GLU   4           HG1      GLU   4  46.055  14.518 -10.322
   30    H    LYS   5           HN       LYS   5  47.277  13.900  -6.188
   31    HA   LYS   5           HA       LYS   5  48.686  16.191  -7.167
   32    HB2  LYS   5           HB2      LYS   5  47.713  15.732  -4.851
   33    HB3  LYS   5           HB1      LYS   5  49.064  14.591  -4.605
   34    HG2  LYS   5           HG2      LYS   5  50.683  16.329  -4.579
   35    HG3  LYS   5           HG1      LYS   5  49.624  17.474  -5.435
   36    HD2  LYS   5           HD2      LYS   5  48.152  17.586  -3.432
   37    HD3  LYS   5           HD1      LYS   5  49.243  16.466  -2.580
   38    HE2  LYS   5           HE2      LYS   5  51.110  18.083  -2.863
   39    HE3  LYS   5           HE1      LYS   5  49.999  19.209  -3.680
   40    HZ1  LYS   5           HZ1      LYS   5  48.763  18.454  -1.316
   41    HZ2  LYS   5           HZ2      LYS   5  49.448  19.965  -1.685
   42    HZ3  LYS   5           HZ3      LYS   5  50.378  18.775  -0.904
   43    H    ILE   6           HN       ILE   6  49.177  13.232  -7.997
   44    HA   ILE   6           HA       ILE   6  50.916  11.982  -8.671
   45    HB   ILE   6           HB       ILE   6  52.877  14.177  -7.866
   46   HG12  ILE   6          HG12      ILE   6  50.981  15.089  -9.366
   47   HG13  ILE   6          HG11      ILE   6  52.632  15.293  -9.971
   48   HG21  ILE   6          HG21      ILE   6  54.100  13.211  -9.915
   49   HG22  ILE   6          HG22      ILE   6  52.923  11.880  -9.860
   50   HG23  ILE   6          HG23      ILE   6  54.008  12.167  -8.481
   51   HD11  ILE   6           HD1      ILE   6  50.917  14.473 -11.679
   52   HD12  ILE   6           HD2      ILE   6  50.865  12.945 -10.777
   53   HD13  ILE   6           HD3      ILE   6  52.383  13.479 -11.533
   54    H    ARG   7           HN       ARG   7  49.682  12.428  -5.961
   55    HA   ARG   7           HA       ARG   7  51.575  10.605  -4.743
   56    HB2  ARG   7           HB2      ARG   7  50.775  12.952  -3.292
   57    HB3  ARG   7           HB1      ARG   7  51.812  11.619  -2.759
   58    HG2  ARG   7           HG2      ARG   7  53.532  12.350  -4.479
   59    HG3  ARG   7           HG1      ARG   7  52.490  13.734  -4.880
   60    HD2  ARG   7           HD2      ARG   7  52.640  14.470  -2.484
   61    HD3  ARG   7           HD1      ARG   7  53.821  13.170  -2.203
   62    HE   ARG   7           HE       ARG   7  54.610  14.820  -4.447
   63   HH11  ARG   7          HH11      ARG   7  53.860  15.700  -1.301
   64   HH12  ARG   7          HH12      ARG   7  55.433  16.305  -0.905
   65   HH21  ARG   7          HH21      ARG   7  56.903  15.150  -3.825
   66   HH22  ARG   7          HH22      ARG   7  57.157  15.993  -2.334
   67    H    LYS   8           HN       LYS   8  48.810  12.257  -4.989
   68    HA   LYS   8           HA       LYS   8  47.310  11.017  -2.711
   69    HB2  LYS   8           HB2      LYS   8  47.473  13.327  -3.537
   70    HB3  LYS   8           HB1      LYS   8  46.816  12.653  -5.003
   71    HG2  LYS   8           HG2      LYS   8  45.475  12.934  -2.263
   72    HG3  LYS   8           HG1      LYS   8  44.896  13.643  -3.777
   73    HD2  LYS   8           HD2      LYS   8  44.444  11.313  -4.632
   74    HD3  LYS   8           HD1      LYS   8  44.939  10.681  -3.044
   75    HE2  LYS   8           HE2      LYS   8  42.805  12.819  -3.096
   76    HE3  LYS   8           HE1      LYS   8  42.363  11.159  -3.561
   77    HZ1  LYS   8           HZ1      LYS   8  43.408  12.156  -0.987
   78    HZ2  LYS   8           HZ2      LYS   8  43.645  10.532  -1.429
   79    HZ3  LYS   8           HZ3      LYS   8  42.071  11.157  -1.290
   80    H    LYS   9           HN       LYS   9  48.510  11.411  -5.700
   81    HA   LYS   9           HA       LYS   9  47.045   9.623  -7.484
   82    HB2  LYS   9           HB2      LYS   9  49.102  11.016  -8.076
   83    HB3  LYS   9           HB1      LYS   9  50.062  10.035  -6.879
   84    HG2  LYS   9           HG2      LYS   9  49.596   8.008  -8.199
   85    HG3  LYS   9           HG1      LYS   9  48.554   8.909  -9.327
   86    HD2  LYS   9           HD2      LYS   9  50.417  10.197 -10.154
   87    HD3  LYS   9           HD1      LYS   9  51.487   9.588  -8.867
   88    HE2  LYS   9           HE2      LYS   9  51.445   7.351  -9.783
   89    HE3  LYS   9           HE1      LYS   9  50.161   7.786 -10.935
   90    HZ1  LYS   9           HZ1      LYS   9  52.252   7.805 -12.065
   91    HZ2  LYS   9           HZ2      LYS   9  52.955   8.814 -10.893
   92    HZ3  LYS   9           HZ3      LYS   9  51.734   9.412 -11.909
   93    H    LEU  10           HN       LEU  10  48.597  10.321  -4.550
   94    HA   LEU  10           HA       LEU  10  48.460   8.584  -2.638
   95    HB2  LEU  10           HB2      LEU  10  46.987   7.094  -4.235
   96    HB3  LEU  10           HB1      LEU  10  48.484   6.184  -4.517
   97    HG   LEU  10           HG       LEU  10  48.442   6.394  -1.728
   98   HD11  LEU  10          HD11      LEU  10  46.101   7.302  -1.839
   99   HD12  LEU  10          HD12      LEU  10  46.187   5.738  -1.001
  100   HD13  LEU  10          HD13      LEU  10  45.597   5.819  -2.676
  101   HD21  LEU  10          HD21      LEU  10  47.560   3.963  -1.871
  102   HD22  LEU  10          HD22      LEU  10  49.036   4.338  -2.792
  103   HD23  LEU  10          HD23      LEU  10  47.469   4.229  -3.628
  104    H    LYS  11           HN       LYS  11  50.954   9.468  -4.349
  105    HA   LYS  11           HA       LYS  11  52.804   7.187  -4.134
  106    HB2  LYS  11           HB2      LYS  11  53.294  10.166  -3.705
  107    HB3  LYS  11           HB1      LYS  11  54.596   8.948  -3.734
  108    HG2  LYS  11           HG2      LYS  11  52.718   9.298  -6.126
  109    HG3  LYS  11           HG1      LYS  11  54.270  10.152  -5.959
  110    HD2  LYS  11           HD2      LYS  11  55.316   7.802  -5.610
  111    HD3  LYS  11           HD1      LYS  11  53.776   7.166  -6.231
  112    HE2  LYS  11           HE2      LYS  11  54.042   8.497  -8.295
  113    HE3  LYS  11           HE1      LYS  11  55.580   9.152  -7.678
  114    HZ1  LYS  11           HZ1      LYS  11  56.081   6.591  -7.401
  115    HZ2  LYS  11           HZ2      LYS  11  56.355   7.398  -8.872
  116    HZ3  LYS  11           HZ3      LYS  11  54.952   6.462  -8.661
  117    H    ASN  12           HN       ASN  12  51.708   9.867  -2.164
  118    HA   ASN  12           HA       ASN  12  51.949   8.350   0.278
  119    HB2  ASN  12           HB2      ASN  12  53.945   9.658   1.256
  120    HB3  ASN  12           HB1      ASN  12  54.302   8.315   0.163
  121   HD21  ASN  12          HD21      ASN  12  56.395   9.831   0.054
  122   HD22  ASN  12          HD22      ASN  12  56.369  11.006  -1.266
  123    H    GLU  13           HN       GLU  13  50.965  10.813  -1.432
  124    HA   GLU  13           HA       GLU  13  50.676  12.848   0.699
  125    HB2  GLU  13           HB2      GLU  13  50.065  13.766  -1.401
  126    HB3  GLU  13           HB1      GLU  13  49.014  12.394  -1.805
  127    HG2  GLU  13           HG2      GLU  13  47.805  14.522  -1.142
  128    HG3  GLU  13           HG1      GLU  13  47.366  13.096  -0.177
  129    H    ILE  14           HN       ILE  14  49.239   9.924  -0.417
  130    HA   ILE  14           HA       ILE  14  48.224   9.440   2.243
  131    HB   ILE  14           HB       ILE  14  46.191  10.474   1.621
  132   HG12  ILE  14          HG12      ILE  14  45.360   7.751   0.605
  133   HG13  ILE  14          HG11      ILE  14  46.175   7.785   2.183
  134   HG21  ILE  14          HG21      ILE  14  45.125   9.708  -0.709
  135   HG22  ILE  14          HG22      ILE  14  46.825   9.388  -1.118
  136   HG23  ILE  14          HG23      ILE  14  46.320  11.020  -0.626
  137   HD11  ILE  14           HD1      ILE  14  44.531   9.385   3.040
  138   HD12  ILE  14           HD2      ILE  14  43.682   7.979   2.355
  139   HD13  ILE  14           HD3      ILE  14  43.766   9.502   1.439
  140    H    LYS  15           HN       LYS  15  50.366   8.339   1.263
  141    HA   LYS  15           HA       LYS  15  50.388   6.383  -0.452
  142    HB2  LYS  15           HB2      LYS  15  52.408   6.528   0.883
  143    HB3  LYS  15           HB1      LYS  15  51.445   5.902   2.231
  144    HG2  LYS  15           HG2      LYS  15  51.315   3.731   1.248
  145    HG3  LYS  15           HG1      LYS  15  51.859   4.331  -0.336
  146    HD2  LYS  15           HD2      LYS  15  54.084   4.862   0.644
  147    HD3  LYS  15           HD1      LYS  15  53.533   4.231   2.215
  148    HE2  LYS  15           HE2      LYS  15  54.825   2.519   0.976
  149    HE3  LYS  15           HE1      LYS  15  53.132   2.013   1.187
  150    HZ1  LYS  15           HZ1      LYS  15  52.636   2.639  -1.031
  151    HZ2  LYS  15           HZ2      LYS  15  54.056   1.710  -1.100
  152    HZ3  LYS  15           HZ3      LYS  15  54.136   3.401  -1.243
  153    H    LYS  16           HN       LYS  16  49.467   6.418   2.153
  154    HA   LYS  16           HA       LYS  16  47.207   4.352   1.959
  155    HB2  LYS  16           HB2      LYS  16  49.221   3.033   2.401
  156    HB3  LYS  16           HB1      LYS  16  49.773   4.293   3.565
  157    HG2  LYS  16           HG2      LYS  16  48.255   3.582   5.230
  158    HG3  LYS  16           HG1      LYS  16  47.122   2.860   4.066
  159    HD2  LYS  16           HD2      LYS  16  49.901   1.668   4.389
  160    HD3  LYS  16           HD1      LYS  16  48.642   1.293   5.585
  161    HE2  LYS  16           HE2      LYS  16  47.145   0.521   3.736
  162    HE3  LYS  16           HE1      LYS  16  48.457   0.823   2.573
  163    HZ1  LYS  16           HZ1      LYS  16  49.713  -0.661   4.407
  164    HZ2  LYS  16           HZ2      LYS  16  48.962  -1.303   3.025
  165    HZ3  LYS  16           HZ3      LYS  16  48.152  -1.312   4.518
  166    H    LYS  17           HN       LYS  17  48.964   6.834   2.839
  167    HA   LYS  17           HA       LYS  17  48.039   8.750   4.188
  168    HB2  LYS  17           HB2      LYS  17  47.747   6.497   6.121
  169    HB3  LYS  17           HB1      LYS  17  47.720   8.208   6.526
  170    HG2  LYS  17           HG2      LYS  17  45.660   8.647   5.610
  171    HG3  LYS  17           HG1      LYS  17  45.747   7.311   4.460
  172    HD2  LYS  17           HD2      LYS  17  45.565   5.720   6.464
  173    HD3  LYS  17           HD1      LYS  17  45.236   7.155   7.460
  174    HE2  LYS  17           HE2      LYS  17  43.286   7.706   6.066
  175    HE3  LYS  17           HE1      LYS  17  43.633   6.320   5.005
  176    HZ1  LYS  17           HZ1      LYS  17  43.480   5.655   7.811
  177    HZ2  LYS  17           HZ2      LYS  17  42.767   4.892   6.471
  178    HZ3  LYS  17           HZ3      LYS  17  42.025   6.250   7.174
  179    H    GLY  18           HN       GLY  18  50.092   7.855   2.529
  180    HA2  GLY  18           HA1      GLY  18  52.469   7.957   2.673
  181    HA3  GLY  18           HA2      GLY  18  52.167   9.016   4.092
  182    H    ARG  19           HN       ARG  19  50.554   6.265   4.663
  183    HA   ARG  19           HA       ARG  19  51.699   4.172   5.801
  184    HB2  ARG  19           HB2      ARG  19  52.734   6.691   7.061
  185    HB3  ARG  19           HB1      ARG  19  52.693   5.179   8.006
  186    HG2  ARG  19           HG2      ARG  19  54.045   4.887   5.316
  187    HG3  ARG  19           HG1      ARG  19  54.927   5.852   6.520
  188    HD2  ARG  19           HD2      ARG  19  54.904   4.025   8.108
  189    HD3  ARG  19           HD1      ARG  19  53.802   3.079   7.079
  190    HE   ARG  19           HE       ARG  19  56.003   3.541   5.448
  191   HH11  ARG  19          HH11      ARG  19  57.980   3.587   7.437
  192   HH12  ARG  19          HH12      ARG  19  58.234   1.936   7.891
  193   HH21  ARG  19          HH21      ARG  19  55.243   0.823   6.533
  194   HH22  ARG  19          HH22      ARG  19  56.685   0.371   7.379
  195    H    LYS  20           HN       LYS  20  50.910   7.552   6.831
  196    HA   LYS  20           HA       LYS  20  48.327   6.831   8.152
  197    HB2  LYS  20           HB2      LYS  20  50.096   5.771   9.772
  198    HB3  LYS  20           HB1      LYS  20  50.566   7.446  10.119
  199    HG2  LYS  20           HG2      LYS  20  48.946   7.120  11.775
  200    HG3  LYS  20           HG1      LYS  20  47.937   7.790  10.475
  201    HD2  LYS  20           HD2      LYS  20  47.320   5.480   9.775
  202    HD3  LYS  20           HD1      LYS  20  48.329   4.822  11.084
  203    HE2  LYS  20           HE2      LYS  20  45.890   6.623  11.405
  204    HE3  LYS  20           HE1      LYS  20  45.994   4.896  11.821
  205    HZ1  LYS  20           HZ1      LYS  20  46.487   5.757  13.836
  206    HZ2  LYS  20           HZ2      LYS  20  47.079   7.223  13.212
  207    HZ3  LYS  20           HZ3      LYS  20  48.056   5.832  13.194
  208    H    ALA  21           HN       ALA  21  49.761   8.181   6.240
  209    HA   ALA  21           HA       ALA  21  49.906  10.278   5.332
  210    HB1  ALA  21           HB1      ALA  21  49.630  12.250   6.515
  211    HB2  ALA  21           HB2      ALA  21  49.153  11.292   7.923
  212    HB3  ALA  21           HB3      ALA  21  48.127  11.294   6.482
  213    H    VAL  22           HN       VAL  22  51.590   8.806   7.408
  214    HA   VAL  22           HA       VAL  22  53.394  10.660   8.228
  215    HB   VAL  22           HB       VAL  22  54.429   8.028   7.146
  216   HG11  VAL  22          HG11      VAL  22  56.407   9.124   7.644
  217   HG12  VAL  22          HG12      VAL  22  56.014   8.590   9.289
  218   HG13  VAL  22          HG13      VAL  22  55.627  10.248   8.782
  219   HG21  VAL  22          HG21      VAL  22  53.879   7.006   9.217
  220   HG22  VAL  22          HG22      VAL  22  52.462   8.038   8.929
  221   HG23  VAL  22          HG23      VAL  22  53.727   8.569  10.055
  222    H    ILE  23           HN       ILE  23  52.293  11.437   5.875
  223    HA   ILE  23           HA       ILE  23  54.848  12.522   4.917
  224    HB   ILE  23           HB       ILE  23  53.289  10.910   3.093
  225   HG12  ILE  23          HG12      ILE  23  55.114  11.660   1.441
  226   HG13  ILE  23          HG11      ILE  23  55.733  12.700   2.737
  227   HG21  ILE  23          HG21      ILE  23  53.455  13.841   2.270
  228   HG22  ILE  23          HG22      ILE  23  51.953  12.981   2.690
  229   HG23  ILE  23          HG23      ILE  23  52.898  12.499   1.259
  230   HD11  ILE  23           HD1      ILE  23  56.332  10.859   4.100
  231   HD12  ILE  23           HD2      ILE  23  56.784  10.332   2.466
  232   HD13  ILE  23           HD3      ILE  23  55.287   9.729   3.209
  233    H    ALA  24           HN       ALA  24  52.590  12.290   6.428
  234    HA   ALA  24           HA       ALA  24  52.329  15.198   6.909
  235    HB1  ALA  24           HB1      ALA  24  49.547  14.521   6.815
  236    HB2  ALA  24           HB2      ALA  24  50.241  14.043   5.243
  237    HB3  ALA  24           HB3      ALA  24  50.405  15.714   5.814
  238    H    TRP  25           HN       TRP  25  50.915  11.851   7.340
  239    HA   TRP  25           HA       TRP  25  51.052  10.644   9.321
  240    HB2  TRP  25           HB2      TRP  25  52.721  11.047  10.828
  241    HB3  TRP  25           HB1      TRP  25  53.139  12.413   9.786
  242    HD1  TRP  25           HD1      TRP  25  53.326  14.630  11.022
  243    HE1  TRP  25           HE1      TRP  25  52.414  15.659  13.227
  244    HE3  TRP  25           HE3      TRP  25  50.362  10.747  12.564
  245    HZ2  TRP  25           HZ2      TRP  25  50.645  14.874  15.356
  246    HZ3  TRP  25           HZ3      TRP  25  49.076  10.909  14.687
  247    HH2  TRP  25           HH2      TRP  25  49.216  12.965  16.086
  Start of MODEL    6
    1    H1   ALA   1           HT1      ALA   1  46.560  18.339  -6.649
    2    H2   ALA   1           HT2      ALA   1  45.512  19.647  -6.371
    3    H3   ALA   1           HT3      ALA   1  46.101  19.342  -7.935
    4    HA   ALA   1           HA       ALA   1  43.797  18.660  -7.629
    5    HB1  ALA   1           HB1      ALA   1  45.487  17.579  -9.228
    6    HB2  ALA   1           HB2      ALA   1  44.046  16.620  -8.808
    7    HB3  ALA   1           HB3      ALA   1  45.609  16.265  -8.034
    8    H    GLY   2           HN       GLY   2  43.028  16.110  -7.180
    9    HA2  GLY   2           HA1      GLY   2  43.681  15.353  -4.403
   10    HA3  GLY   2           HA2      GLY   2  42.045  15.980  -4.662
   11    H    LYS   3           HN       LYS   3  44.394  13.604  -6.049
   12    HA   LYS   3           HA       LYS   3  42.904  11.280  -5.736
   13    HB2  LYS   3           HB2      LYS   3  40.954  11.943  -6.904
   14    HB3  LYS   3           HB1      LYS   3  41.870  12.907  -8.085
   15    HG2  LYS   3           HG2      LYS   3  42.618  10.935  -9.244
   16    HG3  LYS   3           HG1      LYS   3  42.085   9.870  -7.918
   17    HD2  LYS   3           HD2      LYS   3  39.729  10.482  -8.364
   18    HD3  LYS   3           HD1      LYS   3  40.253  11.565  -9.676
   19    HE2  LYS   3           HE2      LYS   3  41.225   9.654 -10.893
   20    HE3  LYS   3           HE1      LYS   3  40.760   8.558  -9.569
   21    HZ1  LYS   3           HZ1      LYS   3  38.521  10.079 -10.373
   22    HZ2  LYS   3           HZ2      LYS   3  38.742   8.395 -10.431
   23    HZ3  LYS   3           HZ3      LYS   3  39.215   9.363 -11.745
   24    H    GLU   4           HN       GLU   4  44.787  13.427  -7.617
   25    HA   GLU   4           HA       GLU   4  46.871  11.442  -7.948
   26    HB2  GLU   4           HB2      GLU   4  47.046  11.768 -10.441
   27    HB3  GLU   4           HB1      GLU   4  45.650  10.795  -9.928
   28    HG2  GLU   4           HG2      GLU   4  44.220  12.852 -10.041
   29    HG3  GLU   4           HG1      GLU   4  45.622  13.758 -10.661
   30    H    LYS   5           HN       LYS   5  46.765  13.448  -6.458
   31    HA   LYS   5           HA       LYS   5  47.879  15.887  -7.484
   32    HB2  LYS   5           HB2      LYS   5  46.739  15.648  -5.304
   33    HB3  LYS   5           HB1      LYS   5  48.018  14.498  -4.792
   34    HG2  LYS   5           HG2      LYS   5  49.569  16.205  -4.423
   35    HG3  LYS   5           HG1      LYS   5  48.953  17.214  -5.754
   36    HD2  LYS   5           HD2      LYS   5  47.108  17.998  -4.415
   37    HD3  LYS   5           HD1      LYS   5  47.434  16.793  -3.147
   38    HE2  LYS   5           HE2      LYS   5  49.367  19.007  -3.959
   39    HE3  LYS   5           HE1      LYS   5  48.271  19.088  -2.559
   40    HZ1  LYS   5           HZ1      LYS   5  49.523  16.670  -2.309
   41    HZ2  LYS   5           HZ2      LYS   5  49.892  18.083  -1.440
   42    HZ3  LYS   5           HZ3      LYS   5  50.760  17.697  -2.848
   43    H    ILE   6           HN       ILE   6  48.926  13.055  -8.079
   44    HA   ILE   6           HA       ILE   6  50.946  12.098  -8.426
   45    HB   ILE   6           HB       ILE   6  52.411  14.578  -7.424
   46   HG12  ILE   6          HG12      ILE   6  51.110  14.173 -10.163
   47   HG13  ILE   6          HG11      ILE   6  50.780  15.485  -9.014
   48   HG21  ILE   6          HG21      ILE   6  53.542  12.329  -8.089
   49   HG22  ILE   6          HG22      ILE   6  54.180  13.811  -8.827
   50   HG23  ILE   6          HG23      ILE   6  53.102  12.746  -9.759
   51   HD11  ILE   6           HD1      ILE   6  53.293  16.073  -9.229
   52   HD12  ILE   6           HD2      ILE   6  52.242  16.457 -10.613
   53   HD13  ILE   6           HD3      ILE   6  53.284  15.015 -10.660
   54    H    ARG   7           HN       ARG   7  49.256  12.418  -5.879
   55    HA   ARG   7           HA       ARG   7  51.155  10.930  -4.330
   56    HB2  ARG   7           HB2      ARG   7  49.977  13.206  -3.075
   57    HB3  ARG   7           HB1      ARG   7  51.168  12.070  -2.461
   58    HG2  ARG   7           HG2      ARG   7  52.883  13.038  -3.995
   59    HG3  ARG   7           HG1      ARG   7  51.669  14.197  -4.595
   60    HD2  ARG   7           HD2      ARG   7  51.424  15.085  -2.283
   61    HD3  ARG   7           HD1      ARG   7  52.710  13.980  -1.744
   62    HE   ARG   7           HE       ARG   7  53.092  16.458  -3.245
   63   HH11  ARG   7          HH11      ARG   7  54.838  15.957  -4.963
   64   HH12  ARG   7          HH12      ARG   7  56.236  15.183  -4.294
   65   HH21  ARG   7          HH21      ARG   7  54.662  14.311  -1.331
   66   HH22  ARG   7          HH22      ARG   7  56.136  14.251  -2.237
   67    H    LYS   8           HN       LYS   8  48.369  12.083  -5.076
   68    HA   LYS   8           HA       LYS   8  46.535  10.863  -3.008
   69    HB2  LYS   8           HB2      LYS   8  46.945  12.578  -5.188
   70    HB3  LYS   8           HB1      LYS   8  45.242  12.111  -4.961
   71    HG2  LYS   8           HG2      LYS   8  46.981  13.566  -2.890
   72    HG3  LYS   8           HG1      LYS   8  45.659  14.312  -3.804
   73    HD2  LYS   8           HD2      LYS   8  44.283  12.203  -2.760
   74    HD3  LYS   8           HD1      LYS   8  45.528  12.374  -1.503
   75    HE2  LYS   8           HE2      LYS   8  43.341  14.298  -2.308
   76    HE3  LYS   8           HE1      LYS   8  43.896  13.835  -0.682
   77    HZ1  LYS   8           HZ1      LYS   8  46.003  15.073  -2.106
   78    HZ2  LYS   8           HZ2      LYS   8  45.251  15.568  -0.665
   79    HZ3  LYS   8           HZ3      LYS   8  44.631  16.069  -2.165
   80    H    LYS   9           HN       LYS   9  48.366  11.247  -5.667
   81    HA   LYS   9           HA       LYS   9  47.380   9.186  -7.561
   82    HB2  LYS   9           HB2      LYS   9  49.238  10.902  -7.970
   83    HB3  LYS   9           HB1      LYS   9  50.185  10.097  -6.657
   84    HG2  LYS   9           HG2      LYS   9  51.039   9.094  -8.640
   85    HG3  LYS   9           HG1      LYS   9  49.817   7.918  -8.112
   86    HD2  LYS   9           HD2      LYS   9  48.202   8.807  -9.727
   87    HD3  LYS   9           HD1      LYS   9  49.328  10.104 -10.188
   88    HE2  LYS   9           HE2      LYS   9  50.979   8.312 -10.880
   89    HE3  LYS   9           HE1      LYS   9  49.696   7.109 -10.607
   90    HZ1  LYS   9           HZ1      LYS   9  49.803   7.823 -12.925
   91    HZ2  LYS   9           HZ2      LYS   9  49.519   9.433 -12.463
   92    HZ3  LYS   9           HZ3      LYS   9  48.321   8.253 -12.222
   93    H    LEU  10           HN       LEU  10  48.434  10.225  -4.519
   94    HA   LEU  10           HA       LEU  10  48.504   8.585  -2.525
   95    HB2  LEU  10           HB2      LEU  10  48.604   6.141  -4.366
   96    HB3  LEU  10           HB1      LEU  10  48.534   6.133  -2.617
   97    HG   LEU  10           HG       LEU  10  46.297   7.709  -3.314
   98   HD11  LEU  10          HD11      LEU  10  46.342   6.999  -5.684
   99   HD12  LEU  10          HD12      LEU  10  45.021   6.153  -4.871
  100   HD13  LEU  10          HD13      LEU  10  46.550   5.308  -5.198
  101   HD21  LEU  10          HD21      LEU  10  46.392   4.717  -2.749
  102   HD22  LEU  10          HD22      LEU  10  44.982   5.779  -2.531
  103   HD23  LEU  10          HD23      LEU  10  46.422   5.995  -1.522
  104    H    LYS  11           HN       LYS  11  50.809   9.759  -4.009
  105    HA   LYS  11           HA       LYS  11  52.940   7.687  -3.834
  106    HB2  LYS  11           HB2      LYS  11  52.997  10.731  -3.664
  107    HB3  LYS  11           HB1      LYS  11  54.472   9.703  -3.753
  108    HG2  LYS  11           HG2      LYS  11  52.358   9.842  -5.960
  109    HG3  LYS  11           HG1      LYS  11  53.989  10.539  -6.009
  110    HD2  LYS  11           HD2      LYS  11  54.744   8.041  -5.482
  111    HD3  LYS  11           HD1      LYS  11  53.144   7.635  -6.150
  112    HE2  LYS  11           HE2      LYS  11  54.640   7.571  -8.008
  113    HE3  LYS  11           HE1      LYS  11  53.774   9.118  -8.158
  114    HZ1  LYS  11           HZ1      LYS  11  56.440   8.875  -8.203
  115    HZ2  LYS  11           HZ2      LYS  11  56.192   9.196  -6.553
  116    HZ3  LYS  11           HZ3      LYS  11  55.628  10.286  -7.728
  117    H    ASN  12           HN       ASN  12  51.782  10.463  -2.076
  118    HA   ASN  12           HA       ASN  12  52.913   9.338   0.507
  119    HB2  ASN  12           HB2      ASN  12  53.973  11.719  -1.017
  120    HB3  ASN  12           HB1      ASN  12  54.213  11.561   0.728
  121   HD21  ASN  12          HD21      ASN  12  56.041  11.262  -1.859
  122   HD22  ASN  12          HD22      ASN  12  56.915   9.766  -1.518
  123    H    GLU  13           HN       GLU  13  50.732  11.137  -1.266
  124    HA   GLU  13           HA       GLU  13  50.106  12.974   1.066
  125    HB2  GLU  13           HB2      GLU  13  49.450  13.899  -1.068
  126    HB3  GLU  13           HB1      GLU  13  48.496  12.449  -1.466
  127    HG2  GLU  13           HG2      GLU  13  47.112  14.395  -0.679
  128    HG3  GLU  13           HG1      GLU  13  46.913  12.945   0.324
  129    H    ILE  14           HN       ILE  14  49.342   9.951  -0.348
  130    HA   ILE  14           HA       ILE  14  48.299   9.056   2.144
  131    HB   ILE  14           HB       ILE  14  46.177   9.936   1.572
  132   HG12  ILE  14          HG12      ILE  14  45.665   7.225   0.342
  133   HG13  ILE  14          HG11      ILE  14  46.445   7.224   1.936
  134   HG21  ILE  14          HG21      ILE  14  45.167   9.712  -0.648
  135   HG22  ILE  14          HG22      ILE  14  46.573   8.779  -1.212
  136   HG23  ILE  14          HG23      ILE  14  46.762  10.489  -0.754
  137   HD11  ILE  14           HD1      ILE  14  43.962   7.134   2.101
  138   HD12  ILE  14           HD2      ILE  14  43.861   8.691   1.245
  139   HD13  ILE  14           HD3      ILE  14  44.623   8.606   2.852
  140    H    LYS  15           HN       LYS  15  50.484   8.153   1.371
  141    HA   LYS  15           HA       LYS  15  50.406   6.315  -0.614
  142    HB2  LYS  15           HB2      LYS  15  52.546   7.063   0.362
  143    HB3  LYS  15           HB1      LYS  15  52.134   6.002   1.728
  144    HG2  LYS  15           HG2      LYS  15  52.208   4.036   0.295
  145    HG3  LYS  15           HG1      LYS  15  52.440   5.051  -1.150
  146    HD2  LYS  15           HD2      LYS  15  54.596   5.850  -0.280
  147    HD3  LYS  15           HD1      LYS  15  54.360   4.915   1.217
  148    HE2  LYS  15           HE2      LYS  15  54.339   2.815  -0.083
  149    HE3  LYS  15           HE1      LYS  15  54.549   3.738  -1.591
  150    HZ1  LYS  15           HZ1      LYS  15  56.657   2.883  -0.771
  151    HZ2  LYS  15           HZ2      LYS  15  56.447   3.698   0.705
  152    HZ3  LYS  15           HZ3      LYS  15  56.649   4.578  -0.735
  153    H    LYS  16           HN       LYS  16  49.474   6.399   1.980
  154    HA   LYS  16           HA       LYS  16  47.697   3.986   1.929
  155    HB2  LYS  16           HB2      LYS  16  49.870   3.030   2.550
  156    HB3  LYS  16           HB1      LYS  16  50.136   4.415   3.676
  157    HG2  LYS  16           HG2      LYS  16  48.615   3.546   5.273
  158    HG3  LYS  16           HG1      LYS  16  47.718   2.586   4.072
  159    HD2  LYS  16           HD2      LYS  16  49.555   0.989   3.902
  160    HD3  LYS  16           HD1      LYS  16  50.576   1.993   4.960
  161    HE2  LYS  16           HE2      LYS  16  47.897   0.833   5.824
  162    HE3  LYS  16           HE1      LYS  16  49.457   0.030   6.122
  163    HZ1  LYS  16           HZ1      LYS  16  50.167   2.155   7.213
  164    HZ2  LYS  16           HZ2      LYS  16  48.946   1.306   8.032
  165    HZ3  LYS  16           HZ3      LYS  16  48.558   2.683   7.117
  166    H    LYS  17           HN       LYS  17  49.022   6.765   2.741
  167    HA   LYS  17           HA       LYS  17  47.905   8.640   3.983
  168    HB2  LYS  17           HB2      LYS  17  47.595   6.462   5.996
  169    HB3  LYS  17           HB1      LYS  17  47.372   8.207   6.254
  170    HG2  LYS  17           HG2      LYS  17  45.336   8.310   5.148
  171    HG3  LYS  17           HG1      LYS  17  45.669   6.899   4.134
  172    HD2  LYS  17           HD2      LYS  17  45.465   5.436   6.166
  173    HD3  LYS  17           HD1      LYS  17  45.027   6.877   7.116
  174    HE2  LYS  17           HE2      LYS  17  42.959   5.830   6.462
  175    HE3  LYS  17           HE1      LYS  17  43.145   7.273   5.436
  176    HZ1  LYS  17           HZ1      LYS  17  44.360   4.862   4.383
  177    HZ2  LYS  17           HZ2      LYS  17  43.401   6.029   3.606
  178    HZ3  LYS  17           HZ3      LYS  17  42.670   4.793   4.514
  179    H    GLY  18           HN       GLY  18  50.095   7.969   2.577
  180    HA2  GLY  18           HA1      GLY  18  52.441   7.936   3.019
  181    HA3  GLY  18           HA2      GLY  18  51.993   9.005   4.401
  182    H    ARG  19           HN       ARG  19  50.322   6.160   4.615
  183    HA   ARG  19           HA       ARG  19  51.143   4.088   5.920
  184    HB2  ARG  19           HB2      ARG  19  53.258   5.287   6.587
  185    HB3  ARG  19           HB1      ARG  19  52.167   6.458   7.465
  186    HG2  ARG  19           HG2      ARG  19  51.728   4.869   9.165
  187    HG3  ARG  19           HG1      ARG  19  51.976   3.471   8.100
  188    HD2  ARG  19           HD2      ARG  19  54.337   5.236   8.812
  189    HD3  ARG  19           HD1      ARG  19  53.765   4.012   9.969
  190    HE   ARG  19           HE       ARG  19  54.010   2.726   7.457
  191   HH11  ARG  19          HH11      ARG  19  55.386   1.460   9.612
  192   HH12  ARG  19          HH12      ARG  19  57.059   1.820   9.346
  193   HH21  ARG  19          HH21      ARG  19  56.422   4.450   7.176
  194   HH22  ARG  19          HH22      ARG  19  57.646   3.513   7.967
  195    H    LYS  20           HN       LYS  20  50.571   7.508   6.760
  196    HA   LYS  20           HA       LYS  20  47.881   7.180   8.020
  197    HB2  LYS  20           HB2      LYS  20  49.966   6.272   9.739
  198    HB3  LYS  20           HB1      LYS  20  49.627   7.923  10.279
  199    HG2  LYS  20           HG2      LYS  20  47.180   7.325  10.380
  200    HG3  LYS  20           HG1      LYS  20  47.619   5.644   9.991
  201    HD2  LYS  20           HD2      LYS  20  49.075   5.566  12.004
  202    HD3  LYS  20           HD1      LYS  20  48.598   7.235  12.402
  203    HE2  LYS  20           HE2      LYS  20  46.612   4.949  12.068
  204    HE3  LYS  20           HE1      LYS  20  47.285   5.449  13.638
  205    HZ1  LYS  20           HZ1      LYS  20  46.408   7.748  12.323
  206    HZ2  LYS  20           HZ2      LYS  20  45.755   7.030  13.717
  207    HZ3  LYS  20           HZ3      LYS  20  45.164   6.603  12.182
  208    H    ALA  21           HN       ALA  21  49.576   8.216   6.114
  209    HA   ALA  21           HA       ALA  21  50.170  10.225   5.133
  210    HB1  ALA  21           HB1      ALA  21  49.219  11.540   7.515
  211    HB2  ALA  21           HB2      ALA  21  48.405  11.525   5.953
  212    HB3  ALA  21           HB3      ALA  21  50.018  12.286   6.136
  213    H    VAL  22           HN       VAL  22  51.252   8.778   7.686
  214    HA   VAL  22           HA       VAL  22  53.228  10.387   8.559
  215    HB   VAL  22           HB       VAL  22  53.958   7.522   7.877
  216   HG11  VAL  22          HG11      VAL  22  55.204   9.682   9.542
  217   HG12  VAL  22          HG12      VAL  22  55.959   8.325   8.685
  218   HG13  VAL  22          HG13      VAL  22  55.191   8.057  10.261
  219   HG21  VAL  22          HG21      VAL  22  51.728   7.913   9.226
  220   HG22  VAL  22          HG22      VAL  22  52.800   8.423  10.542
  221   HG23  VAL  22          HG23      VAL  22  52.921   6.779   9.889
  222    H    ILE  23           HN       ILE  23  52.601  11.046   6.003
  223    HA   ILE  23           HA       ILE  23  55.427  11.580   5.366
  224    HB   ILE  23           HB       ILE  23  53.734  10.915   2.947
  225   HG12  ILE  23          HG12      ILE  23  54.300   8.856   4.429
  226   HG13  ILE  23          HG11      ILE  23  54.753   8.770   2.723
  227   HG21  ILE  23          HG21      ILE  23  55.511  12.464   2.453
  228   HG22  ILE  23          HG22      ILE  23  56.094  10.876   1.898
  229   HG23  ILE  23          HG23      ILE  23  56.684  11.550   3.426
  230   HD11  ILE  23           HD1      ILE  23  57.064   9.182   3.225
  231   HD12  ILE  23           HD2      ILE  23  56.516   7.980   4.413
  232   HD13  ILE  23           HD3      ILE  23  56.691   9.683   4.889
  233    H    ALA  24           HN       ALA  24  52.904  11.955   6.316
  234    HA   ALA  24           HA       ALA  24  53.010  14.918   6.136
  235    HB1  ALA  24           HB1      ALA  24  51.340  15.286   4.627
  236    HB2  ALA  24           HB2      ALA  24  50.215  14.542   5.779
  237    HB3  ALA  24           HB3      ALA  24  50.987  13.551   4.511
  238    H    TRP  25           HN       TRP  25  51.193  11.922   7.019
  239    HA   TRP  25           HA       TRP  25  51.017  11.034   9.175
  240    HB2  TRP  25           HB2      TRP  25  53.087  12.503   9.779
  241    HB3  TRP  25           HB1      TRP  25  51.932  13.647  10.496
  242    HD1  TRP  25           HD1      TRP  25  53.731  10.468  11.178
  243    HE1  TRP  25           HE1      TRP  25  53.017   9.456  13.461
  244    HE3  TRP  25           HE3      TRP  25  49.678  13.446  12.151
  245    HZ2  TRP  25           HZ2      TRP  25  50.964   9.906  15.424
  246    HZ3  TRP  25           HZ3      TRP  25  48.362  13.137  14.238
  247    HH2  TRP  25           HH2      TRP  25  49.002  11.374  15.875
  Start of MODEL    7
    1    H1   ALA   1           HT1      ALA   1  45.694  18.877   0.266
    2    H2   ALA   1           HT2      ALA   1  46.083  17.623   1.345
    3    H3   ALA   1           HT3      ALA   1  44.901  17.384   0.148
    4    HA   ALA   1           HA       ALA   1  47.809  17.499  -0.083
    5    HB1  ALA   1           HB1      ALA   1  45.558  15.720  -1.041
    6    HB2  ALA   1           HB2      ALA   1  46.940  15.299  -0.005
    7    HB3  ALA   1           HB3      ALA   1  47.190  15.609  -1.742
    8    H    GLY   2           HN       GLY   2  48.125  16.880  -2.680
    9    HA2  GLY   2           HA1      GLY   2  47.649  19.468  -3.955
   10    HA3  GLY   2           HA2      GLY   2  48.545  18.096  -4.622
   11    H    LYS   3           HN       LYS   3  47.130  16.091  -5.163
   12    HA   LYS   3           HA       LYS   3  44.590  15.677  -5.751
   13    HB2  LYS   3           HB2      LYS   3  43.869  17.911  -6.338
   14    HB3  LYS   3           HB1      LYS   3  45.234  18.128  -7.464
   15    HG2  LYS   3           HG2      LYS   3  44.303  16.581  -9.038
   16    HG3  LYS   3           HG1      LYS   3  43.158  15.933  -7.843
   17    HD2  LYS   3           HD2      LYS   3  42.078  17.479  -9.502
   18    HD3  LYS   3           HD1      LYS   3  41.917  18.040  -7.821
   19    HE2  LYS   3           HE2      LYS   3  42.634  19.786  -9.608
   20    HE3  LYS   3           HE1      LYS   3  43.573  19.719  -8.098
   21    HZ1  LYS   3           HZ1      LYS   3  45.366  18.884  -9.151
   22    HZ2  LYS   3           HZ2      LYS   3  44.673  19.620 -10.516
   23    HZ3  LYS   3           HZ3      LYS   3  44.458  17.957 -10.243
   24    H    GLU   4           HN       GLU   4  45.794  13.829  -6.083
   25    HA   GLU   4           HA       GLU   4  47.058  12.293  -7.265
   26    HB2  GLU   4           HB2      GLU   4  46.343  13.770  -9.821
   27    HB3  GLU   4           HB1      GLU   4  46.641  12.035  -9.568
   28    HG2  GLU   4           HG2      GLU   4  44.562  11.894  -8.203
   29    HG3  GLU   4           HG1      GLU   4  44.258  13.622  -8.508
   30    H    LYS   5           HN       LYS   5  48.152  14.264  -6.063
   31    HA   LYS   5           HA       LYS   5  50.003  15.883  -7.380
   32    HB2  LYS   5           HB2      LYS   5  49.328  15.924  -4.969
   33    HB3  LYS   5           HB1      LYS   5  50.155  14.366  -4.757
   34    HG2  LYS   5           HG2      LYS   5  51.391  16.537  -3.998
   35    HG3  LYS   5           HG1      LYS   5  52.312  15.358  -4.941
   36    HD2  LYS   5           HD2      LYS   5  52.153  16.689  -6.939
   37    HD3  LYS   5           HD1      LYS   5  50.888  17.725  -6.230
   38    HE2  LYS   5           HE2      LYS   5  52.465  18.676  -4.649
   39    HE3  LYS   5           HE1      LYS   5  53.725  17.517  -5.135
   40    HZ1  LYS   5           HZ1      LYS   5  54.342  19.111  -6.552
   41    HZ2  LYS   5           HZ2      LYS   5  52.880  19.965  -6.408
   42    HZ3  LYS   5           HZ3      LYS   5  53.001  18.655  -7.484
   43    H    ILE   6           HN       ILE   6  49.638  12.833  -7.972
   44    HA   ILE   6           HA       ILE   6  50.934  11.163  -8.739
   45    HB   ILE   6           HB       ILE   6  53.489  12.774  -8.301
   46   HG12  ILE   6          HG12      ILE   6  51.519  13.017 -10.627
   47   HG13  ILE   6          HG11      ILE   6  52.088  14.321  -9.567
   48   HG21  ILE   6          HG21      ILE   6  52.784  10.849 -10.554
   49   HG22  ILE   6          HG22      ILE   6  53.405  10.273  -8.992
   50   HG23  ILE   6          HG23      ILE   6  54.395  11.355  -9.994
   51   HD11  ILE   6           HD1      ILE   6  53.643  12.823 -11.697
   52   HD12  ILE   6           HD2      ILE   6  54.465  13.747 -10.417
   53   HD13  ILE   6           HD3      ILE   6  53.370  14.574 -11.549
   54    H    ARG   7           HN       ARG   7  50.118  12.159  -6.018
   55    HA   ARG   7           HA       ARG   7  51.577   9.998  -4.742
   56    HB2  ARG   7           HB2      ARG   7  51.500  12.561  -3.502
   57    HB3  ARG   7           HB1      ARG   7  52.248  11.067  -2.932
   58    HG2  ARG   7           HG2      ARG   7  53.917  11.238  -4.829
   59    HG3  ARG   7           HG1      ARG   7  53.200  12.806  -5.262
   60    HD2  ARG   7           HD2      ARG   7  54.513  12.122  -2.600
   61    HD3  ARG   7           HD1      ARG   7  55.231  13.114  -3.892
   62    HE   ARG   7           HE       ARG   7  52.675  14.203  -3.149
   63   HH11  ARG   7          HH11      ARG   7  56.023  14.493  -2.857
   64   HH12  ARG   7          HH12      ARG   7  55.981  15.593  -1.519
   65   HH21  ARG   7          HH21      ARG   7  52.554  15.321  -1.062
   66   HH22  ARG   7          HH22      ARG   7  54.016  16.059  -0.503
   67    H    LYS   8           HN       LYS   8  49.401  12.348  -4.942
   68    HA   LYS   8           HA       LYS   8  47.728  11.812  -2.518
   69    HB2  LYS   8           HB2      LYS   8  48.128  13.920  -3.658
   70    HB3  LYS   8           HB1      LYS   8  47.793  12.970  -5.123
   71    HG2  LYS   8           HG2      LYS   8  45.858  14.582  -4.152
   72    HG3  LYS   8           HG1      LYS   8  45.442  12.963  -4.755
   73    HD2  LYS   8           HD2      LYS   8  45.382  12.049  -2.540
   74    HD3  LYS   8           HD1      LYS   8  46.094  13.519  -1.840
   75    HE2  LYS   8           HE2      LYS   8  44.067  14.801  -2.627
   76    HE3  LYS   8           HE1      LYS   8  43.356  13.260  -3.159
   77    HZ1  LYS   8           HZ1      LYS   8  42.548  13.738  -0.990
   78    HZ2  LYS   8           HZ2      LYS   8  44.108  14.041  -0.389
   79    HZ3  LYS   8           HZ3      LYS   8  43.656  12.465  -0.835
   80    H    LYS   9           HN       LYS   9  48.864  11.348  -5.587
   81    HA   LYS   9           HA       LYS   9  46.801   9.833  -7.021
   82    HB2  LYS   9           HB2      LYS   9  49.004  10.523  -8.011
   83    HB3  LYS   9           HB1      LYS   9  49.868   9.563  -6.738
   84    HG2  LYS   9           HG2      LYS   9  48.931   7.501  -7.611
   85    HG3  LYS   9           HG1      LYS   9  47.841   8.361  -8.722
   86    HD2  LYS   9           HD2      LYS   9  50.838   8.806  -8.958
   87    HD3  LYS   9           HD1      LYS   9  50.130   7.316  -9.617
   88    HE2  LYS   9           HE2      LYS   9  49.016  10.065 -10.299
   89    HE3  LYS   9           HE1      LYS   9  50.320   9.303 -11.238
   90    HZ1  LYS   9           HZ1      LYS   9  48.289   7.411 -10.817
   91    HZ2  LYS   9           HZ2      LYS   9  48.811   8.092 -12.284
   92    HZ3  LYS   9           HZ3      LYS   9  47.564   8.830 -11.397
   93    H    LEU  10           HN       LEU  10  48.697  10.352  -4.332
   94    HA   LEU  10           HA       LEU  10  48.375   8.825  -2.259
   95    HB2  LEU  10           HB2      LEU  10  47.445   6.464  -3.946
   96    HB3  LEU  10           HB1      LEU  10  47.626   6.497  -2.209
   97    HG   LEU  10           HG       LEU  10  45.944   8.685  -2.591
   98   HD11  LEU  10          HD11      LEU  10  44.013   7.599  -3.978
   99   HD12  LEU  10          HD12      LEU  10  45.264   6.555  -4.676
  100   HD13  LEU  10          HD13      LEU  10  45.340   8.308  -4.900
  101   HD21  LEU  10          HD21      LEU  10  45.124   5.788  -2.108
  102   HD22  LEU  10          HD22      LEU  10  44.171   7.226  -1.672
  103   HD23  LEU  10          HD23      LEU  10  45.719   6.914  -0.870
  104    H    LYS  11           HN       LYS  11  50.776   9.047  -4.207
  105    HA   LYS  11           HA       LYS  11  52.011   6.342  -4.042
  106    HB2  LYS  11           HB2      LYS  11  53.208   9.130  -4.180
  107    HB3  LYS  11           HB1      LYS  11  54.164   7.615  -4.368
  108    HG2  LYS  11           HG2      LYS  11  51.908   8.439  -6.286
  109    HG3  LYS  11           HG1      LYS  11  53.656   8.494  -6.613
  110    HD2  LYS  11           HD2      LYS  11  53.576   5.926  -5.969
  111    HD3  LYS  11           HD1      LYS  11  51.842   6.085  -6.337
  112    HE2  LYS  11           HE2      LYS  11  52.501   7.108  -8.566
  113    HE3  LYS  11           HE1      LYS  11  54.183   6.658  -8.198
  114    HZ1  LYS  11           HZ1      LYS  11  52.822   5.016  -9.538
  115    HZ2  LYS  11           HZ2      LYS  11  51.963   4.691  -8.109
  116    HZ3  LYS  11           HZ3      LYS  11  53.635   4.394  -8.185
  117    H    ASN  12           HN       ASN  12  52.233   9.407  -2.418
  118    HA   ASN  12           HA       ASN  12  53.235   8.070   0.091
  119    HB2  ASN  12           HB2      ASN  12  55.243   8.358  -1.377
  120    HB3  ASN  12           HB1      ASN  12  54.929  10.110  -1.360
  121   HD21  ASN  12          HD21      ASN  12  55.911  11.267   0.306
  122   HD22  ASN  12          HD22      ASN  12  56.497  10.542   1.806
  123    H    GLU  13           HN       GLU  13  51.571  10.376  -1.571
  124    HA   GLU  13           HA       GLU  13  51.852  12.411   0.691
  125    HB2  GLU  13           HB2      GLU  13  51.546  13.384  -1.515
  126    HB3  GLU  13           HB1      GLU  13  50.003  12.512  -1.722
  127    HG2  GLU  13           HG2      GLU  13  48.958  13.772   0.017
  128    HG3  GLU  13           HG1      GLU  13  50.514  14.375   0.617
  129    H    ILE  14           HN       ILE  14  50.010   9.835  -0.500
  130    HA   ILE  14           HA       ILE  14  48.627   9.579   2.036
  131    HB   ILE  14           HB       ILE  14  46.876   9.628  -0.456
  132   HG12  ILE  14          HG12      ILE  14  47.303  11.763   1.683
  133   HG13  ILE  14          HG11      ILE  14  47.557  11.924  -0.070
  134   HG21  ILE  14          HG21      ILE  14  46.049   9.757   2.478
  135   HG22  ILE  14          HG22      ILE  14  46.305   8.204   1.653
  136   HG23  ILE  14          HG23      ILE  14  45.056   9.323   1.067
  137   HD11  ILE  14           HD1      ILE  14  45.046  11.363  -0.307
  138   HD12  ILE  14           HD2      ILE  14  45.454  12.963   0.358
  139   HD13  ILE  14           HD3      ILE  14  44.939  11.654   1.444
  140    H    LYS  15           HN       LYS  15  50.592   7.996   1.348
  141    HA   LYS  15           HA       LYS  15  49.980   6.040  -0.377
  142    HB2  LYS  15           HB2      LYS  15  52.245   6.119   0.510
  143    HB3  LYS  15           HB1      LYS  15  51.529   5.562   2.039
  144    HG2  LYS  15           HG2      LYS  15  50.999   3.414   1.104
  145    HG3  LYS  15           HG1      LYS  15  51.340   3.974  -0.551
  146    HD2  LYS  15           HD2      LYS  15  53.711   4.188  -0.055
  147    HD3  LYS  15           HD1      LYS  15  53.426   3.843   1.669
  148    HE2  LYS  15           HE2      LYS  15  52.508   1.588   0.995
  149    HE3  LYS  15           HE1      LYS  15  53.008   1.939  -0.676
  150    HZ1  LYS  15           HZ1      LYS  15  54.615   0.650   0.810
  151    HZ2  LYS  15           HZ2      LYS  15  54.918   2.135   1.579
  152    HZ3  LYS  15           HZ3      LYS  15  55.244   1.952  -0.078
  153    H    LYS  16           HN       LYS  16  49.076   6.693   2.150
  154    HA   LYS  16           HA       LYS  16  46.706   4.819   2.178
  155    HB2  LYS  16           HB2      LYS  16  48.483   3.317   2.986
  156    HB3  LYS  16           HB1      LYS  16  49.093   4.626   4.057
  157    HG2  LYS  16           HG2      LYS  16  47.742   2.810   5.242
  158    HG3  LYS  16           HG1      LYS  16  47.106   4.453   5.468
  159    HD2  LYS  16           HD2      LYS  16  45.313   4.091   3.928
  160    HD3  LYS  16           HD1      LYS  16  46.078   2.630   3.256
  161    HE2  LYS  16           HE2      LYS  16  45.654   1.379   5.268
  162    HE3  LYS  16           HE1      LYS  16  45.188   2.847   6.161
  163    HZ1  LYS  16           HZ1      LYS  16  43.125   2.249   5.575
  164    HZ2  LYS  16           HZ2      LYS  16  43.646   1.229   4.321
  165    HZ3  LYS  16           HZ3      LYS  16  43.510   2.901   4.057
  166    H    LYS  17           HN       LYS  17  48.910   6.920   3.122
  167    HA   LYS  17           HA       LYS  17  48.014   9.174   4.041
  168    HB2  LYS  17           HB2      LYS  17  47.435   7.060   6.070
  169    HB3  LYS  17           HB1      LYS  17  47.831   8.668   6.561
  170    HG2  LYS  17           HG2      LYS  17  45.942   9.682   5.758
  171    HG3  LYS  17           HG1      LYS  17  45.689   8.453   4.512
  172    HD2  LYS  17           HD2      LYS  17  45.136   6.810   6.411
  173    HD3  LYS  17           HD1      LYS  17  45.175   8.209   7.509
  174    HE2  LYS  17           HE2      LYS  17  43.431   9.326   6.137
  175    HE3  LYS  17           HE1      LYS  17  43.381   7.909   5.061
  176    HZ1  LYS  17           HZ1      LYS  17  42.612   8.069   7.923
  177    HZ2  LYS  17           HZ2      LYS  17  42.899   6.585   7.146
  178    HZ3  LYS  17           HZ3      LYS  17  41.655   7.606   6.602
  179    H    GLY  18           HN       GLY  18  49.794   7.875   2.400
  180    HA2  GLY  18           HA1      GLY  18  52.106   7.810   2.095
  181    HA3  GLY  18           HA2      GLY  18  52.167   8.998   3.413
  182    H    ARG  19           HN       ARG  19  50.567   6.769   4.877
  183    HA   ARG  19           HA       ARG  19  52.132   4.632   5.740
  184    HB2  ARG  19           HB2      ARG  19  53.964   6.314   6.109
  185    HB3  ARG  19           HB1      ARG  19  52.766   7.371   6.947
  186    HG2  ARG  19           HG2      ARG  19  52.702   5.932   8.839
  187    HG3  ARG  19           HG1      ARG  19  53.329   4.530   7.941
  188    HD2  ARG  19           HD2      ARG  19  54.934   7.036   8.616
  189    HD3  ARG  19           HD1      ARG  19  55.028   5.493   9.498
  190    HE   ARG  19           HE       ARG  19  56.226   6.061   6.888
  191   HH11  ARG  19          HH11      ARG  19  57.348   4.349   5.927
  192   HH12  ARG  19          HH12      ARG  19  57.184   2.752   6.576
  193   HH21  ARG  19          HH21      ARG  19  54.966   3.703   9.065
  194   HH22  ARG  19          HH22      ARG  19  55.835   2.386   8.352
  195    H    LYS  20           HN       LYS  20  50.875   7.865   6.686
  196    HA   LYS  20           HA       LYS  20  48.458   6.942   7.997
  197    HB2  LYS  20           HB2      LYS  20  50.246   5.990   9.636
  198    HB3  LYS  20           HB1      LYS  20  50.629   7.680  10.004
  199    HG2  LYS  20           HG2      LYS  20  48.155   8.027  10.501
  200    HG3  LYS  20           HG1      LYS  20  47.956   6.266  10.360
  201    HD2  LYS  20           HD2      LYS  20  49.877   7.656  12.283
  202    HD3  LYS  20           HD1      LYS  20  48.282   7.012  12.730
  203    HE2  LYS  20           HE2      LYS  20  49.158   4.755  11.722
  204    HE3  LYS  20           HE1      LYS  20  50.769   5.497  11.882
  205    HZ1  LYS  20           HZ1      LYS  20  50.701   5.341  14.101
  206    HZ2  LYS  20           HZ2      LYS  20  49.497   4.172  13.840
  207    HZ3  LYS  20           HZ3      LYS  20  49.065   5.774  14.206
  208    H    ALA  21           HN       ALA  21  49.697   8.520   6.098
  209    HA   ALA  21           HA       ALA  21  49.250  10.562   5.356
  210    HB1  ALA  21           HB1      ALA  21  48.887  12.517   6.625
  211    HB2  ALA  21           HB2      ALA  21  49.169  11.521   8.045
  212    HB3  ALA  21           HB3      ALA  21  47.735  11.239   7.057
  213    H    VAL  22           HN       VAL  22  51.683   9.486   6.706
  214    HA   VAL  22           HA       VAL  22  53.619  10.966   6.951
  215    HB   VAL  22           HB       VAL  22  53.680   8.726   5.326
  216   HG11  VAL  22          HG11      VAL  22  55.136   9.089   3.489
  217   HG12  VAL  22          HG12      VAL  22  55.578  10.714   4.061
  218   HG13  VAL  22          HG13      VAL  22  53.968  10.420   3.381
  219   HG21  VAL  22          HG21      VAL  22  56.154   8.713   5.821
  220   HG22  VAL  22          HG22      VAL  22  55.117   8.955   7.245
  221   HG23  VAL  22          HG23      VAL  22  55.949  10.343   6.508
  222    H    ILE  23           HN       ILE  23  51.528  12.058   5.586
  223    HA   ILE  23           HA       ILE  23  53.135  14.414   4.834
  224    HB   ILE  23           HB       ILE  23  51.581  13.417   2.803
  225   HG12  ILE  23          HG12      ILE  23  51.344  15.974   2.078
  226   HG13  ILE  23          HG11      ILE  23  52.309  16.280   3.534
  227   HG21  ILE  23          HG21      ILE  23  49.422  14.466   2.714
  228   HG22  ILE  23          HG22      ILE  23  49.782  15.489   4.123
  229   HG23  ILE  23          HG23      ILE  23  49.541  13.741   4.331
  230   HD11  ILE  23           HD1      ILE  23  53.104  14.392   1.271
  231   HD12  ILE  23           HD2      ILE  23  54.082  14.780   2.705
  232   HD13  ILE  23           HD3      ILE  23  53.729  16.041   1.502
  233    H    ALA  24           HN       ALA  24  51.921  12.788   6.665
  234    HA   ALA  24           HA       ALA  24  51.617  14.805   8.646
  235    HB1  ALA  24           HB1      ALA  24  49.419  15.249   8.982
  236    HB2  ALA  24           HB2      ALA  24  48.935  13.570   8.739
  237    HB3  ALA  24           HB3      ALA  24  49.167  14.639   7.337
  238    H    TRP  25           HN       TRP  25  50.790  11.349   7.489
  239    HA   TRP  25           HA       TRP  25  51.548   9.458   8.773
  240    HB2  TRP  25           HB2      TRP  25  53.790   9.750   9.027
  241    HB3  TRP  25           HB1      TRP  25  53.598  11.494   9.221
  242    HD1  TRP  25           HD1      TRP  25  53.817  12.477  11.596
  243    HE1  TRP  25           HE1      TRP  25  54.370  11.509  13.946
  244    HE3  TRP  25           HE3      TRP  25  53.400   7.485  10.533
  245    HZ2  TRP  25           HZ2      TRP  25  54.594   8.911  15.166
  246    HZ3  TRP  25           HZ3      TRP  25  53.787   5.780  12.305
  247    HH2  TRP  25           HH2      TRP  25  54.383   6.488  14.619
  Start of MODEL    8
    1    H1   ALA   1           HT1      ALA   1  48.748  19.879  -3.135
    2    H2   ALA   1           HT2      ALA   1  48.602  18.992  -1.694
    3    H3   ALA   1           HT3      ALA   1  48.165  20.633  -1.734
    4    HA   ALA   1           HA       ALA   1  46.126  20.077  -2.183
    5    HB1  ALA   1           HB1      ALA   1  46.576  18.411  -4.591
    6    HB2  ALA   1           HB2      ALA   1  47.511  19.929  -4.613
    7    HB3  ALA   1           HB3      ALA   1  45.744  19.983  -4.430
    8    H    GLY   2           HN       GLY   2  44.890  17.978  -3.350
    9    HA2  GLY   2           HA1      GLY   2  45.801  15.433  -2.290
   10    HA3  GLY   2           HA2      GLY   2  44.495  16.146  -1.318
   11    H    LYS   3           HN       LYS   3  45.455  15.190  -4.647
   12    HA   LYS   3           HA       LYS   3  42.912  13.905  -5.118
   13    HB2  LYS   3           HB2      LYS   3  42.166  15.557  -6.979
   14    HB3  LYS   3           HB1      LYS   3  41.797  15.992  -5.297
   15    HG2  LYS   3           HG2      LYS   3  43.862  17.414  -5.239
   16    HG3  LYS   3           HG1      LYS   3  44.147  17.033  -6.950
   17    HD2  LYS   3           HD2      LYS   3  41.633  18.366  -5.850
   18    HD3  LYS   3           HD1      LYS   3  42.981  19.223  -6.628
   19    HE2  LYS   3           HE2      LYS   3  42.547  17.517  -8.618
   20    HE3  LYS   3           HE1      LYS   3  40.942  17.357  -7.862
   21    HZ1  LYS   3           HZ1      LYS   3  41.597  19.269  -9.611
   22    HZ2  LYS   3           HZ2      LYS   3  41.917  20.076  -8.152
   23    HZ3  LYS   3           HZ3      LYS   3  40.373  19.431  -8.448
   24    H    GLU   4           HN       GLU   4  44.770  12.495  -5.572
   25    HA   GLU   4           HA       GLU   4  46.323  11.542  -7.032
   26    HB2  GLU   4           HB2      GLU   4  44.762  12.988  -9.213
   27    HB3  GLU   4           HB1      GLU   4  45.841  11.587  -9.398
   28    HG2  GLU   4           HG2      GLU   4  43.623  10.682  -9.412
   29    HG3  GLU   4           HG1      GLU   4  44.266  10.341  -7.789
   30    H    LYS   5           HN       LYS   5  46.865  13.685  -5.680
   31    HA   LYS   5           HA       LYS   5  48.045  15.891  -7.009
   32    HB2  LYS   5           HB2      LYS   5  47.580  15.778  -4.609
   33    HB3  LYS   5           HB1      LYS   5  48.651  14.356  -4.462
   34    HG2  LYS   5           HG2      LYS   5  50.604  15.646  -4.565
   35    HG3  LYS   5           HG1      LYS   5  49.856  16.909  -5.573
   36    HD2  LYS   5           HD2      LYS   5  48.661  17.798  -3.656
   37    HD3  LYS   5           HD1      LYS   5  49.190  16.442  -2.634
   38    HE2  LYS   5           HE2      LYS   5  51.575  17.162  -3.025
   39    HE3  LYS   5           HE1      LYS   5  50.953  18.594  -3.882
   40    HZ1  LYS   5           HZ1      LYS   5  50.563  19.584  -1.952
   41    HZ2  LYS   5           HZ2      LYS   5  51.319  18.290  -1.152
   42    HZ3  LYS   5           HZ3      LYS   5  49.636  18.279  -1.390
   43    H    ILE   6           HN       ILE   6  48.562  12.876  -7.781
   44    HA   ILE   6           HA       ILE   6  50.275  11.716  -8.700
   45    HB   ILE   6           HB       ILE   6  52.236  14.009  -8.226
   46   HG12  ILE   6          HG12      ILE   6  50.194  13.736 -10.489
   47   HG13  ILE   6          HG11      ILE   6  50.364  15.099  -9.365
   48   HG21  ILE   6          HG21      ILE   6  52.896  11.644  -9.048
   49   HG22  ILE   6          HG22      ILE   6  53.455  13.019 -10.024
   50   HG23  ILE   6          HG23      ILE   6  52.053  12.060 -10.558
   51   HD11  ILE   6           HD1      ILE   6  52.773  15.339 -10.295
   52   HD12  ILE   6           HD2      ILE   6  51.431  15.845 -11.349
   53   HD13  ILE   6           HD3      ILE   6  52.226  14.275 -11.614
   54    H    ARG   7           HN       ARG   7  49.333  12.260  -5.862
   55    HA   ARG   7           HA       ARG   7  51.462  10.730  -4.709
   56    HB2  ARG   7           HB2      ARG   7  50.455  13.138  -3.563
   57    HB3  ARG   7           HB1      ARG   7  51.558  11.976  -2.820
   58    HG2  ARG   7           HG2      ARG   7  53.196  12.513  -4.757
   59    HG3  ARG   7           HG1      ARG   7  52.119  13.863  -5.162
   60    HD2  ARG   7           HD2      ARG   7  52.514  14.922  -3.029
   61    HD3  ARG   7           HD1      ARG   7  53.378  13.491  -2.417
   62    HE   ARG   7           HE       ARG   7  54.723  14.381  -4.761
   63   HH11  ARG   7          HH11      ARG   7  55.142  14.247  -1.515
   64   HH12  ARG   7          HH12      ARG   7  56.054  15.711  -1.354
   65   HH21  ARG   7          HH21      ARG   7  55.408  16.780  -4.589
   66   HH22  ARG   7          HH22      ARG   7  56.205  17.146  -3.096
   67    H    LYS   8           HN       LYS   8  48.522  12.171  -4.738
   68    HA   LYS   8           HA       LYS   8  47.337  10.947  -2.285
   69    HB2  LYS   8           HB2      LYS   8  46.979  13.131  -3.409
   70    HB3  LYS   8           HB1      LYS   8  46.572  12.116  -4.788
   71    HG2  LYS   8           HG2      LYS   8  45.060  12.042  -2.117
   72    HG3  LYS   8           HG1      LYS   8  44.528  13.078  -3.441
   73    HD2  LYS   8           HD2      LYS   8  44.532  10.838  -4.852
   74    HD3  LYS   8           HD1      LYS   8  44.481  10.063  -3.253
   75    HE2  LYS   8           HE2      LYS   8  42.499  11.863  -2.867
   76    HE3  LYS   8           HE1      LYS   8  42.373  11.689  -4.634
   77    HZ1  LYS   8           HZ1      LYS   8  41.317  10.000  -2.787
   78    HZ2  LYS   8           HZ2      LYS   8  42.723   9.182  -3.279
   79    HZ3  LYS   8           HZ3      LYS   8  41.560   9.645  -4.428
   80    H    LYS   9           HN       LYS   9  48.231  11.147  -5.423
   81    HA   LYS   9           HA       LYS   9  46.835   9.090  -6.947
   82    HB2  LYS   9           HB2      LYS   9  48.643  10.647  -7.815
   83    HB3  LYS   9           HB1      LYS   9  49.827   9.831  -6.703
   84    HG2  LYS   9           HG2      LYS   9  49.446   7.704  -7.879
   85    HG3  LYS   9           HG1      LYS   9  48.193   8.432  -8.913
   86    HD2  LYS   9           HD2      LYS   9  49.788   9.826 -10.036
   87    HD3  LYS   9           HD1      LYS   9  51.052   9.477  -8.832
   88    HE2  LYS   9           HE2      LYS   9  51.297   8.211 -11.021
   89    HE3  LYS   9           HE1      LYS   9  51.224   7.179  -9.572
   90    HZ1  LYS   9           HZ1      LYS   9  48.740   7.081 -10.033
   91    HZ2  LYS   9           HZ2      LYS   9  49.752   6.213 -11.086
   92    HZ3  LYS   9           HZ3      LYS   9  49.096   7.705 -11.570
   93    H    LEU  10           HN       LEU  10  48.563  10.061  -4.293
   94    HA   LEU  10           HA       LEU  10  48.895   8.498  -2.344
   95    HB2  LEU  10           HB2      LEU  10  47.896   6.501  -2.176
   96    HB3  LEU  10           HB1      LEU  10  47.437   6.622  -3.851
   97    HG   LEU  10           HG       LEU  10  49.856   5.143  -2.700
   98   HD11  LEU  10          HD11      LEU  10  48.634   3.168  -3.542
   99   HD12  LEU  10          HD12      LEU  10  47.290   4.230  -4.024
  100   HD13  LEU  10          HD13      LEU  10  47.725   4.068  -2.305
  101   HD21  LEU  10          HD21      LEU  10  50.527   4.468  -4.868
  102   HD22  LEU  10          HD22      LEU  10  50.145   6.171  -5.149
  103   HD23  LEU  10          HD23      LEU  10  48.979   4.916  -5.607
  104    H    LYS  11           HN       LYS  11  50.968   9.605  -4.219
  105    HA   LYS  11           HA       LYS  11  53.235   7.757  -4.340
  106    HB2  LYS  11           HB2      LYS  11  53.397  10.188  -5.127
  107    HB3  LYS  11           HB1      LYS  11  53.243  10.689  -3.375
  108    HG2  LYS  11           HG2      LYS  11  55.590  10.750  -3.860
  109    HG3  LYS  11           HG1      LYS  11  55.402   9.183  -3.058
  110    HD2  LYS  11           HD2      LYS  11  55.367   8.041  -5.247
  111    HD3  LYS  11           HD1      LYS  11  55.474   9.610  -6.080
  112    HE2  LYS  11           HE2      LYS  11  57.551   8.659  -4.069
  113    HE3  LYS  11           HE1      LYS  11  57.682   8.356  -5.817
  114    HZ1  LYS  11           HZ1      LYS  11  57.750  10.656  -6.258
  115    HZ2  LYS  11           HZ2      LYS  11  58.820  10.413  -4.960
  116    HZ3  LYS  11           HZ3      LYS  11  57.279  11.071  -4.683
  117    H    ASN  12           HN       ASN  12  51.844  10.022  -2.140
  118    HA   ASN  12           HA       ASN  12  52.280   8.477   0.278
  119    HB2  ASN  12           HB2      ASN  12  54.240   9.788   1.240
  120    HB3  ASN  12           HB1      ASN  12  54.650   8.562   0.043
  121   HD21  ASN  12          HD21      ASN  12  53.183  11.786  -0.643
  122   HD22  ASN  12          HD22      ASN  12  54.563  12.375  -1.574
  123    H    GLU  13           HN       GLU  13  51.315  11.033  -1.483
  124    HA   GLU  13           HA       GLU  13  51.048  13.072   0.627
  125    HB2  GLU  13           HB2      GLU  13  50.326  13.842  -1.512
  126    HB3  GLU  13           HB1      GLU  13  49.177  12.500  -1.701
  127    HG2  GLU  13           HG2      GLU  13  48.116  14.712  -1.099
  128    HG3  GLU  13           HG1      GLU  13  47.746  13.399   0.040
  129    H    ILE  14           HN       ILE  14  49.518  10.155  -0.298
  130    HA   ILE  14           HA       ILE  14  48.846   9.578   2.364
  131    HB   ILE  14           HB       ILE  14  46.362   9.078   1.975
  132   HG12  ILE  14          HG12      ILE  14  46.545  11.245  -0.155
  133   HG13  ILE  14          HG11      ILE  14  46.619   9.520  -0.568
  134   HG21  ILE  14          HG21      ILE  14  45.647  11.158   2.845
  135   HG22  ILE  14          HG22      ILE  14  46.871  12.078   1.946
  136   HG23  ILE  14          HG23      ILE  14  47.354  11.073   3.328
  137   HD11  ILE  14           HD1      ILE  14  44.350  10.962   0.868
  138   HD12  ILE  14           HD2      ILE  14  44.433   9.197   0.652
  139   HD13  ILE  14           HD3      ILE  14  44.309  10.262  -0.765
  140    H    LYS  15           HN       LYS  15  50.586   8.314   1.002
  141    HA   LYS  15           HA       LYS  15  49.809   6.592  -0.837
  142    HB2  LYS  15           HB2      LYS  15  52.140   6.518  -0.623
  143    HB3  LYS  15           HB1      LYS  15  51.902   6.267   1.127
  144    HG2  LYS  15           HG2      LYS  15  51.366   3.955   0.812
  145    HG3  LYS  15           HG1      LYS  15  51.116   4.170  -0.936
  146    HD2  LYS  15           HD2      LYS  15  53.295   3.057  -0.402
  147    HD3  LYS  15           HD1      LYS  15  53.504   4.597  -1.269
  148    HE2  LYS  15           HE2      LYS  15  53.559   4.490   1.768
  149    HE3  LYS  15           HE1      LYS  15  55.017   4.152   0.805
  150    HZ1  LYS  15           HZ1      LYS  15  54.029   6.403  -0.337
  151    HZ2  LYS  15           HZ2      LYS  15  55.283   6.352   0.808
  152    HZ3  LYS  15           HZ3      LYS  15  53.687   6.658   1.304
  153    H    LYS  16           HN       LYS  16  49.330   6.626   1.883
  154    HA   LYS  16           HA       LYS  16  47.213   4.415   1.860
  155    HB2  LYS  16           HB2      LYS  16  49.310   3.210   2.246
  156    HB3  LYS  16           HB1      LYS  16  49.830   4.500   3.389
  157    HG2  LYS  16           HG2      LYS  16  48.342   3.747   5.081
  158    HG3  LYS  16           HG1      LYS  16  47.283   2.899   3.930
  159    HD2  LYS  16           HD2      LYS  16  48.975   1.169   3.578
  160    HD3  LYS  16           HD1      LYS  16  50.136   2.052   4.598
  161    HE2  LYS  16           HE2      LYS  16  48.739   1.744   6.565
  162    HE3  LYS  16           HE1      LYS  16  47.434   1.039   5.579
  163    HZ1  LYS  16           HZ1      LYS  16  49.756  -0.211   6.663
  164    HZ2  LYS  16           HZ2      LYS  16  49.687  -0.428   4.980
  165    HZ3  LYS  16           HZ3      LYS  16  48.386  -0.917   5.957
  166    H    LYS  17           HN       LYS  17  48.880   6.987   2.646
  167    HA   LYS  17           HA       LYS  17  47.953   8.880   3.968
  168    HB2  LYS  17           HB2      LYS  17  47.607   6.679   5.934
  169    HB3  LYS  17           HB1      LYS  17  47.537   8.400   6.300
  170    HG2  LYS  17           HG2      LYS  17  45.516   8.774   5.252
  171    HG3  LYS  17           HG1      LYS  17  45.663   7.369   4.190
  172    HD2  LYS  17           HD2      LYS  17  45.231   5.848   6.056
  173    HD3  LYS  17           HD1      LYS  17  45.293   7.197   7.213
  174    HE2  LYS  17           HE2      LYS  17  43.329   8.231   6.112
  175    HE3  LYS  17           HE1      LYS  17  43.261   6.874   4.962
  176    HZ1  LYS  17           HZ1      LYS  17  42.842   6.796   7.903
  177    HZ2  LYS  17           HZ2      LYS  17  43.083   5.397   6.970
  178    HZ3  LYS  17           HZ3      LYS  17  41.737   6.393   6.681
  179    H    GLY  18           HN       GLY  18  50.059   8.069   2.368
  180    HA2  GLY  18           HA1      GLY  18  52.423   8.035   2.585
  181    HA3  GLY  18           HA2      GLY  18  52.129   9.064   4.038
  182    H    ARG  19           HN       ARG  19  50.383   6.331   4.408
  183    HA   ARG  19           HA       ARG  19  51.394   4.165   5.488
  184    HB2  ARG  19           HB2      ARG  19  53.478   5.370   6.161
  185    HB3  ARG  19           HB1      ARG  19  52.400   6.551   7.030
  186    HG2  ARG  19           HG2      ARG  19  53.661   4.686   8.430
  187    HG3  ARG  19           HG1      ARG  19  51.927   4.909   8.738
  188    HD2  ARG  19           HD2      ARG  19  52.787   2.485   8.456
  189    HD3  ARG  19           HD1      ARG  19  51.359   2.942   7.502
  190    HE   ARG  19           HE       ARG  19  52.662   2.660   5.553
  191   HH11  ARG  19          HH11      ARG  19  54.726   3.575   4.655
  192   HH12  ARG  19          HH12      ARG  19  56.166   3.006   5.433
  193   HH21  ARG  19          HH21      ARG  19  54.485   1.677   8.160
  194   HH22  ARG  19          HH22      ARG  19  56.029   1.930   7.418
  195    H    LYS  20           HN       LYS  20  50.701   7.532   6.633
  196    HA   LYS  20           HA       LYS  20  48.077   6.887   7.900
  197    HB2  LYS  20           HB2      LYS  20  49.816   5.691   9.495
  198    HB3  LYS  20           HB1      LYS  20  50.268   7.344   9.952
  199    HG2  LYS  20           HG2      LYS  20  48.018   7.840  10.698
  200    HG3  LYS  20           HG1      LYS  20  47.401   6.309  10.036
  201    HD2  LYS  20           HD2      LYS  20  47.696   6.059  12.445
  202    HD3  LYS  20           HD1      LYS  20  48.902   5.059  11.604
  203    HE2  LYS  20           HE2      LYS  20  50.676   6.540  12.128
  204    HE3  LYS  20           HE1      LYS  20  49.572   7.893  12.479
  205    HZ1  LYS  20           HZ1      LYS  20  49.177   5.524  14.104
  206    HZ2  LYS  20           HZ2      LYS  20  49.213   7.163  14.552
  207    HZ3  LYS  20           HZ3      LYS  20  50.664   6.304  14.342
  208    H    ALA  21           HN       ALA  21  49.606   8.218   6.050
  209    HA   ALA  21           HA       ALA  21  49.890  10.341   5.215
  210    HB1  ALA  21           HB1      ALA  21  49.133  11.298   7.812
  211    HB2  ALA  21           HB2      ALA  21  48.112  11.334   6.378
  212    HB3  ALA  21           HB3      ALA  21  49.633  12.286   6.442
  213    H    VAL  22           HN       VAL  22  51.412   8.750   7.320
  214    HA   VAL  22           HA       VAL  22  53.288  10.467   8.239
  215    HB   VAL  22           HB       VAL  22  54.169   7.784   7.133
  216   HG11  VAL  22          HG11      VAL  22  56.224   8.748   7.630
  217   HG12  VAL  22          HG12      VAL  22  55.793   8.233   9.272
  218   HG13  VAL  22          HG13      VAL  22  55.522   9.918   8.773
  219   HG21  VAL  22          HG21      VAL  22  53.456   8.464  10.017
  220   HG22  VAL  22          HG22      VAL  22  53.590   6.861   9.265
  221   HG23  VAL  22          HG23      VAL  22  52.214   7.912   8.877
  222    H    ILE  23           HN       ILE  23  52.297  11.387   5.889
  223    HA   ILE  23           HA       ILE  23  54.935  12.405   5.100
  224    HB   ILE  23           HB       ILE  23  53.501  10.896   3.123
  225   HG12  ILE  23          HG12      ILE  23  55.415  11.746   1.605
  226   HG13  ILE  23          HG11      ILE  23  55.950  12.707   2.996
  227   HG21  ILE  23          HG21      ILE  23  53.677  13.860   2.431
  228   HG22  ILE  23          HG22      ILE  23  52.166  12.965   2.717
  229   HG23  ILE  23          HG23      ILE  23  53.204  12.561   1.329
  230   HD11  ILE  23           HD1      ILE  23  56.462  10.785   4.286
  231   HD12  ILE  23           HD2      ILE  23  57.029  10.367   2.656
  232   HD13  ILE  23           HD3      ILE  23  55.490   9.711   3.254
  233    H    ALA  24           HN       ALA  24  52.575  12.213   6.450
  234    HA   ALA  24           HA       ALA  24  52.417  15.130   6.984
  235    HB1  ALA  24           HB1      ALA  24  49.620  14.548   6.784
  236    HB2  ALA  24           HB2      ALA  24  50.350  14.075   5.227
  237    HB3  ALA  24           HB3      ALA  24  50.549  15.728   5.835
  238    H    TRP  25           HN       TRP  25  50.890  11.820   7.296
  239    HA   TRP  25           HA       TRP  25  50.971  10.565   9.280
  240    HB2  TRP  25           HB2      TRP  25  53.057  12.178   9.834
  241    HB3  TRP  25           HB1      TRP  25  51.962  12.792  11.087
  242    HD1  TRP  25           HD1      TRP  25  50.568   9.814  11.502
  243    HE1  TRP  25           HE1      TRP  25  51.844   8.071  12.943
  244    HE3  TRP  25           HE3      TRP  25  55.269  11.811  11.200
  245    HZ2  TRP  25           HZ2      TRP  25  54.546   7.629  13.827
  246    HZ3  TRP  25           HZ3      TRP  25  57.184  10.710  12.351
  247    HH2  TRP  25           HH2      TRP  25  56.826   8.623  13.664
  Start of MODEL    9
    1    H1   ALA   1           HT1      ALA   1  49.032  20.087  -1.172
    2    H2   ALA   1           HT2      ALA   1  49.524  19.010  -2.391
    3    H3   ALA   1           HT3      ALA   1  49.079  18.422  -0.860
    4    HA   ALA   1           HA       ALA   1  46.894  19.770  -1.529
    5    HB1  ALA   1           HB1      ALA   1  48.241  19.895  -3.859
    6    HB2  ALA   1           HB2      ALA   1  46.470  19.730  -3.798
    7    HB3  ALA   1           HB3      ALA   1  47.487  18.295  -4.080
    8    H    GLY   2           HN       GLY   2  45.445  18.012  -2.983
    9    HA2  GLY   2           HA1      GLY   2  45.918  15.268  -2.122
   10    HA3  GLY   2           HA2      GLY   2  44.636  16.076  -1.193
   11    H    LYS   3           HN       LYS   3  45.755  15.355  -4.542
   12    HA   LYS   3           HA       LYS   3  43.122  14.405  -5.322
   13    HB2  LYS   3           HB2      LYS   3  42.649  16.904  -5.194
   14    HB3  LYS   3           HB1      LYS   3  43.861  17.128  -6.478
   15    HG2  LYS   3           HG2      LYS   3  42.583  15.644  -7.973
   16    HG3  LYS   3           HG1      LYS   3  41.388  15.354  -6.687
   17    HD2  LYS   3           HD2      LYS   3  40.907  17.815  -6.634
   18    HD3  LYS   3           HD1      LYS   3  42.017  18.029  -8.009
   19    HE2  LYS   3           HE2      LYS   3  40.637  16.663  -9.443
   20    HE3  LYS   3           HE1      LYS   3  39.628  16.142  -8.073
   21    HZ1  LYS   3           HZ1      LYS   3  39.711  18.746  -9.446
   22    HZ2  LYS   3           HZ2      LYS   3  39.253  18.689  -7.811
   23    HZ3  LYS   3           HZ3      LYS   3  38.371  17.819  -8.974
   24    H    GLU   4           HN       GLU   4  44.887  12.835  -5.778
   25    HA   GLU   4           HA       GLU   4  46.516  11.902  -7.157
   26    HB2  GLU   4           HB2      GLU   4  45.254  13.456  -9.439
   27    HB3  GLU   4           HB1      GLU   4  46.041  11.859  -9.464
   28    HG2  GLU   4           HG2      GLU   4  44.197  10.941  -8.070
   29    HG3  GLU   4           HG1      GLU   4  43.406  12.537  -8.075
   30    H    LYS   5           HN       LYS   5  47.148  13.959  -5.733
   31    HA   LYS   5           HA       LYS   5  48.475  16.129  -6.966
   32    HB2  LYS   5           HB2      LYS   5  47.881  15.857  -4.557
   33    HB3  LYS   5           HB1      LYS   5  49.027  14.491  -4.467
   34    HG2  LYS   5           HG2      LYS   5  49.763  16.878  -3.582
   35    HG3  LYS   5           HG1      LYS   5  50.916  15.921  -4.523
   36    HD2  LYS   5           HD2      LYS   5  50.495  17.243  -6.517
   37    HD3  LYS   5           HD1      LYS   5  49.099  18.041  -5.760
   38    HE2  LYS   5           HE2      LYS   5  51.277  19.391  -5.812
   39    HE3  LYS   5           HE1      LYS   5  50.494  19.236  -4.223
   40    HZ1  LYS   5           HZ1      LYS   5  52.999  18.770  -4.417
   41    HZ2  LYS   5           HZ2      LYS   5  52.536  17.285  -5.099
   42    HZ3  LYS   5           HZ3      LYS   5  52.048  17.689  -3.522
   43    H    ILE   6           HN       ILE   6  48.853  13.148  -7.841
   44    HA   ILE   6           HA       ILE   6  50.529  11.901  -8.695
   45    HB   ILE   6           HB       ILE   6  52.591  14.074  -8.132
   46   HG12  ILE   6          HG12      ILE   6  50.602  13.972 -10.454
   47   HG13  ILE   6          HG11      ILE   6  50.787  15.282  -9.270
   48   HG21  ILE   6          HG21      ILE   6  53.132  11.693  -9.022
   49   HG22  ILE   6          HG22      ILE   6  53.797  13.068  -9.928
   50   HG23  ILE   6          HG23      ILE   6  52.357  12.215 -10.534
   51   HD11  ILE   6           HD1      ILE   6  53.234  15.460 -10.108
   52   HD12  ILE   6           HD2      ILE   6  51.952  16.059 -11.187
   53   HD13  ILE   6           HD3      ILE   6  52.693  14.469 -11.486
   54    H    ARG   7           HN       ARG   7  49.542  12.375  -5.908
   55    HA   ARG   7           HA       ARG   7  51.566  10.613  -4.794
   56    HB2  ARG   7           HB2      ARG   7  50.734  12.965  -3.371
   57    HB3  ARG   7           HB1      ARG   7  51.837  11.688  -2.846
   58    HG2  ARG   7           HG2      ARG   7  53.429  12.411  -4.716
   59    HG3  ARG   7           HG1      ARG   7  52.349  13.787  -5.017
   60    HD2  ARG   7           HD2      ARG   7  52.751  14.681  -2.805
   61    HD3  ARG   7           HD1      ARG   7  53.648  13.220  -2.325
   62    HE   ARG   7           HE       ARG   7  55.535  14.209  -3.320
   63   HH11  ARG   7          HH11      ARG   7  55.123  14.101  -6.083
   64   HH12  ARG   7          HH12      ARG   7  54.840  15.733  -6.589
   65   HH21  ARG   7          HH21      ARG   7  54.098  16.875  -3.400
   66   HH22  ARG   7          HH22      ARG   7  54.260  17.303  -5.071
   67    H    LYS   8           HN       LYS   8  48.761  12.309  -4.816
   68    HA   LYS   8           HA       LYS   8  47.397  11.080  -2.459
   69    HB2  LYS   8           HB2      LYS   8  47.274  13.334  -3.484
   70    HB3  LYS   8           HB1      LYS   8  46.812  12.414  -4.905
   71    HG2  LYS   8           HG2      LYS   8  45.194  13.035  -2.387
   72    HG3  LYS   8           HG1      LYS   8  44.666  13.163  -4.060
   73    HD2  LYS   8           HD2      LYS   8  44.452  10.740  -4.243
   74    HD3  LYS   8           HD1      LYS   8  45.111  10.533  -2.595
   75    HE2  LYS   8           HE2      LYS   8  43.219  11.780  -1.660
   76    HE3  LYS   8           HE1      LYS   8  42.581  12.074  -3.295
   77    HZ1  LYS   8           HZ1      LYS   8  42.580   9.621  -1.704
   78    HZ2  LYS   8           HZ2      LYS   8  42.815   9.447  -3.378
   79    HZ3  LYS   8           HZ3      LYS   8  41.418  10.216  -2.788
   80    H    LYS   9           HN       LYS   9  48.470  11.329  -5.548
   81    HA   LYS   9           HA       LYS   9  46.943   9.436  -7.174
   82    HB2  LYS   9           HB2      LYS   9  48.877  10.866  -7.954
   83    HB3  LYS   9           HB1      LYS   9  49.973   9.942  -6.842
   84    HG2  LYS   9           HG2      LYS   9  49.528   7.893  -8.096
   85    HG3  LYS   9           HG1      LYS   9  48.286   8.688  -9.093
   86    HD2  LYS   9           HD2      LYS   9  49.934  10.105 -10.154
   87    HD3  LYS   9           HD1      LYS   9  51.198   9.579  -9.017
   88    HE2  LYS   9           HE2      LYS   9  51.113   7.302  -9.903
   89    HE3  LYS   9           HE1      LYS   9  49.748   7.731 -10.961
   90    HZ1  LYS   9           HZ1      LYS   9  51.174   8.471 -12.467
   91    HZ2  LYS   9           HZ2      LYS   9  52.475   7.984 -11.490
   92    HZ3  LYS   9           HZ3      LYS   9  51.855   9.562 -11.361
   93    H    LEU  10           HN       LEU  10  48.606  10.175  -4.402
   94    HA   LEU  10           HA       LEU  10  48.613   8.381  -2.483
   95    HB2  LEU  10           HB2      LEU  10  48.802   6.031  -4.470
   96    HB3  LEU  10           HB1      LEU  10  48.597   5.946  -2.734
   97    HG   LEU  10           HG       LEU  10  46.460   7.151  -4.550
   98   HD11  LEU  10          HD11      LEU  10  45.303   4.981  -4.228
   99   HD12  LEU  10          HD12      LEU  10  46.778   4.341  -3.462
  100   HD13  LEU  10          HD13      LEU  10  46.801   4.823  -5.175
  101   HD21  LEU  10          HD21      LEU  10  46.483   6.137  -1.686
  102   HD22  LEU  10          HD22      LEU  10  45.035   6.670  -2.573
  103   HD23  LEU  10          HD23      LEU  10  46.325   7.826  -2.203
  104    H    LYS  11           HN       LYS  11  51.015   9.464  -4.353
  105    HA   LYS  11           HA       LYS  11  52.992   7.300  -4.100
  106    HB2  LYS  11           HB2      LYS  11  53.376  10.305  -3.794
  107    HB3  LYS  11           HB1      LYS  11  54.716   9.136  -3.849
  108    HG2  LYS  11           HG2      LYS  11  52.729   9.211  -6.153
  109    HG3  LYS  11           HG1      LYS  11  54.109  10.327  -6.083
  110    HD2  LYS  11           HD2      LYS  11  54.368   7.293  -5.925
  111    HD3  LYS  11           HD1      LYS  11  54.559   8.240  -7.408
  112    HE2  LYS  11           HE2      LYS  11  56.309   9.607  -5.844
  113    HE3  LYS  11           HE1      LYS  11  56.403   8.019  -5.045
  114    HZ1  LYS  11           HZ1      LYS  11  56.413   7.720  -7.865
  115    HZ2  LYS  11           HZ2      LYS  11  57.577   7.235  -6.728
  116    HZ3  LYS  11           HZ3      LYS  11  57.636   8.796  -7.394
  117    H    ASN  12           HN       ASN  12  51.963  10.065  -2.181
  118    HA   ASN  12           HA       ASN  12  52.681   8.604   0.349
  119    HB2  ASN  12           HB2      ASN  12  54.273  11.093  -0.311
  120    HB3  ASN  12           HB1      ASN  12  54.432  10.040   1.109
  121   HD21  ASN  12          HD21      ASN  12  55.198   7.740   0.678
  122   HD22  ASN  12          HD22      ASN  12  56.296   7.494  -0.684
  123    H    GLU  13           HN       GLU  13  51.211  11.029  -1.391
  124    HA   GLU  13           HA       GLU  13  50.727  12.901   0.797
  125    HB2  GLU  13           HB2      GLU  13  50.254  13.765  -1.378
  126    HB3  GLU  13           HB1      GLU  13  49.107  12.459  -1.732
  127    HG2  GLU  13           HG2      GLU  13  47.968  14.591  -1.135
  128    HG3  GLU  13           HG1      GLU  13  47.599  13.316   0.039
  129    H    ILE  14           HN       ILE  14  49.408   9.930  -0.407
  130    HA   ILE  14           HA       ILE  14  48.473   9.356   2.215
  131    HB   ILE  14           HB       ILE  14  46.479  10.594   1.941
  132   HG12  ILE  14          HG12      ILE  14  45.324   8.042   0.795
  133   HG13  ILE  14          HG11      ILE  14  46.276   7.890   2.287
  134   HG21  ILE  14          HG21      ILE  14  45.073  10.261  -0.226
  135   HG22  ILE  14          HG22      ILE  14  46.579   9.627  -0.909
  136   HG23  ILE  14          HG23      ILE  14  46.520  11.286  -0.302
  137   HD11  ILE  14           HD1      ILE  14  43.907   9.768   1.869
  138   HD12  ILE  14           HD2      ILE  14  44.850   9.606   3.370
  139   HD13  ILE  14           HD3      ILE  14  43.875   8.240   2.779
  140    H    LYS  15           HN       LYS  15  50.323   8.138   1.135
  141    HA   LYS  15           HA       LYS  15  49.662   6.314  -0.713
  142    HB2  LYS  15           HB2      LYS  15  51.986   6.619  -0.374
  143    HB3  LYS  15           HB1      LYS  15  51.751   6.044   1.288
  144    HG2  LYS  15           HG2      LYS  15  51.368   3.790   0.539
  145    HG3  LYS  15           HG1      LYS  15  51.205   4.310  -1.157
  146    HD2  LYS  15           HD2      LYS  15  53.566   4.941  -1.237
  147    HD3  LYS  15           HD1      LYS  15  53.755   4.577   0.495
  148    HE2  LYS  15           HE2      LYS  15  53.275   2.216   0.103
  149    HE3  LYS  15           HE1      LYS  15  52.910   2.537  -1.609
  150    HZ1  LYS  15           HZ1      LYS  15  55.387   3.622  -1.232
  151    HZ2  LYS  15           HZ2      LYS  15  55.054   2.126  -1.965
  152    HZ3  LYS  15           HZ3      LYS  15  55.447   2.197  -0.314
  153    H    LYS  16           HN       LYS  16  49.194   6.556   2.001
  154    HA   LYS  16           HA       LYS  16  47.187   4.283   2.186
  155    HB2  LYS  16           HB2      LYS  16  49.323   3.132   2.527
  156    HB3  LYS  16           HB1      LYS  16  49.861   4.474   3.599
  157    HG2  LYS  16           HG2      LYS  16  48.461   3.757   5.378
  158    HG3  LYS  16           HG1      LYS  16  47.372   2.847   4.304
  159    HD2  LYS  16           HD2      LYS  16  49.032   1.113   3.977
  160    HD3  LYS  16           HD1      LYS  16  50.276   2.073   4.816
  161    HE2  LYS  16           HE2      LYS  16  47.698   1.073   6.105
  162    HE3  LYS  16           HE1      LYS  16  49.285   0.282   6.268
  163    HZ1  LYS  16           HZ1      LYS  16  50.153   2.359   7.199
  164    HZ2  LYS  16           HZ2      LYS  16  48.871   1.744   8.129
  165    HZ3  LYS  16           HZ3      LYS  16  48.614   3.065   7.092
  166    H    LYS  17           HN       LYS  17  48.843   6.914   2.787
  167    HA   LYS  17           HA       LYS  17  47.970   8.860   4.078
  168    HB2  LYS  17           HB2      LYS  17  47.721   6.729   6.135
  169    HB3  LYS  17           HB1      LYS  17  47.628   8.459   6.437
  170    HG2  LYS  17           HG2      LYS  17  45.559   8.749   5.463
  171    HG3  LYS  17           HG1      LYS  17  45.687   7.297   4.467
  172    HD2  LYS  17           HD2      LYS  17  45.461   5.877   6.488
  173    HD3  LYS  17           HD1      LYS  17  45.382   7.337   7.501
  174    HE2  LYS  17           HE2      LYS  17  43.437   6.759   5.230
  175    HE3  LYS  17           HE1      LYS  17  43.124   6.330   6.928
  176    HZ1  LYS  17           HZ1      LYS  17  43.999   8.994   6.824
  177    HZ2  LYS  17           HZ2      LYS  17  42.477   8.401   7.292
  178    HZ3  LYS  17           HZ3      LYS  17  42.771   8.810   5.669
  179    H    GLY  18           HN       GLY  18  49.989   7.998   2.418
  180    HA2  GLY  18           HA1      GLY  18  52.355   7.934   2.522
  181    HA3  GLY  18           HA2      GLY  18  52.148   9.024   3.937
  182    H    ARG  19           HN       ARG  19  50.404   6.305   4.478
  183    HA   ARG  19           HA       ARG  19  51.458   4.162   5.601
  184    HB2  ARG  19           HB2      ARG  19  52.599   6.612   6.899
  185    HB3  ARG  19           HB1      ARG  19  52.519   5.078   7.804
  186    HG2  ARG  19           HG2      ARG  19  53.831   4.821   5.091
  187    HG3  ARG  19           HG1      ARG  19  54.757   5.720   6.314
  188    HD2  ARG  19           HD2      ARG  19  54.724   3.850   7.833
  189    HD3  ARG  19           HD1      ARG  19  53.540   2.980   6.831
  190    HE   ARG  19           HE       ARG  19  55.439   2.120   5.734
  191   HH11  ARG  19          HH11      ARG  19  57.531   3.281   7.426
  192   HH12  ARG  19          HH12      ARG  19  58.382   4.334   6.345
  193   HH21  ARG  19          HH21      ARG  19  55.842   4.398   3.985
  194   HH22  ARG  19          HH22      ARG  19  57.425   4.966   4.396
  195    H    LYS  20           HN       LYS  20  50.771   7.564   6.667
  196    HA   LYS  20           HA       LYS  20  48.200   6.909   8.056
  197    HB2  LYS  20           HB2      LYS  20  49.998   5.770   9.601
  198    HB3  LYS  20           HB1      LYS  20  50.487   7.432   9.989
  199    HG2  LYS  20           HG2      LYS  20  48.004   7.887  10.499
  200    HG3  LYS  20           HG1      LYS  20  47.778   6.122  10.437
  201    HD2  LYS  20           HD2      LYS  20  49.658   7.650  12.292
  202    HD3  LYS  20           HD1      LYS  20  48.162   6.807  12.758
  203    HE2  LYS  20           HE2      LYS  20  49.277   4.684  11.735
  204    HE3  LYS  20           HE1      LYS  20  50.793   5.616  11.822
  205    HZ1  LYS  20           HZ1      LYS  20  49.433   4.274  13.890
  206    HZ2  LYS  20           HZ2      LYS  20  49.456   5.934  14.252
  207    HZ3  LYS  20           HZ3      LYS  20  50.910   5.105  13.958
  208    H    ALA  21           HN       ALA  21  49.680   8.227   6.122
  209    HA   ALA  21           HA       ALA  21  49.905  10.331   5.239
  210    HB1  ALA  21           HB1      ALA  21  49.653  12.287   6.456
  211    HB2  ALA  21           HB2      ALA  21  49.150  11.315   7.839
  212    HB3  ALA  21           HB3      ALA  21  48.133  11.363   6.391
  213    H    VAL  22           HN       VAL  22  51.526   8.779   7.245
  214    HA   VAL  22           HA       VAL  22  53.373  10.530   8.162
  215    HB   VAL  22           HB       VAL  22  54.328   7.916   6.968
  216   HG11  VAL  22          HG11      VAL  22  55.956   8.352   9.108
  217   HG12  VAL  22          HG12      VAL  22  55.618  10.038   8.665
  218   HG13  VAL  22          HG13      VAL  22  56.348   8.932   7.477
  219   HG21  VAL  22          HG21      VAL  22  52.383   7.948   8.775
  220   HG22  VAL  22          HG22      VAL  22  53.681   8.390   9.902
  221   HG23  VAL  22          HG23      VAL  22  53.759   6.850   9.012
  222    H    ILE  23           HN       ILE  23  52.307  11.435   5.836
  223    HA   ILE  23           HA       ILE  23  54.882  12.575   5.043
  224    HB   ILE  23           HB       ILE  23  53.563  11.035   3.037
  225   HG12  ILE  23          HG12      ILE  23  55.336  12.144   1.513
  226   HG13  ILE  23          HG11      ILE  23  55.792  13.112   2.926
  227   HG21  ILE  23          HG21      ILE  23  52.007  12.989   2.770
  228   HG22  ILE  23          HG22      ILE  23  52.996  12.688   1.319
  229   HG23  ILE  23          HG23      ILE  23  53.415  14.014   2.407
  230   HD11  ILE  23           HD1      ILE  23  56.572  11.228   4.131
  231   HD12  ILE  23           HD2      ILE  23  57.107  10.901   2.468
  232   HD13  ILE  23           HD3      ILE  23  55.671  10.079   3.115
  233    H    ALA  24           HN       ALA  24  52.552  12.279   6.430
  234    HA   ALA  24           HA       ALA  24  52.333  15.184   7.016
  235    HB1  ALA  24           HB1      ALA  24  50.256  14.133   5.276
  236    HB2  ALA  24           HB2      ALA  24  50.420  15.769   5.941
  237    HB3  ALA  24           HB3      ALA  24  49.543  14.529   6.861
  238    H    TRP  25           HN       TRP  25  50.931  11.825   7.298
  239    HA   TRP  25           HA       TRP  25  51.034  10.548   9.233
  240    HB2  TRP  25           HB2      TRP  25  52.732  10.868  10.722
  241    HB3  TRP  25           HB1      TRP  25  53.141  12.286   9.746
  242    HD1  TRP  25           HD1      TRP  25  53.301  14.465  11.068
  243    HE1  TRP  25           HE1      TRP  25  52.433  15.367  13.343
  244    HE3  TRP  25           HE3      TRP  25  50.474  10.443  12.514
  245    HZ2  TRP  25           HZ2      TRP  25  50.747  14.443  15.485
  246    HZ3  TRP  25           HZ3      TRP  25  49.250  10.477  14.680
  247    HH2  TRP  25           HH2      TRP  25  49.385  12.470  16.167
  Start of MODEL   10
    1    H1   ALA   1           HT1      ALA   1  45.585  19.750  -6.693
    2    H2   ALA   1           HT2      ALA   1  45.733  20.132  -8.342
    3    H3   ALA   1           HT3      ALA   1  46.992  19.324  -7.536
    4    HA   ALA   1           HA       ALA   1  44.606  18.312  -8.728
    5    HB1  ALA   1           HB1      ALA   1  46.715  17.547  -9.516
    6    HB2  ALA   1           HB2      ALA   1  46.042  16.199  -8.566
    7    HB3  ALA   1           HB3      ALA   1  47.304  17.241  -7.866
    8    H    GLY   2           HN       GLY   2  44.397  15.793  -7.780
    9    HA2  GLY   2           HA1      GLY   2  44.342  15.378  -5.012
   10    HA3  GLY   2           HA2      GLY   2  42.823  16.197  -5.395
   11    H    LYS   3           HN       LYS   3  44.899  13.533  -6.733
   12    HA   LYS   3           HA       LYS   3  42.986  11.453  -6.344
   13    HB2  LYS   3           HB2      LYS   3  41.588  12.797  -8.028
   14    HB3  LYS   3           HB1      LYS   3  42.880  12.517  -9.211
   15    HG2  LYS   3           HG2      LYS   3  42.608  10.007  -8.684
   16    HG3  LYS   3           HG1      LYS   3  41.115  10.454  -7.834
   17    HD2  LYS   3           HD2      LYS   3  41.710  11.158 -10.745
   18    HD3  LYS   3           HD1      LYS   3  40.760   9.747 -10.234
   19    HE2  LYS   3           HE2      LYS   3  40.086  12.688  -9.820
   20    HE3  LYS   3           HE1      LYS   3  39.182  11.484 -10.762
   21    HZ1  LYS   3           HZ1      LYS   3  39.178  10.275  -8.429
   22    HZ2  LYS   3           HZ2      LYS   3  37.999  11.425  -8.846
   23    HZ3  LYS   3           HZ3      LYS   3  39.311  11.868  -7.863
   24    H    GLU   4           HN       GLU   4  45.120  13.032  -8.619
   25    HA   GLU   4           HA       GLU   4  47.112  10.916  -8.262
   26    HB2  GLU   4           HB2      GLU   4  46.483  11.693 -11.108
   27    HB3  GLU   4           HB1      GLU   4  47.415  10.310 -10.483
   28    HG2  GLU   4           HG2      GLU   4  45.311   9.345  -9.550
   29    HG3  GLU   4           HG1      GLU   4  44.396  10.709 -10.238
   30    H    LYS   5           HN       LYS   5  47.169  13.092  -7.115
   31    HA   LYS   5           HA       LYS   5  48.468  15.272  -8.463
   32    HB2  LYS   5           HB2      LYS   5  47.305  15.452  -6.299
   33    HB3  LYS   5           HB1      LYS   5  48.464  14.277  -5.595
   34    HG2  LYS   5           HG2      LYS   5  50.177  15.868  -5.458
   35    HG3  LYS   5           HG1      LYS   5  49.622  16.763  -6.894
   36    HD2  LYS   5           HD2      LYS   5  47.762  17.723  -5.593
   37    HD3  LYS   5           HD1      LYS   5  48.248  16.775  -4.168
   38    HE2  LYS   5           HE2      LYS   5  50.062  18.784  -5.569
   39    HE3  LYS   5           HE1      LYS   5  49.072  19.166  -4.139
   40    HZ1  LYS   5           HZ1      LYS   5  51.531  17.677  -4.330
   41    HZ2  LYS   5           HZ2      LYS   5  50.334  16.870  -3.433
   42    HZ3  LYS   5           HZ3      LYS   5  50.822  18.435  -2.989
   43    H    ILE   6           HN       ILE   6  49.316  12.339  -8.690
   44    HA   ILE   6           HA       ILE   6  51.255  11.201  -8.896
   45    HB   ILE   6           HB       ILE   6  52.888  13.683  -8.222
   46   HG12  ILE   6          HG12      ILE   6  51.480  13.024 -10.854
   47   HG13  ILE   6          HG11      ILE   6  51.319  14.508  -9.893
   48   HG21  ILE   6          HG21      ILE   6  54.582  12.632  -9.535
   49   HG22  ILE   6          HG22      ILE   6  53.422  11.522 -10.302
   50   HG23  ILE   6          HG23      ILE   6  53.870  11.302  -8.599
   51   HD11  ILE   6           HD1      ILE   6  52.789  15.101 -11.664
   52   HD12  ILE   6           HD2      ILE   6  53.702  13.579 -11.527
   53   HD13  ILE   6           HD3      ILE   6  53.858  14.828 -10.267
   54    H    ARG   7           HN       ARG   7  49.627  11.913  -6.365
   55    HA   ARG   7           HA       ARG   7  51.463  10.598  -4.658
   56    HB2  ARG   7           HB2      ARG   7  50.377  13.110  -3.867
   57    HB3  ARG   7           HB1      ARG   7  51.400  12.002  -2.937
   58    HG2  ARG   7           HG2      ARG   7  53.288  12.498  -4.579
   59    HG3  ARG   7           HG1      ARG   7  52.238  13.719  -5.332
   60    HD2  ARG   7           HD2      ARG   7  52.136  14.977  -3.246
   61    HD3  ARG   7           HD1      ARG   7  53.073  13.718  -2.406
   62    HE   ARG   7           HE       ARG   7  55.002  14.738  -3.283
   63   HH11  ARG   7          HH11      ARG   7  55.750  14.674  -5.696
   64   HH12  ARG   7          HH12      ARG   7  55.090  15.983  -6.619
   65   HH21  ARG   7          HH21      ARG   7  52.639  16.742  -4.287
   66   HH22  ARG   7          HH22      ARG   7  53.328  17.154  -5.821
   67    H    LYS   8           HN       LYS   8  48.689  11.812  -5.505
   68    HA   LYS   8           HA       LYS   8  46.875  10.964  -3.232
   69    HB2  LYS   8           HB2      LYS   8  47.247  12.341  -5.675
   70    HB3  LYS   8           HB1      LYS   8  45.554  11.931  -5.337
   71    HG2  LYS   8           HG2      LYS   8  47.210  13.482  -3.289
   72    HG3  LYS   8           HG1      LYS   8  46.344  14.335  -4.566
   73    HD2  LYS   8           HD2      LYS   8  44.218  13.293  -3.878
   74    HD3  LYS   8           HD1      LYS   8  45.063  12.394  -2.601
   75    HE2  LYS   8           HE2      LYS   8  44.672  14.172  -1.207
   76    HE3  LYS   8           HE1      LYS   8  45.766  15.153  -2.213
   77    HZ1  LYS   8           HZ1      LYS   8  43.236  14.867  -3.468
   78    HZ2  LYS   8           HZ2      LYS   8  44.044  16.281  -2.984
   79    HZ3  LYS   8           HZ3      LYS   8  43.035  15.459  -1.892
   80    H    LYS   9           HN       LYS   9  48.574  10.920  -5.992
   81    HA   LYS   9           HA       LYS   9  47.464   8.702  -7.631
   82    HB2  LYS   9           HB2      LYS   9  49.420  10.226  -8.292
   83    HB3  LYS   9           HB1      LYS   9  50.362   9.516  -6.909
   84    HG2  LYS   9           HG2      LYS   9  50.266   7.317  -7.932
   85    HG3  LYS   9           HG1      LYS   9  49.101   7.846  -9.169
   86    HD2  LYS   9           HD2      LYS   9  50.771   9.297 -10.197
   87    HD3  LYS   9           HD1      LYS   9  51.935   8.937  -8.897
   88    HE2  LYS   9           HE2      LYS   9  50.770   6.912 -10.857
   89    HE3  LYS   9           HE1      LYS   9  52.417   7.584 -10.911
   90    HZ1  LYS   9           HZ1      LYS   9  51.218   5.803  -8.866
   91    HZ2  LYS   9           HZ2      LYS   9  52.617   6.713  -8.546
   92    HZ3  LYS   9           HZ3      LYS   9  52.618   5.557  -9.792
   93    H    LEU  10           HN       LEU  10  48.657  10.006  -4.786
   94    HA   LEU  10           HA       LEU  10  48.730   8.645  -2.678
   95    HB2  LEU  10           HB2      LEU  10  47.778   6.594  -2.386
   96    HB3  LEU  10           HB1      LEU  10  47.162   6.951  -3.996
   97    HG   LEU  10           HG       LEU  10  49.612   5.586  -4.529
   98   HD11  LEU  10          HD11      LEU  10  48.186   4.289  -2.162
   99   HD12  LEU  10          HD12      LEU  10  49.860   4.855  -2.204
  100   HD13  LEU  10          HD13      LEU  10  49.381   3.472  -3.190
  101   HD21  LEU  10          HD21      LEU  10  47.190   5.273  -5.547
  102   HD22  LEU  10          HD22      LEU  10  46.955   4.108  -4.238
  103   HD23  LEU  10          HD23      LEU  10  48.244   3.851  -5.435
  104    H    LYS  11           HN       LYS  11  50.961   9.541  -4.233
  105    HA   LYS  11           HA       LYS  11  53.138   7.572  -4.162
  106    HB2  LYS  11           HB2      LYS  11  53.489   9.909  -5.057
  107    HB3  LYS  11           HB1      LYS  11  53.164  10.562  -3.375
  108    HG2  LYS  11           HG2      LYS  11  55.209   9.592  -2.570
  109    HG3  LYS  11           HG1      LYS  11  55.386   8.516  -3.977
  110    HD2  LYS  11           HD2      LYS  11  55.923  10.374  -5.427
  111    HD3  LYS  11           HD1      LYS  11  55.490  11.555  -4.168
  112    HE2  LYS  11           HE2      LYS  11  57.341  10.757  -2.751
  113    HE3  LYS  11           HE1      LYS  11  57.759   9.526  -3.966
  114    HZ1  LYS  11           HZ1      LYS  11  57.567  12.181  -5.056
  115    HZ2  LYS  11           HZ2      LYS  11  58.808  11.030  -5.209
  116    HZ3  LYS  11           HZ3      LYS  11  58.756  12.055  -3.854
  117    H    ASN  12           HN       ASN  12  51.762  10.040  -2.228
  118    HA   ASN  12           HA       ASN  12  52.057   8.597   0.309
  119    HB2  ASN  12           HB2      ASN  12  54.340  10.377  -0.505
  120    HB3  ASN  12           HB1      ASN  12  53.856  10.362   1.204
  121   HD21  ASN  12          HD21      ASN  12  56.431   9.414   0.278
  122   HD22  ASN  12          HD22      ASN  12  56.490   7.677   0.593
  123    H    GLU  13           HN       GLU  13  51.104  11.053  -1.666
  124    HA   GLU  13           HA       GLU  13  50.628  13.063   0.440
  125    HB2  GLU  13           HB2      GLU  13  50.332  13.782  -1.822
  126    HB3  GLU  13           HB1      GLU  13  48.984  12.646  -2.061
  127    HG2  GLU  13           HG2      GLU  13  48.959  14.766   0.124
  128    HG3  GLU  13           HG1      GLU  13  48.425  15.140  -1.529
  129    H    ILE  14           HN       ILE  14  49.276  10.095  -0.464
  130    HA   ILE  14           HA       ILE  14  47.833   9.873   2.008
  131    HB   ILE  14           HB       ILE  14  46.178  11.179   0.554
  132   HG12  ILE  14          HG12      ILE  14  45.325   8.397   1.482
  133   HG13  ILE  14          HG11      ILE  14  45.533   9.812   2.540
  134   HG21  ILE  14          HG21      ILE  14  45.416   8.646  -0.875
  135   HG22  ILE  14          HG22      ILE  14  46.887   9.444  -1.462
  136   HG23  ILE  14          HG23      ILE  14  45.351  10.333  -1.433
  137   HD11  ILE  14           HD1      ILE  14  43.857  11.027   1.030
  138   HD12  ILE  14           HD2      ILE  14  43.192   9.707   2.021
  139   HD13  ILE  14           HD3      ILE  14  43.515   9.444   0.291
  140    H    LYS  15           HN       LYS  15  50.062   8.554   0.918
  141    HA   LYS  15           HA       LYS  15  49.391   6.482  -0.600
  142    HB2  LYS  15           HB2      LYS  15  51.721   6.533  -0.473
  143    HB3  LYS  15           HB1      LYS  15  51.561   6.607   1.292
  144    HG2  LYS  15           HG2      LYS  15  51.087   4.267   1.471
  145    HG3  LYS  15           HG1      LYS  15  50.831   4.113  -0.274
  146    HD2  LYS  15           HD2      LYS  15  52.999   3.227   0.002
  147    HD3  LYS  15           HD1      LYS  15  53.341   4.902  -0.475
  148    HE2  LYS  15           HE2      LYS  15  53.530   5.506   1.961
  149    HE3  LYS  15           HE1      LYS  15  53.301   3.790   2.366
  150    HZ1  LYS  15           HZ1      LYS  15  55.657   4.473   2.247
  151    HZ2  LYS  15           HZ2      LYS  15  55.458   4.832   0.598
  152    HZ3  LYS  15           HZ3      LYS  15  55.274   3.236   1.151
  153    H    LYS  16           HN       LYS  16  49.010   6.992   2.093
  154    HA   LYS  16           HA       LYS  16  46.903   4.899   2.564
  155    HB2  LYS  16           HB2      LYS  16  48.980   3.560   2.713
  156    HB3  LYS  16           HB1      LYS  16  49.707   4.845   3.748
  157    HG2  LYS  16           HG2      LYS  16  48.230   4.285   5.576
  158    HG3  LYS  16           HG1      LYS  16  47.155   3.330   4.535
  159    HD2  LYS  16           HD2      LYS  16  48.963   1.670   4.192
  160    HD3  LYS  16           HD1      LYS  16  50.038   2.625   5.241
  161    HE2  LYS  16           HE2      LYS  16  49.071   0.840   6.579
  162    HE3  LYS  16           HE1      LYS  16  48.334   2.378   7.091
  163    HZ1  LYS  16           HZ1      LYS  16  46.640   0.711   6.804
  164    HZ2  LYS  16           HZ2      LYS  16  47.155   0.385   5.218
  165    HZ3  LYS  16           HZ3      LYS  16  46.462   1.889   5.598
  166    H    LYS  17           HN       LYS  17  48.909   7.337   2.846
  167    HA   LYS  17           HA       LYS  17  48.466   9.374   3.976
  168    HB2  LYS  17           HB2      LYS  17  47.665   7.679   6.245
  169    HB3  LYS  17           HB1      LYS  17  47.738   9.405   6.287
  170    HG2  LYS  17           HG2      LYS  17  45.885   9.746   4.972
  171    HG3  LYS  17           HG1      LYS  17  45.967   8.151   4.224
  172    HD2  LYS  17           HD2      LYS  17  45.220   7.077   6.287
  173    HD3  LYS  17           HD1      LYS  17  45.333   8.618   7.167
  174    HE2  LYS  17           HE2      LYS  17  42.995   8.182   6.559
  175    HE3  LYS  17           HE1      LYS  17  43.603   9.582   5.642
  176    HZ1  LYS  17           HZ1      LYS  17  43.472   8.471   3.712
  177    HZ2  LYS  17           HZ2      LYS  17  42.384   7.462   4.540
  178    HZ3  LYS  17           HZ3      LYS  17  44.013   7.006   4.373
  179    H    GLY  18           HN       GLY  18  50.268   8.283   2.436
  180    HA2  GLY  18           HA1      GLY  18  52.647   8.119   2.463
  181    HA3  GLY  18           HA2      GLY  18  52.576   9.069   3.962
  182    H    ARG  19           HN       ARG  19  50.591   6.742   4.682
  183    HA   ARG  19           HA       ARG  19  51.704   4.331   5.373
  184    HB2  ARG  19           HB2      ARG  19  53.709   5.613   6.207
  185    HB3  ARG  19           HB1      ARG  19  52.547   6.655   7.112
  186    HG2  ARG  19           HG2      ARG  19  53.851   4.768   8.423
  187    HG3  ARG  19           HG1      ARG  19  52.100   4.873   8.675
  188    HD2  ARG  19           HD2      ARG  19  51.688   2.967   7.307
  189    HD3  ARG  19           HD1      ARG  19  53.298   3.054   6.553
  190    HE   ARG  19           HE       ARG  19  52.669   1.756   9.080
  191   HH11  ARG  19          HH11      ARG  19  54.482   2.620  10.661
  192   HH12  ARG  19          HH12      ARG  19  56.067   2.325  10.029
  193   HH21  ARG  19          HH21      ARG  19  54.959   1.747   6.795
  194   HH22  ARG  19          HH22      ARG  19  56.338   1.831   7.840
  195    H    LYS  20           HN       LYS  20  50.826   7.570   6.736
  196    HA   LYS  20           HA       LYS  20  48.222   6.687   7.851
  197    HB2  LYS  20           HB2      LYS  20  49.911   5.432   9.388
  198    HB3  LYS  20           HB1      LYS  20  50.413   7.045   9.945
  199    HG2  LYS  20           HG2      LYS  20  47.934   7.501  10.430
  200    HG3  LYS  20           HG1      LYS  20  47.653   5.768  10.143
  201    HD2  LYS  20           HD2      LYS  20  49.406   5.266  11.893
  202    HD3  LYS  20           HD1      LYS  20  49.467   7.007  12.256
  203    HE2  LYS  20           HE2      LYS  20  47.933   6.030  13.835
  204    HE3  LYS  20           HE1      LYS  20  46.944   6.900  12.638
  205    HZ1  LYS  20           HZ1      LYS  20  47.552   3.985  12.558
  206    HZ2  LYS  20           HZ2      LYS  20  46.540   4.834  11.490
  207    HZ3  LYS  20           HZ3      LYS  20  46.101   4.659  13.121
  208    H    ALA  21           HN       ALA  21  49.764   8.351   6.169
  209    HA   ALA  21           HA       ALA  21  49.686  10.525   5.621
  210    HB1  ALA  21           HB1      ALA  21  49.681  12.339   7.180
  211    HB2  ALA  21           HB2      ALA  21  49.287  11.137   8.399
  212    HB3  ALA  21           HB3      ALA  21  48.132  11.466   7.109
  213    H    VAL  22           HN       VAL  22  51.667   8.814   7.192
  214    HA   VAL  22           HA       VAL  22  53.664  10.513   7.972
  215    HB   VAL  22           HB       VAL  22  54.157   7.930   6.460
  216   HG11  VAL  22          HG11      VAL  22  56.497   8.187   7.683
  217   HG12  VAL  22          HG12      VAL  22  56.126   9.923   7.597
  218   HG13  VAL  22          HG13      VAL  22  56.239   8.956   6.103
  219   HG21  VAL  22          HG21      VAL  22  54.458   6.992   8.643
  220   HG22  VAL  22          HG22      VAL  22  53.053   8.065   8.838
  221   HG23  VAL  22          HG23      VAL  22  54.659   8.588   9.391
  222    H    ILE  23           HN       ILE  23  52.151  11.573   5.990
  223    HA   ILE  23           HA       ILE  23  54.376  12.849   4.615
  224    HB   ILE  23           HB       ILE  23  52.823  11.725   2.871
  225   HG12  ILE  23          HG12      ILE  23  52.618  13.789   1.462
  226   HG13  ILE  23          HG11      ILE  23  53.049  14.771   2.875
  227   HG21  ILE  23          HG21      ILE  23  50.586  12.635   2.635
  228   HG22  ILE  23          HG22      ILE  23  50.926  13.939   3.774
  229   HG23  ILE  23          HG23      ILE  23  50.783  12.265   4.347
  230   HD11  ILE  23           HD1      ILE  23  55.288  14.073   2.850
  231   HD12  ILE  23           HD2      ILE  23  54.918  14.006   1.113
  232   HD13  ILE  23           HD3      ILE  23  54.907  12.513   2.079
  233    H    ALA  24           HN       ALA  24  52.737  12.236   6.715
  234    HA   ALA  24           HA       ALA  24  52.776  14.825   8.054
  235    HB1  ALA  24           HB1      ALA  24  50.409  14.418   6.433
  236    HB2  ALA  24           HB2      ALA  24  50.827  15.814   7.446
  237    HB3  ALA  24           HB3      ALA  24  49.934  14.448   8.148
  238    H    TRP  25           HN       TRP  25  50.984  11.547   7.820
  239    HA   TRP  25           HA       TRP  25  51.087   9.942   9.576
  240    HB2  TRP  25           HB2      TRP  25  53.376  10.554  10.272
  241    HB3  TRP  25           HB1      TRP  25  52.732  11.842  11.300
  242    HD1  TRP  25           HD1      TRP  25  53.210   8.097  11.180
  243    HE1  TRP  25           HE1      TRP  25  52.481   7.040  13.435
  244    HE3  TRP  25           HE3      TRP  25  51.000  12.192  13.311
  245    HZ2  TRP  25           HZ2      TRP  25  51.124   7.884  15.828
  246    HZ3  TRP  25           HZ3      TRP  25  49.995  12.043  15.585
  247    HH2  TRP  25           HH2      TRP  25  50.055   9.894  16.844