*HEADER    LIGASE                                  23-OCT-09   2KPZ              
*TITLE     HUMAN NEDD4 3RD WW DOMAIN COMPLEX WITH THE HUMAN T-CELL LEUKEMIA VIRUS
*TITLE    2 1 GAG-PRO POLIPROTEIN DERIVED PEPTIDE SDPQIPPPYVEP                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: E3 UBIQUITIN-PROTEIN LIGASE NEDD4;                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: 3RD WW DOMAIN, UNP RESIDUES 834-878;                       
*COMPND   5 SYNONYM: NEURAL PRECURSOR CELL EXPRESSED DEVELOPMENTALLY DOWN-       
*COMPND   6 REGULATED PROTEIN 4, NEDD-4, CELL PROLIFERATION-INDUCING GENE 53     
*COMPND   7 PROTEIN;                                                             
*COMPND   8 EC: 6.3.2.-;                                                         
*COMPND   9 ENGINEERED: YES;                                                     
*COMPND  10 MOL_ID: 2;                                                           
*COMPND  11 MOLECULE: 12-MER FROM GAG-PRO POLYPROTEIN;                           
*COMPND  12 CHAIN: B;                                                            
*COMPND  13 FRAGMENT: UNP RESIDUES 113-124;                                      
*COMPND  14 SYNONYM: PR76GAG-PRO, MATRIX PROTEIN P19, MA,;                       
*COMPND  15 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: NEDD4;                                                         
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_VARIANT: BL21(DE3);                                
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PETM11;                                    
*SOURCE  11 MOL_ID: 2;                                                           
*SOURCE  12 SYNTHETIC: YES;                                                      
*SOURCE  13 ORGANISM_SCIENTIFIC: HUMAN T-CELL LYMPHOTROPHIC VIRUS TYPE 1 ISOLATE 
*SOURCE  14 MEL 15;                                                              
*SOURCE  15 ORGANISM_COMMON: HTLV-1;                                             
*SOURCE  16 ORGANISM_TAXID: 402046;                                              
*SOURCE  17 OTHER_DETAILS: CHEMICAL SYNTHESIS                                    
*KEYWDS    WW DOMAIN, HTLV1, NEDD4, HUMAN MODULAR DOMAIN, COMPLEX, HOST-VIRUS    
*KEYWDS   2 INTERACTION, LIGASE, PHOSPHOPROTEIN, UBL CONJUGATION PATHWAY,        
*KEYWDS   3 ASPARTYL PROTEASE, CAPSID PROTEIN, LIPOPROTEIN, METAL-BINDING,       
*KEYWDS   4 MYRISTATE, PROTEASE, VIRAL NUCLEOPROTEIN, VIRION, ZINC-FINGER        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    M.IGLESIAS-BEXIGA, M.MACIAS, R.BONET, F.J.BLANCO, E.S.COBOS, I.LUQUE  
*REVDAT   1   03-NOV-10 2KPZ    0                                                

 !From hbonds, file hbonds 
assign ( residue   14  and name HN  ) ( residue   26  and name O )  1.80  0.00  0.70
assign ( residue   14  and name N  )  ( residue   26  and name O )  2.80  0.00  0.70
assign ( residue   26  and name HN  ) ( residue   14  and name O )  1.80  0.00  0.70
assign ( residue   26  and name N  )  ( residue   14  and name O )  2.80  0.00  0.70
assign ( residue   16  and name HN  ) ( residue   24  and name O )  1.80  0.00  0.70
assign ( residue   16  and name N  )  ( residue   24  and name O )  2.80  0.00  0.70
assign ( residue   24  and name HN  ) ( residue   16  and name O )  1.80  0.00  0.70
assign ( residue   24  and name N  )  ( residue   16  and name O )  2.80  0.00  0.70
assign ( residue   25  and name HN  ) ( residue   34  and name O )  1.80  0.00  0.70
assign ( residue   25  and name N  )  ( residue   34  and name O )  2.80  0.00  0.70
assign ( residue   34  and name HN  ) ( residue   25  and name O )  1.80  0.00  0.70
assign ( residue   34  and name N  )  ( residue   25  and name O )  2.80  0.00  0.70
assign ( residue   27  and name HN  ) ( residue   32  and name O )  1.80  0.00  0.70
assign ( residue   27  and name N  )  ( residue   32  and name O )  2.80  0.00  0.70
assign ( residue   32  and name HN  ) ( residue   27  and name O )  1.80  0.00  0.70
assign ( residue   32  and name N  )  ( residue   27  and name O )  2.80  0.00  0.70!BETA SHEET from 13 to 17
assign (resid   12 and name C ) (resid   13 and name N ) (resid   13 and name CA) (resid   13 and name C )  1.00  -120.00   30.00 2
assign (resid   13 and name N ) (resid   13 and name CA ) (resid   13 and name C) (resid   14 and name N )  1.00  120.00   30.00 2
assign (resid   13 and name C ) (resid   14 and name N ) (resid   14 and name CA) (resid   14 and name C )  1.00  -120.00   30.00 2
assign (resid   14 and name N ) (resid   14 and name CA ) (resid   14 and name C) (resid   15 and name N )  1.00  120.00   30.00 2
assign (resid   14 and name C ) (resid   15 and name N ) (resid   15 and name CA) (resid   15 and name C )  1.00  -120.00   30.00 2
assign (resid   15 and name N ) (resid   15 and name CA ) (resid   15 and name C) (resid   16 and name N )  1.00  120.00   30.00 2
assign (resid   15 and name C ) (resid   16 and name N ) (resid   16 and name CA) (resid   16 and name C )  1.00  -120.00   30.00 2
assign (resid   16 and name N ) (resid   16 and name CA ) (resid   16 and name C) (resid   17 and name N )  1.00  120.00   30.00 2
assign (resid   16 and name C ) (resid   17 and name N ) (resid   17 and name CA) (resid   17 and name C )  1.00  -120.00   30.00 2
assign (resid   17 and name N ) (resid   17 and name CA ) (resid   17 and name C) (resid   18 and name N )  1.00  120.00   30.00 2
!BETA SHEET from 23 to 27
assign (resid   22 and name C ) (resid   23 and name N ) (resid   23 and name CA) (resid   23 and name C )  1.00  -120.00   30.00 2
assign (resid   23 and name N ) (resid   23 and name CA ) (resid   23 and name C) (resid   24 and name N )  1.00  120.00   30.00 2
assign (resid   23 and name C ) (resid   24 and name N ) (resid   24 and name CA) (resid   24 and name C )  1.00  -120.00   30.00 2
assign (resid   24 and name N ) (resid   24 and name CA ) (resid   24 and name C) (resid   25 and name N )  1.00  120.00   30.00 2
assign (resid   24 and name C ) (resid   25 and name N ) (resid   25 and name CA) (resid   25 and name C )  1.00  -120.00   30.00 2
assign (resid   25 and name N ) (resid   25 and name CA ) (resid   25 and name C) (resid   26 and name N )  1.00  120.00   30.00 2
assign (resid   25 and name C ) (resid   26 and name N ) (resid   26 and name CA) (resid   26 and name C )  1.00  -120.00   30.00 2
assign (resid   26 and name N ) (resid   26 and name CA ) (resid   26 and name C) (resid   27 and name N )  1.00  120.00   30.00 2
assign (resid   26 and name C ) (resid   27 and name N ) (resid   27 and name CA) (resid   27 and name C )  1.00  -120.00   30.00 2
assign (resid   27 and name N ) (resid   27 and name CA ) (resid   27 and name C) (resid   28 and name N )  1.00  120.00   30.00 2
!BETA SHEET from 32 to 34
assign (resid   31 and name C ) (resid   32 and name N ) (resid   32 and name CA) (resid   32 and name C )  1.00  -120.00   30.00 2
assign (resid   32 and name N ) (resid   32 and name CA ) (resid   32 and name C) (resid   33 and name N )  1.00  120.00   30.00 2
assign (resid   32 and name C ) (resid   33 and name N ) (resid   33 and name CA) (resid   33 and name C )  1.00  -120.00   30.00 2
assign (resid   33 and name N ) (resid   33 and name CA ) (resid   33 and name C) (resid   34 and name N )  1.00  120.00   30.00 2
assign (resid   33 and name C ) (resid   34 and name N ) (resid   34 and name CA) (resid   34 and name C )  1.00  -120.00   30.00 2
assign (resid   34 and name N ) (resid   34 and name CA ) (resid   34 and name C) (resid   35 and name N )  1.00  120.00   30.00 2
!ALPHA HELIX from 38 to 40
assign (resid  37 and name C ) (resid   38 and name N ) (resid   38 and name CA) (resid   38 and name C )  1.00  -60.00   20.00 2
assign (resid   38 and name N ) (resid   38 and name CA ) (resid   38 and name C) (resid  39 and name N )  1.00  -30.00   20.00 2
assign (resid  38 and name C ) (resid   39 and name N ) (resid   39 and name CA) (resid   39 and name C )  1.00  -60.00   20.00 2
assign (resid   39 and name N ) (resid   39 and name CA ) (resid   39 and name C) (resid  40 and name N )  1.00  -30.00   20.00 2
assign (resid  39 and name C ) (resid   40 and name N ) (resid   40 and name CA) (resid   40 and name C )  1.00  -60.00   20.00 2
assign (resid   40 and name N ) (resid   40 and name CA ) (resid   40 and name C) (resid  41 and name N )  1.00  -30.00   20.00 2
!ALPHA HELIX from 19 to 20
assign (resid  18 and name C ) (resid   19 and name N ) (resid   19 and name CA) (resid   19 and name C )  1.00  -60.00   20.00 2
assign (resid   19 and name N ) (resid   19 and name CA ) (resid   19 and name C) (resid  20 and name N )  1.00  -30.00   20.00 2
assign (resid  19 and name C ) (resid   20 and name N ) (resid   20 and name CA) (resid   20 and name C )  1.00  -60.00   20.00 2
assign (resid   20 and name N ) (resid   20 and name CA ) (resid   20 and name C) (resid  21 and name N )  1.00  -30.00   20.00 2
!Type II poly-proline helix from 114 to 117
assign (resid  113 and name C ) (resid   114 and name N ) (resid   114 and name CA) (resid   114 and name C )  1.00  -79   30.00 2
assign (resid   114 and name N ) (resid   114 and name CA ) (resid   114 and name C) (resid  115 and name N )  1.00  150.00   30.00 2
assign (resid  114 and name C ) (resid   115 and name N ) (resid   115 and name CA) (resid   115 and name C )  1.00  -79   30.00 2
assign (resid   115 and name N ) (resid   115 and name CA ) (resid   115 and name C) (resid  116 and name N )  1.00  150.00   30.00 2
assign (resid  115 and name C ) (resid   116 and name N ) (resid   116 and name CA) (resid   116 and name C )  1.00  -79   30.00 2
assign (resid   116 and name N ) (resid   116 and name CA ) (resid   116 and name C) (resid  117 and name N )  1.00  150.00   30.00 2
assign (resid  116 and name C ) (resid   117 and name N ) (resid   117 and name CA) (resid   117 and name C )  1.00  -79   30.00 2
assign (resid   117 and name N ) (resid   117 and name CA ) (resid   117 and name C) (resid  118 and name N )  1.00  150.00   30.00 2
assign (resid 9 and name C ) (resid   10 and name N ) (resid   10 and name CA) (resid   10 and name C )  1.00  -80   30.00 2
assign (resid   10 and name N ) (resid   10 and name CA ) (resid   10 and name C) (resid 11 and name N )  1.00  120   30.00 2
assign (resid   9 and name N ) (resid   9 and name CA ) (resid   9 and name C) (resid 10 and name N )  1.00  175   30.00 2
assign (resid 28 and name C ) (resid   29 and name N ) (resid   29 and name CA) (resid   29 and name C )  1.00  -60   30.00 2
assign (resid   36 and name N ) (resid   36 and name CA ) (resid   36 and name C) (resid 37 and name N )  1.00  145   30.00 2



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    PHE  12           H        PHE  12 -10.629  -6.919  -0.574
    2    HA   PHE  12           HA       PHE  12 -13.229  -5.559  -0.967
    3    HB2  PHE  12           HB2      PHE  12 -12.859  -4.639   1.293
    4    HB3  PHE  12           HB1      PHE  12 -13.001  -6.391   1.313
    5    HD1  PHE  12           HD2      PHE  12 -10.762  -3.543   1.807
    6    HD2  PHE  12           HD1      PHE  12 -11.100  -7.787   1.865
    7    HE1  PHE  12           HE2      PHE  12  -8.639  -3.690   3.038
    8    HE2  PHE  12           HE1      PHE  12  -8.978  -7.938   3.102
    9    HZ   PHE  12           HZ       PHE  12  -7.743  -5.888   3.689
   10    H    LEU  13           HN       LEU  13 -10.185  -5.552  -1.987
   11    HA   LEU  13           HA       LEU  13  -9.778  -2.652  -1.698
   12    HB2  LEU  13           HB2      LEU  13  -7.871  -4.906  -2.297
   13    HB3  LEU  13           HB1      LEU  13  -7.437  -3.220  -2.486
   14    HG   LEU  13           HG       LEU  13  -8.316  -4.447   0.109
   15   HD11  LEU  13          HD11      LEU  13  -5.962  -4.391   0.731
   16   HD12  LEU  13          HD12      LEU  13  -5.544  -3.842  -0.892
   17   HD13  LEU  13          HD13      LEU  13  -6.234  -5.448  -0.653
   18   HD21  LEU  13          HD21      LEU  13  -7.390  -2.402   1.082
   19   HD22  LEU  13          HD22      LEU  13  -8.707  -2.049  -0.037
   20   HD23  LEU  13          HD23      LEU  13  -7.035  -1.799  -0.538
   21    HA   PRO  14           HA       PRO  14  -9.992  -1.881  -6.174
   22    HB2  PRO  14           HB2      PRO  14  -7.658  -0.335  -5.124
   23    HB3  PRO  14           HB1      PRO  14  -8.759   0.085  -6.441
   24    HG2  PRO  14           HG2      PRO  14  -9.226   1.086  -4.213
   25    HG3  PRO  14           HG1      PRO  14 -10.584   0.243  -4.928
   26    HD2  PRO  14           HD2      PRO  14  -8.714  -0.695  -2.749
   27    HD3  PRO  14           HD1      PRO  14 -10.488  -0.835  -2.829
   28    H    LYS  15           HN       LYS  15  -8.801  -2.183  -7.827
   29    HA   LYS  15           HA       LYS  15  -7.477  -4.710  -7.749
   30    HB2  LYS  15           HB2      LYS  15  -8.882  -3.990  -9.635
   31    HB3  LYS  15           HB1      LYS  15  -7.713  -2.742 -10.035
   32    HG2  LYS  15           HG2      LYS  15  -6.771  -5.557  -9.940
   33    HG3  LYS  15           HG1      LYS  15  -7.781  -5.058 -11.297
   34    HD2  LYS  15           HD2      LYS  15  -6.222  -3.247 -11.800
   35    HD3  LYS  15           HD1      LYS  15  -5.219  -3.721 -10.430
   36    HE2  LYS  15           HE2      LYS  15  -4.751  -5.855 -11.459
   37    HE3  LYS  15           HE1      LYS  15  -5.852  -5.489 -12.787
   38    HZ1  LYS  15           HZ1      LYS  15  -4.417  -3.703 -13.479
   39    HZ2  LYS  15           HZ2      LYS  15  -3.515  -5.133 -13.377
   40    HZ3  LYS  15           HZ3      LYS  15  -3.388  -3.956 -12.163
   41    H    GLY  16           HN       GLY  16  -5.440  -5.149  -7.322
   42    HA2  GLY  16           HA2      GLY  16  -3.132  -5.013  -7.495
   43    HA3  GLY  16           HA1      GLY  16  -3.281  -3.459  -8.295
   44    H    TRP  17           HN       TRP  17  -5.108  -3.591  -5.437
   45    HA   TRP  17           HA       TRP  17  -3.065  -1.999  -4.088
   46    HB2  TRP  17           HB2      TRP  17  -6.036  -2.271  -3.704
   47    HB3  TRP  17           HB1      TRP  17  -5.014  -1.581  -2.446
   48    HD1  TRP  17           HD1      TRP  17  -5.888  -0.900  -6.181
   49    HE1  TRP  17           HE1      TRP  17  -5.618   1.628  -6.586
   50    HE3  TRP  17           HE3      TRP  17  -4.052   0.477  -1.607
   51    HZ2  TRP  17           HZ2      TRP  17  -4.734   3.894  -5.171
   52    HZ3  TRP  17           HZ3      TRP  17  -3.513   2.847  -1.220
   53    HH2  TRP  17           HH2      TRP  17  -3.846   4.519  -2.967
   54    H    GLU  18           HN       GLU  18  -2.206  -2.476  -2.162
   55    HA   GLU  18           HA       GLU  18  -2.789  -5.153  -1.076
   56    HB2  GLU  18           HB2      GLU  18  -0.380  -4.162  -2.114
   57    HB3  GLU  18           HB1      GLU  18  -0.159  -4.296  -0.392
   58    HG2  GLU  18           HG2      GLU  18  -1.196  -6.666  -0.765
   59    HG3  GLU  18           HG1      GLU  18  -0.650  -6.398  -2.425
   60    H    VAL  19           HN       VAL  19  -2.658  -5.426   1.027
   61    HA   VAL  19           HA       VAL  19  -2.115  -3.119   2.767
   62    HB   VAL  19           HB       VAL  19  -4.006  -5.375   3.481
   63   HG11  VAL  19          HG11      VAL  19  -3.439  -2.744   4.839
   64   HG12  VAL  19          HG12      VAL  19  -2.894  -4.332   5.381
   65   HG13  VAL  19          HG13      VAL  19  -4.616  -3.947   5.366
   66   HG21  VAL  19          HG21      VAL  19  -4.692  -2.575   2.605
   67   HG22  VAL  19          HG22      VAL  19  -5.833  -3.768   3.226
   68   HG23  VAL  19          HG23      VAL  19  -4.999  -4.056   1.699
   69    H    ARG  20           HN       ARG  20   0.048  -3.709   3.004
   70    HA   ARG  20           HA       ARG  20   0.489  -6.360   4.199
   71    HB2  ARG  20           HB2      ARG  20   1.550  -5.851   1.917
   72    HB3  ARG  20           HB1      ARG  20   2.606  -4.750   2.799
   73    HG2  ARG  20           HG2      ARG  20   3.241  -6.690   4.262
   74    HG3  ARG  20           HG1      ARG  20   2.372  -7.726   3.129
   75    HD2  ARG  20           HD2      ARG  20   4.704  -5.943   2.511
   76    HD3  ARG  20           HD1      ARG  20   4.736  -7.700   2.609
   77    HE   ARG  20           HE       ARG  20   2.828  -6.786   0.683
   78   HH11  ARG  20          HH11      ARG  20   6.229  -7.490   1.178
   79   HH12  ARG  20          HH12      ARG  20   6.567  -7.634  -0.517
   80   HH21  ARG  20          HH21      ARG  20   3.280  -6.918  -1.528
   81   HH22  ARG  20          HH22      ARG  20   4.905  -7.311  -2.055
   82    H    HIS  21           HN       HIS  21   1.735  -6.524   6.011
   83    HA   HIS  21           HA       HIS  21   2.080  -4.011   7.499
   84    HB2  HIS  21           HB2      HIS  21   1.054  -6.541   8.192
   85    HB3  HIS  21           HB1      HIS  21   2.614  -6.440   8.989
   86    HD1  HIS  21           HD1      HIS  21   1.281  -6.598  11.173
   87    HD2  HIS  21           HD2      HIS  21   0.622  -3.009   9.069
   88    HE1  HIS  21           HE1      HIS  21   0.049  -5.090  12.746
   89    HE2  HIS  21           HE2      HIS  21  -0.591  -3.100  11.360
   90    H    ALA  22           HN       ALA  22   4.085  -3.193   7.318
   91    HA   ALA  22           HA       ALA  22   6.369  -4.704   6.575
   92    HB1  ALA  22           HB1      ALA  22   6.197  -1.981   7.876
   93    HB2  ALA  22           HB2      ALA  22   6.188  -2.303   6.141
   94    HB3  ALA  22           HB3      ALA  22   7.626  -2.663   7.099
   95    HA   PRO  23           HA       PRO  23   7.831  -6.489  10.334
   96    HB2  PRO  23           HB2      PRO  23  10.426  -5.081  10.079
   97    HB3  PRO  23           HB1      PRO  23  10.086  -6.812  10.171
   98    HG2  PRO  23           HG2      PRO  23  10.796  -5.681   7.861
   99    HG3  PRO  23           HG1      PRO  23   9.578  -6.970   7.914
  100    HD2  PRO  23           HD2      PRO  23   9.205  -4.018   7.608
  101    HD3  PRO  23           HD1      PRO  23   8.347  -5.353   6.811
  102    H    ASN  24           HN       ASN  24   7.786  -3.098  10.040
  103    HA   ASN  24           HA       ASN  24   8.483  -2.524  12.779
  104    HB2  ASN  24           HB2      ASN  24   7.653  -0.200  12.174
  105    HB3  ASN  24           HB1      ASN  24   9.037  -0.782  11.259
  106   HD21  ASN  24          HD21      ASN  24   8.630   0.610   9.570
  107   HD22  ASN  24          HD22      ASN  24   7.329   0.369   8.461
  108    H    GLY  25           HN       GLY  25   5.861  -3.719  11.122
  109    HA2  GLY  25           HA2      GLY  25   3.879  -4.476  12.073
  110    HA3  GLY  25           HA1      GLY  25   4.183  -3.440  13.447
  111    H    ARG  26           HN       ARG  26   4.372  -2.190  10.227
  112    HA   ARG  26           HA       ARG  26   1.785  -0.828  10.625
  113    HB2  ARG  26           HB2      ARG  26   4.297   0.227   9.303
  114    HB3  ARG  26           HB1      ARG  26   2.750   1.063   9.322
  115    HG2  ARG  26           HG2      ARG  26   4.199   0.286  11.835
  116    HG3  ARG  26           HG1      ARG  26   4.472   1.817  11.005
  117    HD2  ARG  26           HD2      ARG  26   2.895   2.238  12.725
  118    HD3  ARG  26           HD1      ARG  26   2.013   2.259  11.203
  119    HE   ARG  26           HE       ARG  26   1.956  -0.299  12.533
  120   HH11  ARG  26          HH11      ARG  26   0.479   2.870  12.354
  121   HH12  ARG  26          HH12      ARG  26  -1.065   2.341  12.951
  122   HH21  ARG  26          HH21      ARG  26  -0.076  -1.009  13.355
  123   HH22  ARG  26          HH22      ARG  26  -1.373   0.132  13.524
  124    HA   PRO  27           HA       PRO  27   0.946  -2.609   6.599
  125    HB2  PRO  27           HB2      PRO  27  -1.625  -1.902   6.401
  126    HB3  PRO  27           HB1      PRO  27  -1.115  -3.130   7.565
  127    HG2  PRO  27           HG2      PRO  27  -1.740  -0.238   8.017
  128    HG3  PRO  27           HG1      PRO  27  -2.178  -1.644   9.006
  129    HD2  PRO  27           HD2      PRO  27  -0.036  -0.035   9.518
  130    HD3  PRO  27           HD1      PRO  27  -0.165  -1.640  10.094
  131    H    PHE  28           HN       PHE  28   1.884  -1.604   5.022
  132    HA   PHE  28           HA       PHE  28   1.095   1.097   4.245
  133    HB2  PHE  28           HB2      PHE  28   3.121   1.037   2.810
  134    HB3  PHE  28           HB1      PHE  28   3.490   0.814   4.504
  135    HD1  PHE  28           HD1      PHE  28   3.336  -1.910   5.129
  136    HD2  PHE  28           HD2      PHE  28   4.466  -0.181   1.400
  137    HE1  PHE  28           HE1      PHE  28   4.639  -3.919   4.594
  138    HE2  PHE  28           HE2      PHE  28   5.750  -2.206   0.864
  139    HZ   PHE  28           HZ       PHE  28   5.840  -4.074   2.455
  140    H    PHE  29           HN       PHE  29  -0.144   1.403   2.532
  141    HA   PHE  29           HA       PHE  29  -1.115  -0.977   1.179
  142    HB2  PHE  29           HB2      PHE  29  -2.170   1.863   1.081
  143    HB3  PHE  29           HB1      PHE  29  -2.943   0.438   0.385
  144    HD1  PHE  29           HD1      PHE  29  -1.667   1.668   3.676
  145    HD2  PHE  29           HD2      PHE  29  -4.580  -0.615   1.579
  146    HE1  PHE  29           HE1      PHE  29  -2.837   1.227   5.793
  147    HE2  PHE  29           HE2      PHE  29  -5.756  -1.058   3.695
  148    HZ   PHE  29           HZ       PHE  29  -4.878  -0.148   5.805
  149    H    ILE  30           HN       ILE  30  -0.257  -1.565  -0.652
  150    HA   ILE  30           HA       ILE  30   1.251   0.400  -2.203
  151    HB   ILE  30           HB       ILE  30   1.179  -2.566  -2.727
  152   HG12  ILE  30          HG12      ILE  30   3.217  -1.119  -1.085
  153   HG13  ILE  30          HG11      ILE  30   1.896  -2.016  -0.360
  154   HG21  ILE  30          HG21      ILE  30   2.058  -1.149  -4.505
  155   HG22  ILE  30          HG22      ILE  30   3.348  -2.108  -3.779
  156   HG23  ILE  30          HG23      ILE  30   3.182  -0.400  -3.371
  157   HD11  ILE  30          HD11      ILE  30   4.063  -3.137  -2.122
  158   HD12  ILE  30          HD12      ILE  30   2.728  -4.054  -1.425
  159   HD13  ILE  30          HD13      ILE  30   3.939  -3.321  -0.372
  160    H    ASP  31           HN       ASP  31   0.685   1.037  -4.145
  161    HA   ASP  31           HA       ASP  31  -1.541  -0.310  -5.510
  162    HB2  ASP  31           HB2      ASP  31  -1.952   2.026  -5.487
  163    HB3  ASP  31           HB1      ASP  31  -0.283   2.404  -5.910
  164    H    HIS  32           HN       HIS  32  -0.916  -1.903  -6.689
  165    HA   HIS  32           HA       HIS  32   1.843  -2.180  -7.485
  166    HB2  HIS  32           HB2      HIS  32  -0.565  -3.999  -7.649
  167    HB3  HIS  32           HB1      HIS  32   1.021  -4.463  -8.240
  168    HD1  HIS  32           HD1      HIS  32   1.515  -6.292  -6.502
  169    HD2  HIS  32           HD2      HIS  32   0.504  -2.637  -4.798
  170    HE1  HIS  32           HE1      HIS  32   2.055  -6.468  -4.027
  171    HE2  HIS  32           HE2      HIS  32   1.226  -4.359  -3.023
  172    H    ASN  33           HN       ASN  33  -0.634  -0.603  -8.846
  173    HA   ASN  33           HA       ASN  33  -0.218  -1.497 -11.581
  174    HB2  ASN  33           HB2      ASN  33  -1.958   0.765 -10.576
  175    HB3  ASN  33           HB1      ASN  33  -1.996   0.041 -12.179
  176   HD21  ASN  33          HD21      ASN  33  -2.924  -0.253  -8.875
  177   HD22  ASN  33          HD22      ASN  33  -3.963  -1.636  -9.076
  178    H    THR  34           HN       THR  34  -0.056   1.625  -9.841
  179    HA   THR  34           HA       THR  34   1.617   2.650 -12.023
  180    HB   THR  34           HB       THR  34   0.357   4.291  -9.830
  181    HG1  THR  34           HG1      THR  34  -1.482   3.597 -10.654
  182   HG21  THR  34          HG21      THR  34   0.405   6.063 -11.522
  183   HG22  THR  34          HG22      THR  34   1.117   4.943 -12.684
  184   HG23  THR  34          HG23      THR  34   2.021   5.414 -11.244
  185    H    LYS  35           HN       LYS  35   2.351   1.011  -9.467
  186    HA   LYS  35           HA       LYS  35   4.273   0.737  -8.261
  187    HB2  LYS  35           HB2      LYS  35   5.282   3.156  -9.756
  188    HB3  LYS  35           HB1      LYS  35   6.262   2.008  -8.870
  189    HG2  LYS  35           HG2      LYS  35   4.589   1.167 -11.208
  190    HG3  LYS  35           HG1      LYS  35   6.205   1.842 -11.414
  191    HD2  LYS  35           HD2      LYS  35   7.066   0.080  -9.885
  192    HD3  LYS  35           HD1      LYS  35   5.453  -0.636  -9.876
  193    HE2  LYS  35           HE2      LYS  35   5.565  -0.984 -12.271
  194    HE3  LYS  35           HE1      LYS  35   7.134  -0.184 -12.337
  195    HZ1  LYS  35           HZ1      LYS  35   7.479  -2.526 -12.359
  196    HZ2  LYS  35           HZ2      LYS  35   6.495  -2.751 -10.998
  197    HZ3  LYS  35           HZ3      LYS  35   7.984  -1.948 -10.844
  198    H    THR  36           HN       THR  36   2.076   2.631  -7.410
  199    HA   THR  36           HA       THR  36   3.622   4.649  -5.943
  200    HB   THR  36           HB       THR  36   1.419   5.733  -5.490
  201    HG1  THR  36           HG1      THR  36   0.433   3.768  -7.322
  202   HG21  THR  36          HG21      THR  36   1.076   6.573  -7.771
  203   HG22  THR  36          HG22      THR  36   2.055   5.249  -8.403
  204   HG23  THR  36          HG23      THR  36   2.788   6.473  -7.367
  205    H    THR  37           HN       THR  37   3.331   4.948  -3.686
  206    HA   THR  37           HA       THR  37   1.979   2.746  -2.290
  207    HB   THR  37           HB       THR  37   3.928   2.947  -0.599
  208    HG1  THR  37           HG1      THR  37   5.876   3.617  -1.510
  209   HG21  THR  37          HG21      THR  37   4.338   1.636  -3.288
  210   HG22  THR  37          HG22      THR  37   3.462   0.947  -1.920
  211   HG23  THR  37          HG23      THR  37   5.201   1.230  -1.804
  212    H    THR  38           HN       THR  38   1.008   3.273  -0.354
  213    HA   THR  38           HA       THR  38   1.354   5.934   0.745
  214    HB   THR  38           HB       THR  38  -0.335   6.322  -0.980
  215    HG1  THR  38           HG1      THR  38  -2.105   6.899   0.620
  216   HG21  THR  38          HG21      THR  38  -1.259   4.057  -1.128
  217   HG22  THR  38          HG22      THR  38  -2.530   5.254  -0.865
  218   HG23  THR  38          HG23      THR  38  -1.977   4.245   0.472
  219    H    TRP  39           HN       TRP  39   0.510   6.148   2.879
  220    HA   TRP  39           HA       TRP  39   0.241   3.583   4.245
  221    HB2  TRP  39           HB2      TRP  39   0.307   6.355   5.446
  222    HB3  TRP  39           HB1      TRP  39   0.494   4.829   6.302
  223    HD1  TRP  39           HD1      TRP  39   2.376   7.340   4.204
  224    HE1  TRP  39           HE1      TRP  39   4.900   6.769   4.277
  225    HE3  TRP  39           HE3      TRP  39   2.091   2.790   6.498
  226    HZ2  TRP  39           HZ2      TRP  39   6.536   4.633   5.209
  227    HZ3  TRP  39           HZ3      TRP  39   4.156   1.548   6.951
  228    HH2  TRP  39           HH2      TRP  39   6.331   2.444   6.321
  229    H    GLU  40           HN       GLU  40  -1.747   5.857   2.866
  230    HA   GLU  40           HA       GLU  40  -3.814   5.615   4.902
  231    HB2  GLU  40           HB2      GLU  40  -4.895   7.476   3.810
  232    HB3  GLU  40           HB1      GLU  40  -3.199   7.850   4.081
  233    HG2  GLU  40           HG2      GLU  40  -3.626   8.693   1.984
  234    HG3  GLU  40           HG1      GLU  40  -2.840   7.153   1.654
  235    H    ASP  41           HN       ASP  41  -6.078   5.272   4.087
  236    HA   ASP  41           HA       ASP  41  -5.923   2.946   2.285
  237    HB2  ASP  41           HB2      ASP  41  -6.196   2.259   4.599
  238    HB3  ASP  41           HB1      ASP  41  -7.583   3.325   4.780
  239    HA   PRO  42           HA       PRO  42  -8.953   5.207  -0.140
  240    HB2  PRO  42           HB2      PRO  42  -9.332   3.140  -1.912
  241    HB3  PRO  42           HB1      PRO  42  -8.018   4.312  -2.033
  242    HG2  PRO  42           HG2      PRO  42  -7.991   1.547  -0.892
  243    HG3  PRO  42           HG1      PRO  42  -6.786   2.350  -1.917
  244    HD2  PRO  42           HD2      PRO  42  -6.434   2.108   0.731
  245    HD3  PRO  42           HD1      PRO  42  -5.900   3.558  -0.146
  246    H    ARG  43           HN       ARG  43  -9.247   2.207   1.528
  247    HA   ARG  43           HA       ARG  43 -12.022   1.755   0.936
  248    HB2  ARG  43           HB2      ARG  43 -10.747  -0.170   1.443
  249    HB3  ARG  43           HB1      ARG  43 -10.049   0.568   2.874
  250    HG2  ARG  43           HG2      ARG  43 -12.301   0.496   3.928
  251    HG3  ARG  43           HG1      ARG  43 -12.869  -0.418   2.528
  252    HD2  ARG  43           HD2      ARG  43 -12.246  -1.873   4.417
  253    HD3  ARG  43           HD1      ARG  43 -11.274  -2.174   2.977
  254    HE   ARG  43           HE       ARG  43  -9.765  -0.399   4.380
  255   HH11  ARG  43          HH11      ARG  43 -11.288  -3.446   5.202
  256   HH12  ARG  43          HH12      ARG  43 -10.060  -3.895   6.352
  257   HH21  ARG  43          HH21      ARG  43  -8.153  -0.997   5.903
  258   HH22  ARG  43          HH22      ARG  43  -8.294  -2.510   6.745
  259    H    LEU  44           HN       LEU  44 -10.250   3.629   3.236
  260    HA   LEU  44           HA       LEU  44 -12.349   3.748   5.175
  261    HB2  LEU  44           HB2      LEU  44  -9.823   5.348   4.882
  262    HB3  LEU  44           HB1      LEU  44 -10.945   5.550   6.213
  263    HG   LEU  44           HG       LEU  44  -9.395   3.040   5.577
  264   HD11  LEU  44          HD11      LEU  44  -8.202   3.532   7.652
  265   HD12  LEU  44          HD12      LEU  44  -9.105   5.039   7.814
  266   HD13  LEU  44          HD13      LEU  44  -7.992   4.819   6.464
  267   HD21  LEU  44          HD21      LEU  44 -11.261   3.664   7.861
  268   HD22  LEU  44          HD22      LEU  44 -10.271   2.212   7.704
  269   HD23  LEU  44          HD23      LEU  44 -11.567   2.526   6.547
  270    H    LYS  45           HN       LYS  45 -11.907   5.120   2.273
  271    HA   LYS  45           HA       LYS  45 -13.461   7.526   2.908
  272    HB2  LYS  45           HB2      LYS  45 -11.252   7.568   1.530
  273    HB3  LYS  45           HB1      LYS  45 -12.236   6.928   0.224
  274    HG2  LYS  45           HG2      LYS  45 -13.004   9.440   1.665
  275    HG3  LYS  45           HG1      LYS  45 -11.842   9.455   0.342
  276    HD2  LYS  45           HD2      LYS  45 -14.653   8.372   0.147
  277    HD3  LYS  45           HD1      LYS  45 -14.164   9.989  -0.361
  278    HE2  LYS  45           HE2      LYS  45 -13.746   9.095  -2.359
  279    HE3  LYS  45           HE1      LYS  45 -12.342   8.335  -1.613
  280    HZ1  LYS  45           HZ1      LYS  45 -15.022   7.168  -2.077
  281    HZ2  LYS  45           HZ2      LYS  45 -13.911   6.463  -1.009
  282    HZ3  LYS  45           HZ3      LYS  45 -13.525   6.613  -2.656
  283    H    GLN 112           H        GLN 112   8.701  10.376   4.369
  284    HA   GLN 112           HA       GLN 112   8.609   8.490   5.846
  285    HB2  GLN 112           HB2      GLN 112   6.895   9.460   7.369
  286    HB3  GLN 112           HB1      GLN 112   5.681   9.211   6.125
  287    HG2  GLN 112           HG2      GLN 112   5.970   6.821   6.262
  288    HG3  GLN 112           HG1      GLN 112   7.281   7.018   7.424
  289   HE21  GLN 112          HE21      GLN 112   5.928   9.208   8.811
  290   HE22  GLN 112          HE22      GLN 112   4.661   8.483   9.734
  291    H    ILE 113           HN       ILE 113   9.028   7.140   4.204
  292    HA   ILE 113           HA       ILE 113   7.098   7.064   1.988
  293    HB   ILE 113           HB       ILE 113   8.905   6.245   0.543
  294   HG12  ILE 113          HG12      ILE 113  10.304   5.280   2.448
  295   HG13  ILE 113          HG11      ILE 113  11.182   6.125   1.182
  296   HG21  ILE 113          HG21      ILE 113   9.487   8.845   1.942
  297   HG22  ILE 113          HG22      ILE 113   8.390   8.597   0.584
  298   HG23  ILE 113          HG23      ILE 113  10.126   8.368   0.370
  299   HD11  ILE 113          HD11      ILE 113  10.481   7.240   3.890
  300   HD12  ILE 113          HD12      ILE 113  11.372   8.086   2.624
  301   HD13  ILE 113          HD13      ILE 113  12.064   6.651   3.382
  302    HA   PRO 114           HA       PRO 114   6.491   2.776   3.081
  303    HB2  PRO 114           HB2      PRO 114   4.388   2.363   1.427
  304    HB3  PRO 114           HB1      PRO 114   4.248   3.183   2.983
  305    HG2  PRO 114           HG2      PRO 114   4.168   4.293   0.254
  306    HG3  PRO 114           HG1      PRO 114   3.467   4.925   1.750
  307    HD2  PRO 114           HD2      PRO 114   5.848   5.773   0.471
  308    HD3  PRO 114           HD1      PRO 114   5.234   6.282   2.058
  309    HA   PRO 115           HA       PRO 115   9.014   0.922  -0.186
  310    HB2  PRO 115           HB2      PRO 115   7.909  -1.524   1.095
  311    HB3  PRO 115           HB1      PRO 115   9.575  -1.119   0.700
  312    HG2  PRO 115           HG2      PRO 115   8.715  -1.019   3.208
  313    HG3  PRO 115           HG1      PRO 115   9.846   0.199   2.585
  314    HD2  PRO 115           HD2      PRO 115   6.920   0.421   3.120
  315    HD3  PRO 115           HD1      PRO 115   8.208   1.632   3.302
  316    HA   PRO 116           HA       PRO 116   5.901  -0.067  -3.343
  317    HB2  PRO 116           HB2      PRO 116   7.990  -1.172  -4.886
  318    HB3  PRO 116           HB1      PRO 116   7.312   0.458  -5.037
  319    HG2  PRO 116           HG2      PRO 116   9.649  -0.490  -3.437
  320    HG3  PRO 116           HG1      PRO 116   9.489   0.973  -4.446
  321    HD2  PRO 116           HD2      PRO 116   9.167   1.274  -1.942
  322    HD3  PRO 116           HD1      PRO 116   7.904   1.896  -2.976
  323    H    TYR 117           HN       TYR 117   5.986  -1.595  -4.703
  324    HA   TYR 117           HA       TYR 117   5.639  -4.226  -3.413
  325    HB2  TYR 117           HB2      TYR 117   3.917  -4.677  -4.881
  326    HB3  TYR 117           HB1      TYR 117   3.819  -2.924  -4.810
  327    HD1  TYR 117           HD1      TYR 117   4.532  -1.554  -6.753
  328    HD2  TYR 117           HD2      TYR 117   4.615  -5.815  -6.867
  329    HE1  TYR 117           HE1      TYR 117   4.756  -1.492  -9.197
  330    HE2  TYR 117           HE2      TYR 117   4.847  -5.753  -9.306
  331    HH   TYR 117           HH       TYR 117   4.477  -4.333 -11.151
  332    H    VAL 118           HN       VAL 118   6.697  -6.048  -4.020
  333    HA   VAL 118           HA       VAL 118   8.577  -5.835  -6.277
  334    HB   VAL 118           HB       VAL 118   8.522  -7.916  -4.076
  335   HG11  VAL 118          HG11      VAL 118  10.594  -7.312  -6.182
  336   HG12  VAL 118          HG12      VAL 118   9.532  -8.718  -6.139
  337   HG13  VAL 118          HG13      VAL 118  10.758  -8.500  -4.891
  338   HG21  VAL 118          HG21      VAL 118   9.060  -5.718  -3.168
  339   HG22  VAL 118          HG22      VAL 118  10.319  -5.512  -4.387
  340   HG23  VAL 118          HG23      VAL 118  10.477  -6.767  -3.156
  341    H    GLU 119           HN       GLU 119   6.151  -7.864  -4.768
  342    HA   GLU 119           HA       GLU 119   5.906  -9.562  -7.111
  343    HB2  GLU 119           HB2      GLU 119   4.101 -10.660  -5.646
  344    HB3  GLU 119           HB1      GLU 119   5.771 -10.809  -5.129
  345    HG2  GLU 119           HG2      GLU 119   3.941  -8.686  -4.049
  346    HG3  GLU 119           HG1      GLU 119   4.039 -10.293  -3.336
  347    HA   PRO 120           HA       PRO 120   2.867  -6.953  -8.978
  348    HB2  PRO 120           HB2      PRO 120   1.758  -8.879 -10.619
  349    HB3  PRO 120           HB1      PRO 120   3.217  -7.955 -10.990
  350    HG2  PRO 120           HG2      PRO 120   2.943 -10.715  -9.891
  351    HG3  PRO 120           HG1      PRO 120   4.109 -10.087 -11.069
  352    HD2  PRO 120           HD2      PRO 120   4.776 -10.521  -8.500
  353    HD3  PRO 120           HD1      PRO 120   5.463  -9.173  -9.429
  Start of MODEL    2
    1    H    PHE  12           H        PHE  12 -11.643  -7.725  -1.932
    2    HA   PHE  12           HA       PHE  12 -13.223  -6.411  -0.765
    3    HB2  PHE  12           HB2      PHE  12 -12.732  -7.530   1.452
    4    HB3  PHE  12           HB1      PHE  12 -11.319  -6.491   1.583
    5    HD1  PHE  12           HD2      PHE  12 -15.015  -6.394   1.220
    6    HD2  PHE  12           HD1      PHE  12 -11.502  -4.385   2.543
    7    HE1  PHE  12           HE2      PHE  12 -16.409  -4.656   2.264
    8    HE2  PHE  12           HE1      PHE  12 -12.889  -2.643   3.589
    9    HZ   PHE  12           HZ       PHE  12 -15.346  -2.775   3.450
   10    H    LEU  13           HN       LEU  13 -10.162  -6.447  -1.771
   11    HA   LEU  13           HA       LEU  13  -9.813  -3.540  -1.527
   12    HB2  LEU  13           HB2      LEU  13  -7.824  -5.776  -1.468
   13    HB3  LEU  13           HB1      LEU  13  -7.335  -4.210  -2.079
   14    HG   LEU  13           HG       LEU  13  -6.673  -4.345   0.203
   15   HD11  LEU  13          HD11      LEU  13  -9.142  -2.636  -0.027
   16   HD12  LEU  13          HD12      LEU  13  -7.504  -2.181  -0.497
   17   HD13  LEU  13          HD13      LEU  13  -7.885  -2.469   1.200
   18   HD21  LEU  13          HD21      LEU  13  -8.245  -4.733   2.035
   19   HD22  LEU  13          HD22      LEU  13  -8.136  -6.124   0.955
   20   HD23  LEU  13          HD23      LEU  13  -9.527  -5.042   0.862
   21    HA   PRO  14           HA       PRO  14 -10.085  -3.029  -5.961
   22    HB2  PRO  14           HB2      PRO  14  -7.988  -1.099  -5.079
   23    HB3  PRO  14           HB1      PRO  14  -9.211  -0.902  -6.338
   24    HG2  PRO  14           HG2      PRO  14  -9.689   0.087  -4.104
   25    HG3  PRO  14           HG1      PRO  14 -10.941  -0.967  -4.725
   26    HD2  PRO  14           HD2      PRO  14  -8.840  -1.559  -2.639
   27    HD3  PRO  14           HD1      PRO  14 -10.574  -1.966  -2.608
   28    H    LYS  15           HN       LYS  15  -8.987  -3.182  -7.672
   29    HA   LYS  15           HA       LYS  15  -7.288  -5.419  -7.816
   30    HB2  LYS  15           HB2      LYS  15  -8.631  -4.860  -9.716
   31    HB3  LYS  15           HB1      LYS  15  -7.876  -3.277  -9.859
   32    HG2  LYS  15           HG2      LYS  15  -5.762  -4.331 -10.474
   33    HG3  LYS  15           HG1      LYS  15  -6.500  -5.923 -10.306
   34    HD2  LYS  15           HD2      LYS  15  -8.026  -5.453 -12.118
   35    HD3  LYS  15           HD1      LYS  15  -7.424  -3.798 -12.235
   36    HE2  LYS  15           HE2      LYS  15  -5.681  -6.225 -12.626
   37    HE3  LYS  15           HE1      LYS  15  -6.523  -5.419 -13.948
   38    HZ1  LYS  15           HZ1      LYS  15  -4.139  -4.741 -13.554
   39    HZ2  LYS  15           HZ2      LYS  15  -4.671  -3.973 -12.137
   40    HZ3  LYS  15           HZ3      LYS  15  -5.264  -3.474 -13.645
   41    H    GLY  16           HN       GLY  16  -5.231  -5.632  -7.321
   42    HA2  GLY  16           HA2      GLY  16  -2.951  -5.275  -7.516
   43    HA3  GLY  16           HA1      GLY  16  -3.271  -3.750  -8.321
   44    H    TRP  17           HN       TRP  17  -5.090  -3.800  -5.545
   45    HA   TRP  17           HA       TRP  17  -3.145  -2.121  -4.172
   46    HB2  TRP  17           HB2      TRP  17  -6.071  -2.664  -3.755
   47    HB3  TRP  17           HB1      TRP  17  -5.107  -1.854  -2.527
   48    HD1  TRP  17           HD1      TRP  17  -6.204  -1.354  -6.215
   49    HE1  TRP  17           HE1      TRP  17  -6.344   1.175  -6.646
   50    HE3  TRP  17           HE3      TRP  17  -4.292   0.347  -1.764
   51    HZ2  TRP  17           HZ2      TRP  17  -5.683   3.571  -5.309
   52    HZ3  TRP  17           HZ3      TRP  17  -4.074   2.776  -1.441
   53    HH2  TRP  17           HH2      TRP  17  -4.753   4.352  -3.179
   54    H    GLU  18           HN       GLU  18  -1.895  -2.825  -2.664
   55    HA   GLU  18           HA       GLU  18  -2.462  -5.427  -1.423
   56    HB2  GLU  18           HB2      GLU  18  -0.164  -4.340  -2.589
   57    HB3  GLU  18           HB1      GLU  18   0.172  -4.452  -0.884
   58    HG2  GLU  18           HG2      GLU  18  -0.901  -6.748  -2.483
   59    HG3  GLU  18           HG1      GLU  18   0.823  -6.417  -2.318
   60    H    VAL  19           HN       VAL  19  -2.150  -5.693   0.709
   61    HA   VAL  19           HA       VAL  19  -1.826  -3.310   2.398
   62    HB   VAL  19           HB       VAL  19  -3.802  -5.469   3.133
   63   HG11  VAL  19          HG11      VAL  19  -4.556  -3.857   4.790
   64   HG12  VAL  19          HG12      VAL  19  -3.386  -2.679   4.198
   65   HG13  VAL  19          HG13      VAL  19  -2.824  -4.164   4.967
   66   HG21  VAL  19          HG21      VAL  19  -5.605  -3.924   2.522
   67   HG22  VAL  19          HG22      VAL  19  -4.646  -4.400   1.120
   68   HG23  VAL  19          HG23      VAL  19  -4.415  -2.813   1.850
   69    H    ARG  20           HN       ARG  20   0.274  -3.939   2.861
   70    HA   ARG  20           HA       ARG  20   0.494  -6.504   4.281
   71    HB2  ARG  20           HB2      ARG  20   1.711  -6.217   2.035
   72    HB3  ARG  20           HB1      ARG  20   2.795  -5.146   2.917
   73    HG2  ARG  20           HG2      ARG  20   3.404  -6.934   4.421
   74    HG3  ARG  20           HG1      ARG  20   2.233  -8.010   3.652
   75    HD2  ARG  20           HD2      ARG  20   4.641  -6.773   2.368
   76    HD3  ARG  20           HD1      ARG  20   4.470  -8.465   2.831
   77    HE   ARG  20           HE       ARG  20   2.425  -7.515   1.012
   78   HH11  ARG  20          HH11      ARG  20   5.640  -8.913   1.191
   79   HH12  ARG  20          HH12      ARG  20   5.520  -9.673  -0.369
   80   HH21  ARG  20          HH21      ARG  20   2.252  -8.525  -0.969
   81   HH22  ARG  20          HH22      ARG  20   3.574  -9.480  -1.591
   82    H    HIS  21           HN       HIS  21   1.852  -6.585   6.068
   83    HA   HIS  21           HA       HIS  21   1.946  -3.981   7.465
   84    HB2  HIS  21           HB2      HIS  21   0.751  -6.404   8.168
   85    HB3  HIS  21           HB1      HIS  21   2.240  -6.385   9.095
   86    HD1  HIS  21           HD1      HIS  21   0.809  -6.383  11.183
   87    HD2  HIS  21           HD2      HIS  21   0.358  -2.861   8.903
   88    HE1  HIS  21           HE1      HIS  21  -0.414  -4.759  12.647
   89    HE2  HIS  21           HE2      HIS  21  -0.842  -2.754  11.196
   90    H    ALA  22           HN       ALA  22   3.963  -3.197   7.398
   91    HA   ALA  22           HA       ALA  22   6.272  -4.732   6.872
   92    HB1  ALA  22           HB1      ALA  22   7.502  -2.679   7.353
   93    HB2  ALA  22           HB2      ALA  22   6.056  -1.970   8.074
   94    HB3  ALA  22           HB3      ALA  22   6.090  -2.345   6.350
   95    HA   PRO  23           HA       PRO  23   7.617  -6.346  10.755
   96    HB2  PRO  23           HB2      PRO  23  10.165  -4.830  10.569
   97    HB3  PRO  23           HB1      PRO  23   9.899  -6.566  10.754
   98    HG2  PRO  23           HG2      PRO  23  10.677  -5.566   8.418
   99    HG3  PRO  23           HG1      PRO  23   9.482  -6.876   8.488
  100    HD2  PRO  23           HD2      PRO  23   9.060  -3.951   8.006
  101    HD3  PRO  23           HD1      PRO  23   8.274  -5.344   7.235
  102    H    ASN  24           HN       ASN  24   7.565  -2.943  10.349
  103    HA   ASN  24           HA       ASN  24   8.040  -2.308  13.122
  104    HB2  ASN  24           HB2      ASN  24   7.320   0.013  12.410
  105    HB3  ASN  24           HB1      ASN  24   8.750  -0.615  11.602
  106   HD21  ASN  24          HD21      ASN  24   8.476   0.810   9.895
  107   HD22  ASN  24          HD22      ASN  24   7.253   0.585   8.693
  108    H    GLY  25           HN       GLY  25   5.567  -3.540  11.295
  109    HA2  GLY  25           HA2      GLY  25   3.517  -4.277  12.095
  110    HA3  GLY  25           HA1      GLY  25   3.717  -3.229  13.479
  111    H    ARG  26           HN       ARG  26   4.145  -1.985  10.276
  112    HA   ARG  26           HA       ARG  26   1.534  -0.616  10.459
  113    HB2  ARG  26           HB2      ARG  26   4.120   0.328   9.200
  114    HB3  ARG  26           HB1      ARG  26   2.597   1.193   9.102
  115    HG2  ARG  26           HG2      ARG  26   4.038   0.573  11.673
  116    HG3  ARG  26           HG1      ARG  26   4.194   2.085  10.783
  117    HD2  ARG  26           HD2      ARG  26   2.613   2.513  12.474
  118    HD3  ARG  26           HD1      ARG  26   1.677   2.312  10.996
  119    HE   ARG  26           HE       ARG  26   1.787  -0.177  12.213
  120   HH11  ARG  26          HH11      ARG  26   0.579   3.003  13.037
  121   HH12  ARG  26          HH12      ARG  26  -0.743   2.400  13.990
  122   HH21  ARG  26          HH21      ARG  26   0.079  -0.975  13.495
  123   HH22  ARG  26          HH22      ARG  26  -1.011   0.133  14.275
  124    HA   PRO  27           HA       PRO  27   0.889  -2.597   6.478
  125    HB2  PRO  27           HB2      PRO  27  -1.652  -1.847   6.091
  126    HB3  PRO  27           HB1      PRO  27  -1.239  -3.044   7.318
  127    HG2  PRO  27           HG2      PRO  27  -1.868  -0.143   7.634
  128    HG3  PRO  27           HG1      PRO  27  -2.340  -1.511   8.661
  129    HD2  PRO  27           HD2      PRO  27  -0.226   0.148   9.177
  130    HD3  PRO  27           HD1      PRO  27  -0.394  -1.412   9.856
  131    H    PHE  28           HN       PHE  28   1.802  -1.758   4.799
  132    HA   PHE  28           HA       PHE  28   1.119   0.939   3.912
  133    HB2  PHE  28           HB2      PHE  28   3.200   0.831   2.577
  134    HB3  PHE  28           HB1      PHE  28   3.500   0.628   4.291
  135    HD1  PHE  28           HD1      PHE  28   3.390  -2.050   4.984
  136    HD2  PHE  28           HD2      PHE  28   4.503  -0.439   1.202
  137    HE1  PHE  28           HE1      PHE  28   4.701  -4.067   4.510
  138    HE2  PHE  28           HE2      PHE  28   5.805  -2.470   0.726
  139    HZ   PHE  28           HZ       PHE  28   5.903  -4.282   2.380
  140    H    PHE  29           HN       PHE  29  -0.172   1.144   2.247
  141    HA   PHE  29           HA       PHE  29  -1.017  -1.239   0.828
  142    HB2  PHE  29           HB2      PHE  29  -2.116   1.582   0.673
  143    HB3  PHE  29           HB1      PHE  29  -2.844   0.128  -0.010
  144    HD1  PHE  29           HD2      PHE  29  -1.698   1.447   3.300
  145    HD2  PHE  29           HD1      PHE  29  -4.525  -0.879   1.136
  146    HE1  PHE  29           HE2      PHE  29  -2.979   1.088   5.367
  147    HE2  PHE  29           HE1      PHE  29  -5.813  -1.239   3.202
  148    HZ   PHE  29           HZ       PHE  29  -5.038  -0.260   5.321
  149    H    ILE  30           HN       ILE  30  -0.152  -1.745  -1.028
  150    HA   ILE  30           HA       ILE  30   1.270   0.348  -2.509
  151    HB   ILE  30           HB       ILE  30   1.578  -2.606  -2.998
  152   HG12  ILE  30          HG12      ILE  30   3.329  -0.922  -1.249
  153   HG13  ILE  30          HG11      ILE  30   2.087  -1.979  -0.598
  154   HG21  ILE  30          HG21      ILE  30   3.729  -1.896  -3.938
  155   HG22  ILE  30          HG22      ILE  30   3.348  -0.220  -3.540
  156   HG23  ILE  30          HG23      ILE  30   2.379  -1.085  -4.733
  157   HD11  ILE  30          HD11      ILE  30   4.467  -2.826  -2.235
  158   HD12  ILE  30          HD12      ILE  30   3.217  -3.898  -1.604
  159   HD13  ILE  30          HD13      ILE  30   4.273  -3.025  -0.493
  160    H    ASP  31           HN       ASP  31   0.700   0.887  -4.451
  161    HA   ASP  31           HA       ASP  31  -1.472  -0.509  -5.814
  162    HB2  ASP  31           HB2      ASP  31  -1.825   1.757  -6.135
  163    HB3  ASP  31           HB1      ASP  31  -0.101   2.124  -6.181
  164    H    HIS  32           HN       HIS  32  -0.959  -2.205  -6.912
  165    HA   HIS  32           HA       HIS  32   1.779  -2.584  -7.844
  166    HB2  HIS  32           HB2      HIS  32  -0.554  -4.476  -7.488
  167    HB3  HIS  32           HB1      HIS  32   0.972  -4.966  -8.205
  168    HD1  HIS  32           HD1      HIS  32   1.629  -6.594  -6.302
  169    HD2  HIS  32           HD2      HIS  32   0.893  -2.704  -5.019
  170    HE1  HIS  32           HE1      HIS  32   2.437  -6.465  -3.906
  171    HE2  HIS  32           HE2      HIS  32   1.771  -4.197  -3.117
  172    H    ASN  33           HN       ASN  33  -0.919  -1.257  -9.097
  173    HA   ASN  33           HA       ASN  33  -0.766  -2.475 -11.728
  174    HB2  ASN  33           HB2      ASN  33  -2.228   0.068 -10.996
  175    HB3  ASN  33           HB1      ASN  33  -2.507  -0.967 -12.390
  176   HD21  ASN  33          HD21      ASN  33  -3.036  -0.474  -9.027
  177   HD22  ASN  33          HD22      ASN  33  -4.230  -1.727  -8.817
  178    H    THR  34           HN       THR  34   0.615   0.130  -9.976
  179    HA   THR  34           HA       THR  34   2.119   0.890 -12.370
  180    HB   THR  34           HB       THR  34   1.033   2.911 -10.397
  181    HG1  THR  34           HG1      THR  34  -0.416   1.725 -12.044
  182   HG21  THR  34          HG21      THR  34   3.128   3.591 -11.467
  183   HG22  THR  34          HG22      THR  34   1.774   4.552 -12.059
  184   HG23  THR  34          HG23      THR  34   2.432   3.251 -13.051
  185    H    LYS  35           HN       LYS  35   2.152   2.158  -9.027
  186    HA   LYS  35           HA       LYS  35   4.312   0.781  -8.001
  187    HB2  LYS  35           HB2      LYS  35   6.163   2.492  -8.318
  188    HB3  LYS  35           HB1      LYS  35   5.776   1.503  -9.715
  189    HG2  LYS  35           HG2      LYS  35   6.131   3.703 -10.496
  190    HG3  LYS  35           HG1      LYS  35   4.395   3.414 -10.573
  191    HD2  LYS  35           HD2      LYS  35   4.071   4.674  -8.517
  192    HD3  LYS  35           HD1      LYS  35   5.813   4.917  -8.369
  193    HE2  LYS  35           HE2      LYS  35   4.144   5.876 -10.686
  194    HE3  LYS  35           HE1      LYS  35   4.591   6.873  -9.301
  195    HZ1  LYS  35           HZ1      LYS  35   6.914   6.575  -9.859
  196    HZ2  LYS  35           HZ2      LYS  35   6.077   7.206 -11.193
  197    HZ3  LYS  35           HZ3      LYS  35   6.506   5.567 -11.167
  198    H    THR  36           HN       THR  36   1.889   2.246  -7.200
  199    HA   THR  36           HA       THR  36   2.913   4.684  -5.930
  200    HB   THR  36           HB       THR  36   0.059   3.860  -5.690
  201    HG1  THR  36           HG1      THR  36   0.353   3.566  -7.886
  202   HG21  THR  36          HG21      THR  36  -0.307   6.276  -5.886
  203   HG22  THR  36          HG22      THR  36   1.424   6.515  -6.121
  204   HG23  THR  36          HG23      THR  36   0.820   5.893  -4.585
  205    H    THR  37           HN       THR  37   2.581   5.116  -3.687
  206    HA   THR  37           HA       THR  37   2.014   2.776  -2.030
  207    HB   THR  37           HB       THR  37   4.039   3.388  -0.602
  208    HG1  THR  37           HG1      THR  37   5.747   4.394  -1.829
  209   HG21  THR  37          HG21      THR  37   5.556   2.029  -1.969
  210   HG22  THR  37          HG22      THR  37   4.486   2.234  -3.357
  211   HG23  THR  37          HG23      THR  37   3.928   1.351  -1.935
  212    H    THR  38           HN       THR  38   0.915   3.220  -0.225
  213    HA   THR  38           HA       THR  38   0.989   5.877   0.964
  214    HB   THR  38           HB       THR  38  -0.775   6.128  -0.699
  215    HG1  THR  38           HG1      THR  38  -2.627   6.203   1.027
  216   HG21  THR  38          HG21      THR  38  -2.795   4.737  -0.650
  217   HG22  THR  38          HG22      THR  38  -2.074   3.732   0.608
  218   HG23  THR  38          HG23      THR  38  -1.362   3.773  -1.005
  219    H    TRP  39           HN       TRP  39   0.230   5.869   3.171
  220    HA   TRP  39           HA       TRP  39   0.137   3.188   4.339
  221    HB2  TRP  39           HB2      TRP  39   0.078   5.840   5.781
  222    HB3  TRP  39           HB1      TRP  39   0.355   4.256   6.492
  223    HD1  TRP  39           HD1      TRP  39   2.059   7.080   4.720
  224    HE1  TRP  39           HE1      TRP  39   4.619   6.629   4.688
  225    HE3  TRP  39           HE3      TRP  39   2.056   2.250   6.369
  226    HZ2  TRP  39           HZ2      TRP  39   6.374   4.483   5.291
  227    HZ3  TRP  39           HZ3      TRP  39   4.197   1.071   6.620
  228    HH2  TRP  39           HH2      TRP  39   6.305   2.164   6.091
  229    H    GLU  40           HN       GLU  40  -1.970   5.540   3.254
  230    HA   GLU  40           HA       GLU  40  -3.932   4.967   5.315
  231    HB2  GLU  40           HB2      GLU  40  -5.174   6.898   4.402
  232    HB3  GLU  40           HB1      GLU  40  -3.541   7.282   4.942
  233    HG2  GLU  40           HG2      GLU  40  -3.881   8.498   2.999
  234    HG3  GLU  40           HG1      GLU  40  -2.830   7.164   2.546
  235    H    ASP  41           HN       ASP  41  -6.229   4.719   4.554
  236    HA   ASP  41           HA       ASP  41  -6.003   2.297   2.916
  237    HB2  ASP  41           HB2      ASP  41  -6.708   2.265   5.371
  238    HB3  ASP  41           HB1      ASP  41  -8.202   3.007   4.851
  239    HA   PRO  42           HA       PRO  42  -8.556   4.243  -0.218
  240    HB2  PRO  42           HB2      PRO  42  -9.085   1.995  -1.659
  241    HB3  PRO  42           HB1      PRO  42  -7.545   2.857  -1.744
  242    HG2  PRO  42           HG2      PRO  42  -8.263   0.422  -0.150
  243    HG3  PRO  42           HG1      PRO  42  -6.816   0.726  -1.130
  244    HD2  PRO  42           HD2      PRO  42  -6.780   0.994   1.546
  245    HD3  PRO  42           HD1      PRO  42  -5.851   2.081   0.492
  246    H    ARG  43           HN       ARG  43  -9.505   1.799   1.991
  247    HA   ARG  43           HA       ARG  43 -12.287   1.726   1.227
  248    HB2  ARG  43           HB2      ARG  43 -11.664  -0.219   2.264
  249    HB3  ARG  43           HB1      ARG  43 -10.570   0.582   3.370
  250    HG2  ARG  43           HG2      ARG  43 -12.544   1.398   4.637
  251    HG3  ARG  43           HG1      ARG  43 -13.567   0.428   3.571
  252    HD2  ARG  43           HD2      ARG  43 -12.881  -0.623   5.786
  253    HD3  ARG  43           HD1      ARG  43 -12.639  -1.587   4.327
  254    HE   ARG  43           HE       ARG  43 -10.270  -0.213   4.761
  255   HH11  ARG  43          HH11      ARG  43 -12.204  -2.585   6.478
  256   HH12  ARG  43          HH12      ARG  43 -10.824  -3.332   7.229
  257   HH21  ARG  43          HH21      ARG  43  -8.469  -1.185   5.746
  258   HH22  ARG  43          HH22      ARG  43  -8.706  -2.546   6.822
  259    H    LEU  44           HN       LEU  44 -10.268   3.796   2.969
  260    HA   LEU  44           HA       LEU  44 -12.322   5.016   4.545
  261    HB2  LEU  44           HB2      LEU  44  -9.507   5.840   3.897
  262    HB3  LEU  44           HB1      LEU  44 -10.575   6.828   4.871
  263    HG   LEU  44           HG       LEU  44  -9.770   4.012   5.577
  264   HD11  LEU  44          HD11      LEU  44  -8.323   5.043   7.258
  265   HD12  LEU  44          HD12      LEU  44  -8.721   6.637   6.616
  266   HD13  LEU  44          HD13      LEU  44  -7.831   5.483   5.622
  267   HD21  LEU  44          HD21      LEU  44 -11.908   4.691   6.519
  268   HD22  LEU  44          HD22      LEU  44 -11.171   6.159   7.161
  269   HD23  LEU  44          HD23      LEU  44 -10.676   4.582   7.775
  270    H    LYS  45           HN       LYS  45 -11.567   4.985   1.396
  271    HA   LYS  45           HA       LYS  45 -12.589   7.667   0.811
  272    HB2  LYS  45           HB2      LYS  45 -11.433   5.560  -1.036
  273    HB3  LYS  45           HB1      LYS  45 -11.958   7.161  -1.533
  274    HG2  LYS  45           HG2      LYS  45  -9.711   6.563   0.376
  275    HG3  LYS  45           HG1      LYS  45  -9.538   7.023  -1.318
  276    HD2  LYS  45           HD2      LYS  45 -10.737   9.143  -0.790
  277    HD3  LYS  45           HD1      LYS  45 -10.699   8.681   0.913
  278    HE2  LYS  45           HE2      LYS  45  -8.245   8.611   0.818
  279    HE3  LYS  45           HE1      LYS  45  -8.306   9.118  -0.870
  280    HZ1  LYS  45           HZ1      LYS  45  -9.489  11.143  -0.097
  281    HZ2  LYS  45           HZ2      LYS  45  -7.893  11.022   0.451
  282    HZ3  LYS  45           HZ3      LYS  45  -9.176  10.667   1.503
  283    H    GLN 112           H        GLN 112   7.592   6.827   6.854
  284    HA   GLN 112           HA       GLN 112   7.997   9.242   5.191
  285    HB2  GLN 112           HB2      GLN 112  10.163   8.333   4.647
  286    HB3  GLN 112           HB1      GLN 112  10.027   8.469   6.391
  287    HG2  GLN 112           HG2      GLN 112   9.588   5.908   4.879
  288    HG3  GLN 112           HG1      GLN 112  11.139   6.397   5.557
  289   HE21  GLN 112          HE21      GLN 112  11.390   6.454   7.800
  290   HE22  GLN 112          HE22      GLN 112  10.312   5.609   8.854
  291    H    ILE 113           HN       ILE 113   8.871   8.336   3.010
  292    HA   ILE 113           HA       ILE 113   6.824   7.420   1.486
  293    HB   ILE 113           HB       ILE 113   9.720   6.755   0.976
  294   HG12  ILE 113          HG12      ILE 113   8.157   9.220   0.172
  295   HG13  ILE 113          HG11      ILE 113   9.311   9.161   1.501
  296   HG21  ILE 113          HG21      ILE 113   9.071   6.812  -1.388
  297   HG22  ILE 113          HG22      ILE 113   7.397   7.102  -0.920
  298   HG23  ILE 113          HG23      ILE 113   8.177   5.576  -0.502
  299   HD11  ILE 113          HD11      ILE 113  10.297  10.151  -0.478
  300   HD12  ILE 113          HD12      ILE 113   9.934   8.694  -1.406
  301   HD13  ILE 113          HD13      ILE 113  11.092   8.630  -0.077
  302    HA   PRO 114           HA       PRO 114   6.323   3.127   2.837
  303    HB2  PRO 114           HB2      PRO 114   4.446   3.063   0.571
  304    HB3  PRO 114           HB1      PRO 114   4.162   2.696   2.273
  305    HG2  PRO 114           HG2      PRO 114   3.213   4.926   1.113
  306    HG3  PRO 114           HG1      PRO 114   3.730   4.892   2.808
  307    HD2  PRO 114           HD2      PRO 114   5.132   5.998   0.416
  308    HD3  PRO 114           HD1      PRO 114   5.080   6.605   2.084
  309    HA   PRO 115           HA       PRO 115   9.086   1.229  -0.210
  310    HB2  PRO 115           HB2      PRO 115   8.045  -1.239   1.070
  311    HB3  PRO 115           HB1      PRO 115   9.714  -0.727   0.807
  312    HG2  PRO 115           HG2      PRO 115   8.603  -0.645   3.236
  313    HG3  PRO 115           HG1      PRO 115   9.744   0.602   2.697
  314    HD2  PRO 115           HD2      PRO 115   6.778   0.726   2.956
  315    HD3  PRO 115           HD1      PRO 115   8.004   1.982   3.236
  316    HA   PRO 116           HA       PRO 116   6.093   0.132  -3.451
  317    HB2  PRO 116           HB2      PRO 116   8.292  -0.876  -4.916
  318    HB3  PRO 116           HB1      PRO 116   7.530   0.712  -5.106
  319    HG2  PRO 116           HG2      PRO 116   9.869  -0.094  -3.437
  320    HG3  PRO 116           HG1      PRO 116   9.646   1.361  -4.446
  321    HD2  PRO 116           HD2      PRO 116   9.243   1.629  -1.946
  322    HD3  PRO 116           HD1      PRO 116   7.977   2.184  -3.014
  323    H    TYR 117           HN       TYR 117   6.309  -1.400  -4.810
  324    HA   TYR 117           HA       TYR 117   6.070  -4.018  -3.475
  325    HB2  TYR 117           HB2      TYR 117   4.442  -4.664  -5.001
  326    HB3  TYR 117           HB1      TYR 117   4.136  -2.946  -4.815
  327    HD1  TYR 117           HD1      TYR 117   4.716  -1.381  -6.679
  328    HD2  TYR 117           HD2      TYR 117   5.127  -5.598  -7.074
  329    HE1  TYR 117           HE1      TYR 117   4.823  -1.142  -9.128
  330    HE2  TYR 117           HE2      TYR 117   5.239  -5.370  -9.511
  331    HH   TYR 117           HH       TYR 117   4.515  -3.759 -11.248
  332    H    VAL 118           HN       VAL 118   7.607  -5.511  -3.747
  333    HA   VAL 118           HA       VAL 118   9.325  -5.391  -6.118
  334    HB   VAL 118           HB       VAL 118  10.709  -7.085  -4.959
  335   HG11  VAL 118          HG11      VAL 118  11.212  -4.726  -4.661
  336   HG12  VAL 118          HG12      VAL 118  11.554  -5.624  -3.181
  337   HG13  VAL 118          HG13      VAL 118  10.093  -4.643  -3.302
  338   HG21  VAL 118          HG21      VAL 118   8.759  -6.733  -2.682
  339   HG22  VAL 118          HG22      VAL 118  10.265  -7.646  -2.622
  340   HG23  VAL 118          HG23      VAL 118   8.950  -8.184  -3.665
  341    H    GLU 119           HN       GLU 119   6.490  -6.635  -5.279
  342    HA   GLU 119           HA       GLU 119   6.696  -8.901  -7.103
  343    HB2  GLU 119           HB2      GLU 119   5.156 -10.142  -5.464
  344    HB3  GLU 119           HB1      GLU 119   6.863 -10.037  -5.069
  345    HG2  GLU 119           HG2      GLU 119   6.404  -8.207  -3.521
  346    HG3  GLU 119           HG1      GLU 119   4.687  -8.297  -3.912
  347    HA   PRO 120           HA       PRO 120   3.111  -6.748  -8.628
  348    HB2  PRO 120           HB2      PRO 120   2.727  -9.076 -10.366
  349    HB3  PRO 120           HB1      PRO 120   3.112  -7.409 -10.801
  350    HG2  PRO 120           HG2      PRO 120   4.900  -9.417 -11.044
  351    HG3  PRO 120           HG1      PRO 120   5.382  -7.757 -10.649
  352    HD2  PRO 120           HD2      PRO 120   5.080 -10.127  -8.839
  353    HD3  PRO 120           HD1      PRO 120   6.333  -8.866  -8.848
  Start of MODEL    3
    1    H    PHE  12           H        PHE  12 -10.569  -6.434   0.985
    2    HA   PHE  12           HA       PHE  12 -11.745  -6.359  -1.024
    3    HB2  PHE  12           HB2      PHE  12 -13.749  -4.842  -1.253
    4    HB3  PHE  12           HB1      PHE  12 -14.019  -6.302  -0.316
    5    HD1  PHE  12           HD2      PHE  12 -14.080  -6.126   2.202
    6    HD2  PHE  12           HD1      PHE  12 -14.151  -2.717  -0.346
    7    HE1  PHE  12           HE2      PHE  12 -14.989  -4.772   4.044
    8    HE2  PHE  12           HE1      PHE  12 -15.060  -1.359   1.491
    9    HZ   PHE  12           HZ       PHE  12 -15.480  -2.386   3.688
   10    H    LEU  13           HN       LEU  13  -9.913  -5.441  -1.694
   11    HA   LEU  13           HA       LEU  13  -9.759  -2.502  -1.493
   12    HB2  LEU  13           HB2      LEU  13  -7.553  -4.557  -1.510
   13    HB3  LEU  13           HB1      LEU  13  -7.256  -2.886  -1.925
   14    HG   LEU  13           HG       LEU  13  -6.600  -3.110   0.320
   15   HD11  LEU  13          HD11      LEU  13  -7.880  -1.099  -0.083
   16   HD12  LEU  13          HD12      LEU  13  -8.157  -1.687   1.556
   17   HD13  LEU  13          HD13      LEU  13  -9.376  -1.948   0.308
   18   HD21  LEU  13          HD21      LEU  13  -8.007  -4.070   2.071
   19   HD22  LEU  13          HD22      LEU  13  -7.648  -5.245   0.807
   20   HD23  LEU  13          HD23      LEU  13  -9.232  -4.471   0.867
   21    HA   PRO  14           HA       PRO  14  -9.766  -2.170  -5.976
   22    HB2  PRO  14           HB2      PRO  14  -7.366  -0.544  -5.285
   23    HB3  PRO  14           HB1      PRO  14  -8.586  -0.251  -6.532
   24    HG2  PRO  14           HG2      PRO  14  -8.817   0.983  -4.378
   25    HG3  PRO  14           HG1      PRO  14 -10.248   0.120  -4.902
   26    HD2  PRO  14           HD2      PRO  14  -8.243  -0.657  -2.785
   27    HD3  PRO  14           HD1      PRO  14 -10.022  -0.753  -2.716
   28    H    LYS  15           HN       LYS  15  -8.662  -2.633  -7.669
   29    HA   LYS  15           HA       LYS  15  -7.208  -5.090  -7.303
   30    HB2  LYS  15           HB2      LYS  15  -8.114  -3.618  -9.759
   31    HB3  LYS  15           HB1      LYS  15  -7.090  -5.048  -9.864
   32    HG2  LYS  15           HG2      LYS  15  -9.865  -4.854  -8.727
   33    HG3  LYS  15           HG1      LYS  15  -9.313  -5.769 -10.130
   34    HD2  LYS  15           HD2      LYS  15  -7.990  -7.220  -8.705
   35    HD3  LYS  15           HD1      LYS  15  -8.456  -6.282  -7.287
   36    HE2  LYS  15           HE2      LYS  15  -9.744  -8.365  -7.491
   37    HE3  LYS  15           HE1      LYS  15 -10.771  -6.934  -7.580
   38    HZ1  LYS  15           HZ1      LYS  15 -11.041  -7.194  -9.877
   39    HZ2  LYS  15           HZ2      LYS  15 -11.217  -8.760  -9.248
   40    HZ3  LYS  15           HZ3      LYS  15  -9.766  -8.307 -10.002
   41    H    GLY  16           HN       GLY  16  -5.156  -5.498  -7.393
   42    HA2  GLY  16           HA2      GLY  16  -2.878  -5.187  -7.734
   43    HA3  GLY  16           HA1      GLY  16  -3.209  -3.641  -8.497
   44    H    TRP  17           HN       TRP  17  -4.943  -3.458  -5.760
   45    HA   TRP  17           HA       TRP  17  -2.808  -2.084  -4.334
   46    HB2  TRP  17           HB2      TRP  17  -5.789  -2.226  -3.958
   47    HB3  TRP  17           HB1      TRP  17  -4.737  -1.550  -2.721
   48    HD1  TRP  17           HD1      TRP  17  -5.619  -0.917  -6.459
   49    HE1  TRP  17           HE1      TRP  17  -5.417   1.607  -6.869
   50    HE3  TRP  17           HE3      TRP  17  -3.801   0.530  -1.893
   51    HZ2  TRP  17           HZ2      TRP  17  -4.561   3.905  -5.479
   52    HZ3  TRP  17           HZ3      TRP  17  -3.302   2.912  -1.526
   53    HH2  TRP  17           HH2      TRP  17  -3.676   4.564  -3.288
   54    H    GLU  18           HN       GLU  18  -1.732  -2.943  -2.734
   55    HA   GLU  18           HA       GLU  18  -2.805  -5.381  -1.497
   56    HB2  GLU  18           HB2      GLU  18  -0.165  -4.847  -2.685
   57    HB3  GLU  18           HB1      GLU  18  -0.218  -5.882  -1.291
   58    HG2  GLU  18           HG2      GLU  18  -1.940  -7.247  -2.485
   59    HG3  GLU  18           HG1      GLU  18  -1.617  -6.261  -3.907
   60    H    VAL  19           HN       VAL  19  -2.518  -5.692   0.529
   61    HA   VAL  19           HA       VAL  19  -1.444  -3.473   2.150
   62    HB   VAL  19           HB       VAL  19  -3.432  -5.521   3.117
   63   HG11  VAL  19          HG11      VAL  19  -3.928  -3.842   4.819
   64   HG12  VAL  19          HG12      VAL  19  -2.716  -2.773   4.113
   65   HG13  VAL  19          HG13      VAL  19  -2.225  -4.307   4.836
   66   HG21  VAL  19          HG21      VAL  19  -4.444  -4.410   1.212
   67   HG22  VAL  19          HG22      VAL  19  -4.051  -2.837   1.901
   68   HG23  VAL  19          HG23      VAL  19  -5.213  -3.889   2.710
   69    H    ARG  20           HN       ARG  20   0.629  -4.125   2.583
   70    HA   ARG  20           HA       ARG  20   0.908  -6.801   3.804
   71    HB2  ARG  20           HB2      ARG  20   2.147  -6.359   1.574
   72    HB3  ARG  20           HB1      ARG  20   3.176  -5.281   2.519
   73    HG2  ARG  20           HG2      ARG  20   4.394  -7.201   2.655
   74    HG3  ARG  20           HG1      ARG  20   3.391  -7.381   4.086
   75    HD2  ARG  20           HD2      ARG  20   3.054  -9.436   3.179
   76    HD3  ARG  20           HD1      ARG  20   1.775  -8.560   2.345
   77    HE   ARG  20           HE       ARG  20   4.378  -9.294   1.174
   78   HH11  ARG  20          HH11      ARG  20   1.036  -8.334   0.784
   79   HH12  ARG  20          HH12      ARG  20   1.000  -8.665  -0.925
   80   HH21  ARG  20          HH21      ARG  20   4.335  -9.793  -1.066
   81   HH22  ARG  20          HH22      ARG  20   2.860  -9.544  -1.960
   82    H    HIS  21           HN       HIS  21   2.108  -6.945   5.729
   83    HA   HIS  21           HA       HIS  21   2.482  -4.407   7.137
   84    HB2  HIS  21           HB2      HIS  21   2.185  -7.230   7.970
   85    HB3  HIS  21           HB1      HIS  21   3.311  -6.283   8.922
   86    HD1  HIS  21           HD1      HIS  21   0.717  -7.495  10.058
   87    HD2  HIS  21           HD2      HIS  21   1.065  -3.497   8.792
   88    HE1  HIS  21           HE1      HIS  21  -0.994  -6.187  11.342
   89    HE2  HIS  21           HE2      HIS  21  -0.916  -3.883  10.398
   90    H    ALA  22           HN       ALA  22   4.355  -3.432   6.836
   91    HA   ALA  22           HA       ALA  22   6.738  -4.758   5.995
   92    HB1  ALA  22           HB1      ALA  22   7.783  -2.555   6.274
   93    HB2  ALA  22           HB2      ALA  22   6.329  -1.970   7.085
   94    HB3  ALA  22           HB3      ALA  22   6.263  -2.437   5.386
   95    HA   PRO  23           HA       PRO  23   8.775  -5.896   9.795
   96    HB2  PRO  23           HB2      PRO  23  10.991  -4.033   9.112
   97    HB3  PRO  23           HB1      PRO  23  11.046  -5.757   9.500
   98    HG2  PRO  23           HG2      PRO  23  11.341  -4.931   6.992
   99    HG3  PRO  23           HG1      PRO  23  10.408  -6.393   7.361
  100    HD2  PRO  23           HD2      PRO  23   9.442  -3.661   6.632
  101    HD3  PRO  23           HD1      PRO  23   8.799  -5.248   6.165
  102    H    ASN  24           HN       ASN  24   7.966  -2.689   9.150
  103    HA   ASN  24           HA       ASN  24   8.843  -1.525  11.637
  104    HB2  ASN  24           HB2      ASN  24   8.644  -0.227   9.490
  105    HB3  ASN  24           HB1      ASN  24   6.902  -0.436   9.575
  106   HD21  ASN  24          HD21      ASN  24   6.564   1.775   9.641
  107   HD22  ASN  24          HD22      ASN  24   6.909   2.725  11.041
  108    H    GLY  25           HN       GLY  25   6.418  -3.549  10.603
  109    HA2  GLY  25           HA2      GLY  25   4.745  -4.525  11.884
  110    HA3  GLY  25           HA1      GLY  25   5.014  -3.289  13.099
  111    H    ARG  26           HN       ARG  26   4.404  -2.686   9.709
  112    HA   ARG  26           HA       ARG  26   1.766  -1.582  10.353
  113    HB2  ARG  26           HB2      ARG  26   4.054  -0.054   9.073
  114    HB3  ARG  26           HB1      ARG  26   2.399   0.526   9.109
  115    HG2  ARG  26           HG2      ARG  26   4.142  -0.002  11.509
  116    HG3  ARG  26           HG1      ARG  26   3.776   1.579  10.820
  117    HD2  ARG  26           HD2      ARG  26   1.465   1.367  11.389
  118    HD3  ARG  26           HD1      ARG  26   1.686  -0.316  11.869
  119    HE   ARG  26           HE       ARG  26   3.408   1.105  13.460
  120   HH11  ARG  26          HH11      ARG  26  -0.051   1.136  12.879
  121   HH12  ARG  26          HH12      ARG  26  -0.435   1.675  14.488
  122   HH21  ARG  26          HH21      ARG  26   2.897   1.836  15.551
  123   HH22  ARG  26          HH22      ARG  26   1.241   2.092  15.998
  124    HA   PRO  27           HA       PRO  27   0.998  -3.034   6.176
  125    HB2  PRO  27           HB2      PRO  27  -1.519  -2.149   5.920
  126    HB3  PRO  27           HB1      PRO  27  -1.150  -3.446   7.059
  127    HG2  PRO  27           HG2      PRO  27  -1.474  -0.507   7.591
  128    HG3  PRO  27           HG1      PRO  27  -2.191  -1.877   8.466
  129    HD2  PRO  27           HD2      PRO  27   0.054  -0.670   9.345
  130    HD3  PRO  27           HD1      PRO  27  -0.238  -2.356   9.574
  131    H    PHE  28           HN       PHE  28   2.090  -1.934   4.687
  132    HA   PHE  28           HA       PHE  28   1.216   0.767   3.999
  133    HB2  PHE  28           HB2      PHE  28   3.250   0.907   2.616
  134    HB3  PHE  28           HB1      PHE  28   3.630   0.546   4.287
  135    HD1  PHE  28           HD1      PHE  28   3.519  -2.239   4.623
  136    HD2  PHE  28           HD2      PHE  28   4.737  -0.086   1.151
  137    HE1  PHE  28           HE1      PHE  28   4.893  -4.149   3.923
  138    HE2  PHE  28           HE2      PHE  28   6.095  -2.006   0.447
  139    HZ   PHE  28           HZ       PHE  28   6.180  -4.038   1.830
  140    H    PHE  29           HN       PHE  29  -0.032   1.080   2.331
  141    HA   PHE  29           HA       PHE  29  -0.962  -1.261   0.881
  142    HB2  PHE  29           HB2      PHE  29  -2.020   1.580   0.876
  143    HB3  PHE  29           HB1      PHE  29  -2.784   0.192   0.110
  144    HD1  PHE  29           HD2      PHE  29  -1.542   1.208   3.489
  145    HD2  PHE  29           HD1      PHE  29  -4.522  -0.783   1.201
  146    HE1  PHE  29           HE2      PHE  29  -2.824   0.772   5.543
  147    HE2  PHE  29           HE1      PHE  29  -5.809  -1.217   3.249
  148    HZ   PHE  29           HZ       PHE  29  -4.962  -0.440   5.424
  149    H    ILE  30           HN       ILE  30  -0.022  -1.743  -0.920
  150    HA   ILE  30           HA       ILE  30   1.347   0.343  -2.432
  151    HB   ILE  30           HB       ILE  30   1.479  -2.613  -2.988
  152   HG12  ILE  30          HG12      ILE  30   3.354  -0.997  -1.287
  153   HG13  ILE  30          HG11      ILE  30   2.151  -2.087  -0.619
  154   HG21  ILE  30          HG21      ILE  30   3.293  -0.274  -3.597
  155   HG22  ILE  30          HG22      ILE  30   2.244  -1.106  -4.745
  156   HG23  ILE  30          HG23      ILE  30   3.615  -1.953  -4.028
  157   HD11  ILE  30          HD11      ILE  30   4.338  -3.131  -0.655
  158   HD12  ILE  30          HD12      ILE  30   4.465  -2.847  -2.391
  159   HD13  ILE  30          HD13      ILE  30   3.246  -3.957  -1.765
  160    H    ASP  31           HN       ASP  31   0.592   1.077  -4.208
  161    HA   ASP  31           HA       ASP  31  -1.518  -0.332  -5.651
  162    HB2  ASP  31           HB2      ASP  31  -1.996   1.952  -5.673
  163    HB3  ASP  31           HB1      ASP  31  -0.308   2.404  -5.883
  164    H    HIS  32           HN       HIS  32  -0.806  -1.967  -6.745
  165    HA   HIS  32           HA       HIS  32   1.911  -2.104  -7.691
  166    HB2  HIS  32           HB2      HIS  32  -0.401  -4.047  -7.684
  167    HB3  HIS  32           HB1      HIS  32   1.139  -4.431  -8.433
  168    HD1  HIS  32           HD1      HIS  32   2.195  -6.096  -6.836
  169    HD2  HIS  32           HD2      HIS  32   0.589  -2.810  -4.855
  170    HE1  HIS  32           HE1      HIS  32   2.823  -6.346  -4.389
  171    HE2  HIS  32           HE2      HIS  32   1.617  -4.502  -3.227
  172    H    ASN  33           HN       ASN  33  -0.712  -0.641  -8.914
  173    HA   ASN  33           HA       ASN  33  -0.396  -1.505 -11.674
  174    HB2  ASN  33           HB2      ASN  33  -2.125   0.736 -10.608
  175    HB3  ASN  33           HB1      ASN  33  -2.226  -0.006 -12.198
  176   HD21  ASN  33          HD21      ASN  33  -3.084  -0.208  -8.884
  177   HD22  ASN  33          HD22      ASN  33  -4.111  -1.609  -9.017
  178    H    THR  34           HN       THR  34   0.131   1.422  -9.715
  179    HA   THR  34           HA       THR  34   1.561   2.590 -12.017
  180    HB   THR  34           HB       THR  34   0.717   4.449  -9.908
  181    HG1  THR  34           HG1      THR  34  -1.082   3.059  -9.858
  182   HG21  THR  34          HG21      THR  34  -0.045   5.743 -11.849
  183   HG22  THR  34          HG22      THR  34   0.288   4.366 -12.898
  184   HG23  THR  34          HG23      THR  34   1.612   5.178 -12.063
  185    H    LYS  35           HN       LYS  35   2.308   1.019  -9.327
  186    HA   LYS  35           HA       LYS  35   4.280   0.792  -8.180
  187    HB2  LYS  35           HB2      LYS  35   5.322   1.517 -10.336
  188    HB3  LYS  35           HB1      LYS  35   5.221   3.180  -9.790
  189    HG2  LYS  35           HG2      LYS  35   7.383   2.725  -9.276
  190    HG3  LYS  35           HG1      LYS  35   6.615   2.258  -7.762
  191    HD2  LYS  35           HD2      LYS  35   8.011   0.464  -8.164
  192    HD3  LYS  35           HD1      LYS  35   6.490  -0.097  -8.861
  193    HE2  LYS  35           HE2      LYS  35   8.657   1.253 -10.464
  194    HE3  LYS  35           HE1      LYS  35   8.550  -0.492 -10.262
  195    HZ1  LYS  35           HZ1      LYS  35   6.445   1.222 -11.484
  196    HZ2  LYS  35           HZ2      LYS  35   6.403  -0.466 -11.335
  197    HZ3  LYS  35           HZ3      LYS  35   7.551   0.264 -12.339
  198    H    THR  36           HN       THR  36   2.027   2.696  -7.431
  199    HA   THR  36           HA       THR  36   3.526   4.742  -5.941
  200    HB   THR  36           HB       THR  36   1.395   5.903  -5.615
  201    HG1  THR  36           HG1      THR  36   0.261   3.819  -7.219
  202   HG21  THR  36          HG21      THR  36   0.979   6.544  -7.948
  203   HG22  THR  36          HG22      THR  36   1.896   5.139  -8.491
  204   HG23  THR  36          HG23      THR  36   2.705   6.426  -7.600
  205    H    THR  37           HN       THR  37   3.129   5.089  -3.688
  206    HA   THR  37           HA       THR  37   1.913   2.774  -2.350
  207    HB   THR  37           HB       THR  37   3.697   3.331  -0.524
  208    HG1  THR  37           HG1      THR  37   5.637   4.089  -1.461
  209   HG21  THR  37          HG21      THR  37   5.188   1.677  -1.554
  210   HG22  THR  37          HG22      THR  37   4.351   1.888  -3.091
  211   HG23  THR  37          HG23      THR  37   3.493   1.213  -1.706
  212    H    THR  38           HN       THR  38   0.984   3.107  -0.329
  213    HA   THR  38           HA       THR  38   0.552   5.843   0.583
  214    HB   THR  38           HB       THR  38  -1.631   3.996  -0.412
  215    HG1  THR  38           HG1      THR  38  -0.262   5.908  -1.590
  216   HG21  THR  38          HG21      THR  38  -1.868   6.565   1.142
  217   HG22  THR  38          HG22      THR  38  -2.459   4.965   1.602
  218   HG23  THR  38          HG23      THR  38  -3.191   5.821   0.246
  219    H    TRP  39           HN       TRP  39  -0.125   5.914   2.823
  220    HA   TRP  39           HA       TRP  39   0.273   3.403   4.274
  221    HB2  TRP  39           HB2      TRP  39  -0.182   6.218   5.257
  222    HB3  TRP  39           HB1      TRP  39  -0.008   4.826   6.312
  223    HD1  TRP  39           HD1      TRP  39   1.881   7.513   4.788
  224    HE1  TRP  39           HE1      TRP  39   4.425   7.119   5.098
  225    HE3  TRP  39           HE3      TRP  39   1.745   2.609   6.160
  226    HZ2  TRP  39           HZ2      TRP  39   6.132   4.953   5.860
  227    HZ3  TRP  39           HZ3      TRP  39   3.843   1.445   6.670
  228    HH2  TRP  39           HH2      TRP  39   5.986   2.584   6.522
  229    H    GLU  40           HN       GLU  40  -2.163   5.709   3.489
  230    HA   GLU  40           HA       GLU  40  -3.949   4.677   5.487
  231    HB2  GLU  40           HB2      GLU  40  -5.337   6.618   4.877
  232    HB3  GLU  40           HB1      GLU  40  -3.687   7.042   5.323
  233    HG2  GLU  40           HG2      GLU  40  -4.101   8.402   3.550
  234    HG3  GLU  40           HG1      GLU  40  -3.227   7.071   2.809
  235    H    ASP  41           HN       ASP  41  -6.295   4.413   4.785
  236    HA   ASP  41           HA       ASP  41  -6.015   2.112   3.007
  237    HB2  ASP  41           HB2      ASP  41  -6.796   1.876   5.391
  238    HB3  ASP  41           HB1      ASP  41  -8.238   2.730   4.944
  239    HA   PRO  42           HA       PRO  42  -8.241   4.338  -0.122
  240    HB2  PRO  42           HB2      PRO  42  -8.537   2.265  -1.867
  241    HB3  PRO  42           HB1      PRO  42  -7.034   3.174  -1.669
  242    HG2  PRO  42           HG2      PRO  42  -7.812   0.524  -0.524
  243    HG3  PRO  42           HG1      PRO  42  -6.260   1.038  -1.211
  244    HD2  PRO  42           HD2      PRO  42  -6.697   0.897   1.456
  245    HD3  PRO  42           HD1      PRO  42  -5.608   2.095   0.730
  246    H    ARG  43           HN       ARG  43  -9.485   1.677   1.659
  247    HA   ARG  43           HA       ARG  43 -12.098   1.680   0.436
  248    HB2  ARG  43           HB2      ARG  43 -11.855  -0.344   1.414
  249    HB3  ARG  43           HB1      ARG  43 -10.709   0.249   2.598
  250    HG2  ARG  43           HG2      ARG  43 -12.701   1.263   3.798
  251    HG3  ARG  43           HG1      ARG  43 -13.703   0.278   2.726
  252    HD2  ARG  43           HD2      ARG  43 -13.218  -0.784   4.927
  253    HD3  ARG  43           HD1      ARG  43 -12.706  -1.737   3.534
  254    HE   ARG  43           HE       ARG  43 -10.451  -0.429   4.105
  255   HH11  ARG  43          HH11      ARG  43 -12.712  -2.008   6.275
  256   HH12  ARG  43          HH12      ARG  43 -11.470  -2.555   7.369
  257   HH21  ARG  43          HH21      ARG  43  -8.829  -1.123   5.545
  258   HH22  ARG  43          HH22      ARG  43  -9.274  -2.047   6.955
  259    H    LEU  44           HN       LEU  44 -10.418   3.491   2.752
  260    HA   LEU  44           HA       LEU  44 -12.660   4.511   4.173
  261    HB2  LEU  44           HB2      LEU  44  -9.796   5.410   4.002
  262    HB3  LEU  44           HB1      LEU  44 -10.976   6.183   5.031
  263    HG   LEU  44           HG       LEU  44 -10.126   3.304   5.248
  264   HD11  LEU  44          HD11      LEU  44  -8.345   4.829   5.909
  265   HD12  LEU  44          HD12      LEU  44  -9.028   4.017   7.317
  266   HD13  LEU  44          HD13      LEU  44  -9.462   5.690   6.968
  267   HD21  LEU  44          HD21      LEU  44 -11.389   3.316   7.330
  268   HD22  LEU  44          HD22      LEU  44 -12.433   3.662   5.950
  269   HD23  LEU  44          HD23      LEU  44 -11.909   4.971   7.011
  270    H    LYS  45           HN       LYS  45 -11.557   4.996   1.163
  271    HA   LYS  45           HA       LYS  45 -12.301   7.806   0.939
  272    HB2  LYS  45           HB2      LYS  45 -11.399   5.913  -1.245
  273    HB3  LYS  45           HB1      LYS  45 -11.498   7.667  -1.343
  274    HG2  LYS  45           HG2      LYS  45  -9.753   7.836   0.384
  275    HG3  LYS  45           HG1      LYS  45  -9.626   6.076   0.391
  276    HD2  LYS  45           HD2      LYS  45  -9.046   6.156  -2.019
  277    HD3  LYS  45           HD1      LYS  45  -9.060   7.919  -1.928
  278    HE2  LYS  45           HE2      LYS  45  -7.283   6.086  -0.320
  279    HE3  LYS  45           HE1      LYS  45  -6.791   7.010  -1.739
  280    HZ1  LYS  45           HZ1      LYS  45  -6.890   8.987  -0.591
  281    HZ2  LYS  45           HZ2      LYS  45  -6.337   7.929   0.616
  282    HZ3  LYS  45           HZ3      LYS  45  -7.966   8.400   0.581
  283    H    GLN 112           H        GLN 112   8.637  10.198   6.516
  284    HA   GLN 112           HA       GLN 112   7.740   7.465   7.219
  285    HB2  GLN 112           HB2      GLN 112   6.128   9.917   6.481
  286    HB3  GLN 112           HB1      GLN 112   5.477   8.304   6.743
  287    HG2  GLN 112           HG2      GLN 112   6.150   8.375   9.066
  288    HG3  GLN 112           HG1      GLN 112   6.897   9.952   8.822
  289   HE21  GLN 112          HE21      GLN 112   5.622  10.958  10.337
  290   HE22  GLN 112          HE22      GLN 112   3.932  11.262  10.090
  291    H    ILE 113           HN       ILE 113   7.900   6.146   5.526
  292    HA   ILE 113           HA       ILE 113   7.276   7.081   2.866
  293    HB   ILE 113           HB       ILE 113   9.618   7.674   2.943
  294   HG12  ILE 113          HG12      ILE 113  10.499   6.217   1.103
  295   HG13  ILE 113          HG11      ILE 113   9.106   5.165   1.334
  296   HG21  ILE 113          HG21      ILE 113  11.379   6.008   3.325
  297   HG22  ILE 113          HG22      ILE 113  10.147   4.818   3.741
  298   HG23  ILE 113          HG23      ILE 113  10.364   6.250   4.747
  299   HD11  ILE 113          HD11      ILE 113   7.619   7.013   0.759
  300   HD12  ILE 113          HD12      ILE 113   8.767   6.667  -0.535
  301   HD13  ILE 113          HD13      ILE 113   9.018   8.059   0.520
  302    HA   PRO 114           HA       PRO 114   6.139   2.730   2.913
  303    HB2  PRO 114           HB2      PRO 114   4.244   2.948   0.968
  304    HB3  PRO 114           HB1      PRO 114   3.953   3.302   2.669
  305    HG2  PRO 114           HG2      PRO 114   4.131   5.131   0.401
  306    HG3  PRO 114           HG1      PRO 114   3.481   5.416   2.021
  307    HD2  PRO 114           HD2      PRO 114   6.042   6.191   0.944
  308    HD3  PRO 114           HD1      PRO 114   5.350   6.563   2.534
  309    HA   PRO 115           HA       PRO 115   8.877   1.721  -0.604
  310    HB2  PRO 115           HB2      PRO 115   8.319  -0.995   0.427
  311    HB3  PRO 115           HB1      PRO 115   9.860  -0.208   0.113
  312    HG2  PRO 115           HG2      PRO 115   9.011  -0.610   2.601
  313    HG3  PRO 115           HG1      PRO 115   9.887   0.868   2.158
  314    HD2  PRO 115           HD2      PRO 115   6.956   0.458   2.593
  315    HD3  PRO 115           HD1      PRO 115   7.996   1.820   3.062
  316    HA   PRO 116           HA       PRO 116   5.684   0.581  -3.608
  317    HB2  PRO 116           HB2      PRO 116   7.743  -0.185  -5.386
  318    HB3  PRO 116           HB1      PRO 116   6.881   1.363  -5.363
  319    HG2  PRO 116           HG2      PRO 116   9.439   0.595  -4.033
  320    HG3  PRO 116           HG1      PRO 116   9.020   2.099  -4.895
  321    HD2  PRO 116           HD2      PRO 116   8.894   2.162  -2.357
  322    HD3  PRO 116           HD1      PRO 116   7.484   2.708  -3.232
  323    H    TYR 117           HN       TYR 117   5.815  -0.846  -5.098
  324    HA   TYR 117           HA       TYR 117   5.565  -3.471  -3.898
  325    HB2  TYR 117           HB2      TYR 117   4.115  -4.059  -5.565
  326    HB3  TYR 117           HB1      TYR 117   3.944  -2.316  -5.618
  327    HD1  TYR 117           HD1      TYR 117   5.223  -5.274  -7.337
  328    HD2  TYR 117           HD2      TYR 117   4.715  -1.056  -7.563
  329    HE1  TYR 117           HE1      TYR 117   5.677  -5.366  -9.740
  330    HE2  TYR 117           HE2      TYR 117   5.175  -1.132  -9.978
  331    HH   TYR 117           HH       TYR 117   5.216  -4.022 -11.759
  332    H    VAL 118           HN       VAL 118   7.208  -4.861  -3.792
  333    HA   VAL 118           HA       VAL 118   9.084  -5.046  -6.032
  334    HB   VAL 118           HB       VAL 118  10.036  -4.962  -3.747
  335   HG11  VAL 118          HG11      VAL 118   8.233  -6.025  -2.523
  336   HG12  VAL 118          HG12      VAL 118   9.761  -6.854  -2.219
  337   HG13  VAL 118          HG13      VAL 118   8.576  -7.562  -3.317
  338   HG21  VAL 118          HG21      VAL 118  11.289  -6.112  -5.473
  339   HG22  VAL 118          HG22      VAL 118  10.430  -7.612  -5.126
  340   HG23  VAL 118          HG23      VAL 118  11.509  -6.915  -3.917
  341    H    GLU 119           HN       GLU 119   6.308  -6.355  -4.703
  342    HA   GLU 119           HA       GLU 119   6.511  -8.961  -6.002
  343    HB2  GLU 119           HB2      GLU 119   4.077  -7.943  -4.581
  344    HB3  GLU 119           HB1      GLU 119   4.692  -9.582  -4.695
  345    HG2  GLU 119           HG2      GLU 119   6.240  -7.527  -3.190
  346    HG3  GLU 119           HG1      GLU 119   4.823  -8.267  -2.453
  347    HA   PRO 120           HA       PRO 120   4.368  -7.005  -9.472
  348    HB2  PRO 120           HB2      PRO 120   4.224  -9.739 -10.547
  349    HB3  PRO 120           HB1      PRO 120   5.013  -8.311 -11.220
  350    HG2  PRO 120           HG2      PRO 120   6.427 -10.363 -10.217
  351    HG3  PRO 120           HG1      PRO 120   6.978  -8.684 -10.067
  352    HD2  PRO 120           HD2      PRO 120   5.626 -10.422  -8.033
  353    HD3  PRO 120           HD1      PRO 120   6.991  -9.302  -7.829
  Start of MODEL    4
    1    H    PHE  12           H        PHE  12  -9.914  -5.864   2.549
    2    HA   PHE  12           HA       PHE  12 -10.397  -6.859   0.480
    3    HB2  PHE  12           HB2      PHE  12 -12.649  -6.589  -0.561
    4    HB3  PHE  12           HB1      PHE  12 -12.657  -7.605   0.872
    5    HD1  PHE  12           HD1      PHE  12 -13.437  -6.554   3.064
    6    HD2  PHE  12           HD2      PHE  12 -14.069  -4.764  -0.745
    7    HE1  PHE  12           HE1      PHE  12 -15.252  -5.191   4.009
    8    HE2  PHE  12           HE2      PHE  12 -15.883  -3.394   0.196
    9    HZ   PHE  12           HZ       PHE  12 -16.477  -3.608   2.577
   10    H    LEU  13           HN       LEU  13  -9.273  -5.618  -0.819
   11    HA   LEU  13           HA       LEU  13  -9.969  -2.753  -0.992
   12    HB2  LEU  13           HB2      LEU  13  -7.256  -4.077  -1.009
   13    HB3  LEU  13           HB1      LEU  13  -7.509  -2.431  -1.549
   14    HG   LEU  13           HG       LEU  13  -6.692  -2.254   0.640
   15   HD11  LEU  13          HD11      LEU  13  -8.570  -0.784   0.213
   16   HD12  LEU  13          HD12      LEU  13  -8.525  -1.266   1.909
   17   HD13  LEU  13          HD13      LEU  13  -9.688  -2.011   0.811
   18   HD21  LEU  13          HD21      LEU  13  -6.971  -4.561   1.338
   19   HD22  LEU  13          HD22      LEU  13  -8.712  -4.322   1.492
   20   HD23  LEU  13          HD23      LEU  13  -7.605  -3.458   2.559
   21    HA   PRO  14           HA       PRO  14  -9.993  -2.833  -5.517
   22    HB2  PRO  14           HB2      PRO  14  -7.776  -0.900  -5.018
   23    HB3  PRO  14           HB1      PRO  14  -8.998  -0.877  -6.294
   24    HG2  PRO  14           HG2      PRO  14  -9.390   0.549  -4.290
   25    HG3  PRO  14           HG1      PRO  14 -10.711  -0.508  -4.724
   26    HD2  PRO  14           HD2      PRO  14  -8.696  -0.823  -2.504
   27    HD3  PRO  14           HD1      PRO  14 -10.447  -1.138  -2.470
   28    H    LYS  15           HN       LYS  15  -8.912  -3.386  -7.159
   29    HA   LYS  15           HA       LYS  15  -7.193  -5.616  -6.743
   30    HB2  LYS  15           HB2      LYS  15  -7.225  -5.956  -9.085
   31    HB3  LYS  15           HB1      LYS  15  -8.810  -5.324  -8.668
   32    HG2  LYS  15           HG2      LYS  15  -8.202  -3.141  -9.492
   33    HG3  LYS  15           HG1      LYS  15  -6.552  -3.688  -9.804
   34    HD2  LYS  15           HD2      LYS  15  -7.445  -5.354 -11.388
   35    HD3  LYS  15           HD1      LYS  15  -9.058  -4.704 -11.118
   36    HE2  LYS  15           HE2      LYS  15  -8.241  -3.727 -13.126
   37    HE3  LYS  15           HE1      LYS  15  -8.181  -2.478 -11.883
   38    HZ1  LYS  15           HZ1      LYS  15  -5.805  -2.978 -11.593
   39    HZ2  LYS  15           HZ2      LYS  15  -6.165  -2.452 -13.163
   40    HZ3  LYS  15           HZ3      LYS  15  -5.891  -4.099 -12.863
   41    H    GLY  16           HN       GLY  16  -5.058  -5.913  -7.113
   42    HA2  GLY  16           HA2      GLY  16  -2.832  -5.374  -7.346
   43    HA3  GLY  16           HA1      GLY  16  -3.309  -3.866  -8.104
   44    H    TRP  17           HN       TRP  17  -4.981  -3.702  -5.344
   45    HA   TRP  17           HA       TRP  17  -2.878  -2.182  -4.028
   46    HB2  TRP  17           HB2      TRP  17  -5.837  -2.424  -3.507
   47    HB3  TRP  17           HB1      TRP  17  -4.748  -1.554  -2.433
   48    HD1  TRP  17           HD1      TRP  17  -6.008  -1.402  -6.100
   49    HE1  TRP  17           HE1      TRP  17  -5.961   1.058  -6.831
   50    HE3  TRP  17           HE3      TRP  17  -3.745   0.642  -1.977
   51    HZ2  TRP  17           HZ2      TRP  17  -5.051   3.534  -5.827
   52    HZ3  TRP  17           HZ3      TRP  17  -3.315   3.063  -1.956
   53    HH2  TRP  17           HH2      TRP  17  -3.953   4.478  -3.839
   54    H    GLU  18           HN       GLU  18  -1.616  -3.146  -2.664
   55    HA   GLU  18           HA       GLU  18  -2.597  -5.554  -1.310
   56    HB2  GLU  18           HB2      GLU  18   0.051  -4.773  -2.404
   57    HB3  GLU  18           HB1      GLU  18   0.001  -5.857  -1.025
   58    HG2  GLU  18           HG2      GLU  18  -1.223  -6.285  -3.732
   59    HG3  GLU  18           HG1      GLU  18   0.115  -7.152  -2.991
   60    H    VAL  19           HN       VAL  19  -2.177  -5.914   0.769
   61    HA   VAL  19           HA       VAL  19  -1.429  -3.565   2.387
   62    HB   VAL  19           HB       VAL  19  -3.144  -5.862   3.332
   63   HG11  VAL  19          HG11      VAL  19  -2.694  -3.093   4.434
   64   HG12  VAL  19          HG12      VAL  19  -2.044  -4.597   5.089
   65   HG13  VAL  19          HG13      VAL  19  -3.783  -4.306   5.109
   66   HG21  VAL  19          HG21      VAL  19  -5.093  -4.404   3.026
   67   HG22  VAL  19          HG22      VAL  19  -4.312  -4.798   1.495
   68   HG23  VAL  19          HG23      VAL  19  -4.064  -3.214   2.230
   69    H    ARG  20           HN       ARG  20   0.695  -3.925   2.825
   70    HA   ARG  20           HA       ARG  20   1.358  -6.539   3.997
   71    HB2  ARG  20           HB2      ARG  20   2.511  -5.852   1.805
   72    HB3  ARG  20           HB1      ARG  20   3.381  -4.679   2.790
   73    HG2  ARG  20           HG2      ARG  20   4.798  -6.520   2.707
   74    HG3  ARG  20           HG1      ARG  20   4.009  -6.660   4.269
   75    HD2  ARG  20           HD2      ARG  20   4.070  -8.825   3.189
   76    HD3  ARG  20           HD1      ARG  20   2.408  -8.253   3.306
   77    HE   ARG  20           HE       ARG  20   3.568  -7.544   0.806
   78   HH11  ARG  20          HH11      ARG  20   2.171 -10.237   2.557
   79   HH12  ARG  20          HH12      ARG  20   1.671 -11.080   1.121
   80   HH21  ARG  20          HH21      ARG  20   2.924  -8.649  -1.096
   81   HH22  ARG  20          HH22      ARG  20   2.104 -10.181  -0.945
   82    H    HIS  21           HN       HIS  21   2.603  -6.567   5.862
   83    HA   HIS  21           HA       HIS  21   2.583  -3.997   7.331
   84    HB2  HIS  21           HB2      HIS  21   1.339  -6.310   8.047
   85    HB3  HIS  21           HB1      HIS  21   2.908  -6.562   8.791
   86    HD1  HIS  21           HD1      HIS  21   2.217  -6.470  11.129
   87    HD2  HIS  21           HD2      HIS  21   1.017  -2.999   9.064
   88    HE1  HIS  21           HE1      HIS  21   1.168  -4.973  12.845
   89    HE2  HIS  21           HE2      HIS  21   0.235  -3.034  11.540
   90    H    ALA  22           HN       ALA  22   4.567  -3.144   7.269
   91    HA   ALA  22           HA       ALA  22   6.911  -4.496   6.588
   92    HB1  ALA  22           HB1      ALA  22   6.654  -2.076   6.386
   93    HB2  ALA  22           HB2      ALA  22   8.082  -2.479   7.338
   94    HB3  ALA  22           HB3      ALA  22   6.614  -1.927   8.143
   95    HA   PRO  23           HA       PRO  23   8.369  -6.609  10.167
   96    HB2  PRO  23           HB2      PRO  23  10.897  -5.050  10.067
   97    HB3  PRO  23           HB1      PRO  23  10.651  -6.801  10.054
   98    HG2  PRO  23           HG2      PRO  23  11.324  -5.519   7.824
   99    HG3  PRO  23           HG1      PRO  23  10.146  -6.844   7.786
  100    HD2  PRO  23           HD2      PRO  23   9.687  -3.890   7.666
  101    HD3  PRO  23           HD1      PRO  23   8.872  -5.194   6.777
  102    H    ASN  24           HN       ASN  24   8.392  -3.159  10.180
  103    HA   ASN  24           HA       ASN  24   8.921  -2.907  12.999
  104    HB2  ASN  24           HB2      ASN  24   8.298  -0.486  12.610
  105    HB3  ASN  24           HB1      ASN  24   9.682  -1.063  11.692
  106   HD21  ASN  24          HD21      ASN  24   9.475   0.532  10.146
  107   HD22  ASN  24          HD22      ASN  24   8.194   0.547   8.976
  108    H    GLY  25           HN       GLY  25   6.354  -3.723  11.051
  109    HA2  GLY  25           HA2      GLY  25   4.263  -4.434  11.760
  110    HA3  GLY  25           HA1      GLY  25   4.527  -3.605  13.271
  111    H    ARG  26           HN       ARG  26   4.917  -2.164  10.122
  112    HA   ARG  26           HA       ARG  26   2.417  -0.651  10.517
  113    HB2  ARG  26           HB2      ARG  26   4.974   0.219   9.142
  114    HB3  ARG  26           HB1      ARG  26   3.486   1.152   9.170
  115    HG2  ARG  26           HG2      ARG  26   4.881   0.340  11.697
  116    HG3  ARG  26           HG1      ARG  26   5.331   1.792  10.803
  117    HD2  ARG  26           HD2      ARG  26   3.803   2.450  12.501
  118    HD3  ARG  26           HD1      ARG  26   2.950   2.531  10.964
  119    HE   ARG  26           HE       ARG  26   2.644   0.186  12.722
  120   HH11  ARG  26          HH11      ARG  26   1.278   2.914  10.987
  121   HH12  ARG  26          HH12      ARG  26  -0.370   2.472  11.332
  122   HH21  ARG  26          HH21      ARG  26   0.472  -0.395  13.185
  123   HH22  ARG  26          HH22      ARG  26  -0.822   0.582  12.559
  124    HA   PRO  27           HA       PRO  27   1.555  -2.614   6.577
  125    HB2  PRO  27           HB2      PRO  27  -1.074  -2.075   6.467
  126    HB3  PRO  27           HB1      PRO  27  -0.422  -3.291   7.570
  127    HG2  PRO  27           HG2      PRO  27  -1.361  -0.530   8.138
  128    HG3  PRO  27           HG1      PRO  27  -1.454  -1.983   9.148
  129    HD2  PRO  27           HD2      PRO  27   0.447   0.008   9.356
  130    HD3  PRO  27           HD1      PRO  27   0.548  -1.511  10.129
  131    H    PHE  28           HN       PHE  28   2.222  -1.701   4.865
  132    HA   PHE  28           HA       PHE  28   1.319   0.972   4.101
  133    HB2  PHE  28           HB2      PHE  28   3.296   0.955   2.575
  134    HB3  PHE  28           HB1      PHE  28   3.724   0.838   4.272
  135    HD1  PHE  28           HD2      PHE  28   3.798  -1.847   5.046
  136    HD2  PHE  28           HD1      PHE  28   4.611  -0.271   1.170
  137    HE1  PHE  28           HE2      PHE  28   5.190  -3.799   4.545
  138    HE2  PHE  28           HE1      PHE  28   5.994  -2.236   0.669
  139    HZ   PHE  28           HZ       PHE  28   6.289  -4.003   2.353
  140    H    PHE  29           HN       PHE  29  -0.085   1.128   2.498
  141    HA   PHE  29           HA       PHE  29  -0.872  -1.316   1.137
  142    HB2  PHE  29           HB2      PHE  29  -2.184   1.417   1.136
  143    HB3  PHE  29           HB1      PHE  29  -2.849  -0.057   0.433
  144    HD1  PHE  29           HD1      PHE  29  -1.566   1.189   3.720
  145    HD2  PHE  29           HD2      PHE  29  -4.375  -1.236   1.642
  146    HE1  PHE  29           HE1      PHE  29  -2.651   0.630   5.854
  147    HE2  PHE  29           HE2      PHE  29  -5.465  -1.800   3.774
  148    HZ   PHE  29           HZ       PHE  29  -4.598  -0.877   5.884
  149    H    ILE  30           HN       ILE  30  -0.015  -1.780  -0.729
  150    HA   ILE  30           HA       ILE  30   1.282   0.359  -2.256
  151    HB   ILE  30           HB       ILE  30   1.537  -2.589  -2.816
  152   HG12  ILE  30          HG12      ILE  30   3.399  -0.953  -1.138
  153   HG13  ILE  30          HG11      ILE  30   2.178  -2.001  -0.434
  154   HG21  ILE  30          HG21      ILE  30   3.647  -1.870  -3.853
  155   HG22  ILE  30          HG22      ILE  30   3.286  -0.200  -3.414
  156   HG23  ILE  30          HG23      ILE  30   2.256  -1.051  -4.566
  157   HD11  ILE  30          HD11      ILE  30   4.341  -3.087  -0.457
  158   HD12  ILE  30          HD12      ILE  30   4.466  -2.846  -2.200
  159   HD13  ILE  30          HD13      ILE  30   3.229  -3.917  -1.544
  160    H    ASP  31           HN       ASP  31   0.651   0.930  -4.202
  161    HA   ASP  31           HA       ASP  31  -1.509  -0.551  -5.508
  162    HB2  ASP  31           HB2      ASP  31  -1.894   1.771  -5.681
  163    HB3  ASP  31           HB1      ASP  31  -0.209   2.107  -6.079
  164    H    HIS  32           HN       HIS  32  -0.987  -2.190  -6.699
  165    HA   HIS  32           HA       HIS  32   1.728  -2.426  -7.743
  166    HB2  HIS  32           HB2      HIS  32  -0.518  -4.424  -7.403
  167    HB3  HIS  32           HB1      HIS  32   1.001  -4.817  -8.191
  168    HD1  HIS  32           HD1      HIS  32   2.171  -6.316  -6.535
  169    HD2  HIS  32           HD2      HIS  32   0.584  -2.924  -4.728
  170    HE1  HIS  32           HE1      HIS  32   2.910  -6.379  -4.118
  171    HE2  HIS  32           HE2      HIS  32   1.802  -4.425  -3.037
  172    H    ASN  33           HN       ASN  33  -0.982  -1.061  -8.843
  173    HA   ASN  33           HA       ASN  33  -0.939  -2.198 -11.528
  174    HB2  ASN  33           HB2      ASN  33  -2.554   0.158 -10.517
  175    HB3  ASN  33           HB1      ASN  33  -2.794  -0.710 -12.027
  176   HD21  ASN  33          HD21      ASN  33  -3.240  -0.701  -8.614
  177   HD22  ASN  33          HD22      ASN  33  -4.345  -2.050  -8.543
  178    H    THR  34           HN       THR  34  -0.703   1.088 -10.159
  179    HA   THR  34           HA       THR  34   0.850   1.880 -12.533
  180    HB   THR  34           HB       THR  34  -0.583   3.701 -10.588
  181    HG1  THR  34           HG1      THR  34  -1.491   2.549 -13.043
  182   HG21  THR  34          HG21      THR  34   0.349   4.128 -13.430
  183   HG22  THR  34          HG22      THR  34   1.124   4.781 -11.986
  184   HG23  THR  34          HG23      THR  34  -0.501   5.307 -12.430
  185    H    LYS  35           HN       LYS  35   1.272   1.015  -9.393
  186    HA   LYS  35           HA       LYS  35   3.013   1.088  -7.957
  187    HB2  LYS  35           HB2      LYS  35   4.568   0.875  -9.771
  188    HB3  LYS  35           HB1      LYS  35   4.377   2.564 -10.210
  189    HG2  LYS  35           HG2      LYS  35   6.366   2.661  -9.114
  190    HG3  LYS  35           HG1      LYS  35   5.266   2.964  -7.770
  191    HD2  LYS  35           HD2      LYS  35   6.737   1.371  -6.926
  192    HD3  LYS  35           HD1      LYS  35   5.340   0.413  -7.422
  193    HE2  LYS  35           HE2      LYS  35   7.419  -0.649  -8.124
  194    HE3  LYS  35           HE1      LYS  35   6.465  -0.147  -9.519
  195    HZ1  LYS  35           HZ1      LYS  35   7.885   1.701  -9.877
  196    HZ2  LYS  35           HZ2      LYS  35   8.897   0.358  -9.654
  197    HZ3  LYS  35           HZ3      LYS  35   8.682   1.476  -8.398
  198    H    THR  36           HN       THR  36   1.661   2.300  -6.601
  199    HA   THR  36           HA       THR  36   2.934   4.839  -5.923
  200    HB   THR  36           HB       THR  36   0.591   5.683  -5.205
  201    HG1  THR  36           HG1      THR  36  -0.147   3.814  -7.235
  202   HG21  THR  36          HG21      THR  36   0.201   6.732  -7.385
  203   HG22  THR  36          HG22      THR  36   1.320   5.592  -8.132
  204   HG23  THR  36          HG23      THR  36   1.909   6.760  -6.948
  205    H    THR  37           HN       THR  37   2.798   5.314  -3.632
  206    HA   THR  37           HA       THR  37   1.960   2.968  -2.059
  207    HB   THR  37           HB       THR  37   3.968   3.381  -0.598
  208    HG1  THR  37           HG1      THR  37   4.226   5.486  -2.193
  209   HG21  THR  37          HG21      THR  37   3.901   1.538  -2.203
  210   HG22  THR  37          HG22      THR  37   5.523   2.221  -2.101
  211   HG23  THR  37          HG23      THR  37   4.488   2.613  -3.473
  212    H    THR  38           HN       THR  38   0.951   3.331  -0.173
  213    HA   THR  38           HA       THR  38   1.059   5.934   1.105
  214    HB   THR  38           HB       THR  38  -0.771   6.233  -0.485
  215    HG1  THR  38           HG1      THR  38  -2.548   6.330   1.280
  216   HG21  THR  38          HG21      THR  38  -2.006   3.797   0.801
  217   HG22  THR  38          HG22      THR  38  -1.380   3.904  -0.844
  218   HG23  THR  38          HG23      THR  38  -2.796   4.845  -0.375
  219    H    TRP  39           HN       TRP  39   0.389   5.836   3.334
  220    HA   TRP  39           HA       TRP  39   0.431   3.122   4.426
  221    HB2  TRP  39           HB2      TRP  39   0.336   5.741   5.934
  222    HB3  TRP  39           HB1      TRP  39   0.682   4.155   6.606
  223    HD1  TRP  39           HD1      TRP  39   2.257   7.044   4.786
  224    HE1  TRP  39           HE1      TRP  39   4.820   6.692   4.691
  225    HE3  TRP  39           HE3      TRP  39   2.472   2.238   6.496
  226    HZ2  TRP  39           HZ2      TRP  39   6.680   4.615   5.288
  227    HZ3  TRP  39           HZ3      TRP  39   4.659   1.140   6.706
  228    HH2  TRP  39           HH2      TRP  39   6.719   2.305   6.113
  229    H    GLU  40           HN       GLU  40  -1.811   5.332   3.404
  230    HA   GLU  40           HA       GLU  40  -3.741   4.557   5.451
  231    HB2  GLU  40           HB2      GLU  40  -4.986   6.578   4.873
  232    HB3  GLU  40           HB1      GLU  40  -3.322   6.930   5.335
  233    HG2  GLU  40           HG2      GLU  40  -3.816   8.350   3.571
  234    HG3  GLU  40           HG1      GLU  40  -2.791   7.096   2.892
  235    H    ASP  41           HN       ASP  41  -6.017   4.332   4.669
  236    HA   ASP  41           HA       ASP  41  -5.732   2.198   2.705
  237    HB2  ASP  41           HB2      ASP  41  -7.832   1.327   3.663
  238    HB3  ASP  41           HB1      ASP  41  -6.575   1.539   4.876
  239    HA   PRO  42           HA       PRO  42  -8.220   4.248  -0.349
  240    HB2  PRO  42           HB2      PRO  42  -8.549   2.125  -1.991
  241    HB3  PRO  42           HB1      PRO  42  -7.029   3.018  -1.879
  242    HG2  PRO  42           HG2      PRO  42  -7.803   0.428  -0.601
  243    HG3  PRO  42           HG1      PRO  42  -6.276   0.880  -1.378
  244    HD2  PRO  42           HD2      PRO  42  -6.627   0.868   1.319
  245    HD3  PRO  42           HD1      PRO  42  -5.504   1.967   0.495
  246    H    ARG  43           HN       ARG  43  -9.232   1.753   1.728
  247    HA   ARG  43           HA       ARG  43 -11.847   1.366   0.600
  248    HB2  ARG  43           HB2      ARG  43 -10.831  -0.429   1.883
  249    HB3  ARG  43           HB1      ARG  43 -10.698   0.607   3.294
  250    HG2  ARG  43           HG2      ARG  43 -12.543  -1.025   3.435
  251    HG3  ARG  43           HG1      ARG  43 -13.080   0.649   3.566
  252    HD2  ARG  43           HD2      ARG  43 -14.565  -0.678   2.140
  253    HD3  ARG  43           HD1      ARG  43 -13.792   0.628   1.247
  254    HE   ARG  43           HE       ARG  43 -12.521  -1.989   1.104
  255   HH11  ARG  43          HH11      ARG  43 -14.630   0.371  -0.386
  256   HH12  ARG  43          HH12      ARG  43 -14.483  -0.305  -1.980
  257   HH21  ARG  43          HH21      ARG  43 -12.361  -2.914  -0.989
  258   HH22  ARG  43          HH22      ARG  43 -13.252  -2.209  -2.308
  259    H    LEU  44           HN       LEU  44 -10.404   3.426   3.014
  260    HA   LEU  44           HA       LEU  44 -12.907   4.387   3.990
  261    HB2  LEU  44           HB2      LEU  44 -10.072   4.852   4.602
  262    HB3  LEU  44           HB1      LEU  44 -11.143   6.186   4.941
  263    HG   LEU  44           HG       LEU  44 -11.291   3.407   6.097
  264   HD11  LEU  44          HD11      LEU  44 -10.781   6.097   7.353
  265   HD12  LEU  44          HD12      LEU  44  -9.591   4.820   7.097
  266   HD13  LEU  44          HD13      LEU  44 -10.927   4.565   8.219
  267   HD21  LEU  44          HD21      LEU  44 -13.202   4.201   7.390
  268   HD22  LEU  44          HD22      LEU  44 -13.542   4.232   5.661
  269   HD23  LEU  44          HD23      LEU  44 -13.167   5.730   6.512
  270    H    LYS  45           HN       LYS  45 -11.224   4.981   1.282
  271    HA   LYS  45           HA       LYS  45 -11.443   7.777   0.939
  272    HB2  LYS  45           HB2      LYS  45 -11.511   5.668  -1.228
  273    HB3  LYS  45           HB1      LYS  45 -11.123   7.365  -1.437
  274    HG2  LYS  45           HG2      LYS  45  -9.479   5.496   0.248
  275    HG3  LYS  45           HG1      LYS  45  -9.184   5.772  -1.464
  276    HD2  LYS  45           HD2      LYS  45  -7.694   7.202  -0.365
  277    HD3  LYS  45           HD1      LYS  45  -9.022   8.245  -0.869
  278    HE2  LYS  45           HE2      LYS  45  -9.921   8.294   1.336
  279    HE3  LYS  45           HE1      LYS  45  -8.822   7.026   1.876
  280    HZ1  LYS  45           HZ1      LYS  45  -8.150   9.283   2.566
  281    HZ2  LYS  45           HZ2      LYS  45  -7.940   9.698   0.936
  282    HZ3  LYS  45           HZ3      LYS  45  -6.978   8.487   1.639
  283    H    GLN 112           H        GLN 112   7.794  10.187   6.761
  284    HA   GLN 112           HA       GLN 112   8.614   7.998   6.037
  285    HB2  GLN 112           HB2      GLN 112   5.658   8.308   6.567
  286    HB3  GLN 112           HB1      GLN 112   6.473   6.752   6.560
  287    HG2  GLN 112           HG2      GLN 112   6.317   7.379   8.805
  288    HG3  GLN 112           HG1      GLN 112   7.987   7.688   8.350
  289   HE21  GLN 112          HE21      GLN 112   8.289   9.169   9.991
  290   HE22  GLN 112          HE22      GLN 112   7.579  10.748   9.958
  291    H    ILE 113           HN       ILE 113   9.162   7.120   4.181
  292    HA   ILE 113           HA       ILE 113   7.323   7.303   1.904
  293    HB   ILE 113           HB       ILE 113  10.242   6.526   1.972
  294   HG12  ILE 113          HG12      ILE 113   9.912   8.888   2.499
  295   HG13  ILE 113          HG11      ILE 113  10.612   8.718   0.892
  296   HG21  ILE 113          HG21      ILE 113   9.076   5.449   0.126
  297   HG22  ILE 113          HG22      ILE 113  10.149   6.715  -0.474
  298   HG23  ILE 113          HG23      ILE 113   8.411   7.002  -0.380
  299   HD11  ILE 113          HD11      ILE 113   8.417   9.096  -0.101
  300   HD12  ILE 113          HD12      ILE 113   8.904  10.438   0.937
  301   HD13  ILE 113          HD13      ILE 113   7.718   9.265   1.510
  302    HA   PRO 114           HA       PRO 114   6.415   2.948   2.804
  303    HB2  PRO 114           HB2      PRO 114   4.568   3.183   0.558
  304    HB3  PRO 114           HB1      PRO 114   4.227   2.816   2.249
  305    HG2  PRO 114           HG2      PRO 114   3.536   5.160   1.072
  306    HG3  PRO 114           HG1      PRO 114   3.916   5.017   2.798
  307    HD2  PRO 114           HD2      PRO 114   5.586   6.079   0.564
  308    HD3  PRO 114           HD1      PRO 114   5.459   6.621   2.251
  309    HA   PRO 115           HA       PRO 115   9.055   1.271  -0.498
  310    HB2  PRO 115           HB2      PRO 115   8.134  -1.264   0.729
  311    HB3  PRO 115           HB1      PRO 115   9.773  -0.705   0.399
  312    HG2  PRO 115           HG2      PRO 115   8.807  -0.771   2.885
  313    HG3  PRO 115           HG1      PRO 115   9.889   0.527   2.348
  314    HD2  PRO 115           HD2      PRO 115   6.930   0.566   2.750
  315    HD3  PRO 115           HD1      PRO 115   8.141   1.826   3.075
  316    HA   PRO 116           HA       PRO 116   5.864   0.316  -3.560
  317    HB2  PRO 116           HB2      PRO 116   7.894  -0.770  -5.190
  318    HB3  PRO 116           HB1      PRO 116   7.222   0.866  -5.286
  319    HG2  PRO 116           HG2      PRO 116   9.605  -0.121  -3.783
  320    HG3  PRO 116           HG1      PRO 116   9.416   1.365  -4.752
  321    HD2  PRO 116           HD2      PRO 116   9.170   1.607  -2.234
  322    HD3  PRO 116           HD1      PRO 116   7.877   2.253  -3.213
  323    H    TYR 117           HN       TYR 117   5.892  -1.191  -4.963
  324    HA   TYR 117           HA       TYR 117   5.425  -3.765  -3.686
  325    HB2  TYR 117           HB2      TYR 117   3.897  -4.274  -5.323
  326    HB3  TYR 117           HB1      TYR 117   3.809  -2.525  -5.315
  327    HD1  TYR 117           HD2      TYR 117   5.055  -5.461  -7.163
  328    HD2  TYR 117           HD1      TYR 117   4.359  -1.263  -7.284
  329    HE1  TYR 117           HE2      TYR 117   5.395  -5.483  -9.596
  330    HE2  TYR 117           HE1      TYR 117   4.685  -1.280  -9.719
  331    HH   TYR 117           HH       TYR 117   4.814  -4.164 -11.556
  332    H    VAL 118           HN       VAL 118   6.686  -5.512  -3.856
  333    HA   VAL 118           HA       VAL 118   8.730  -5.551  -5.979
  334    HB   VAL 118           HB       VAL 118   9.927  -7.210  -4.539
  335   HG11  VAL 118          HG11      VAL 118  10.590  -4.873  -4.513
  336   HG12  VAL 118          HG12      VAL 118  10.757  -5.574  -2.904
  337   HG13  VAL 118          HG13      VAL 118   9.386  -4.526  -3.272
  338   HG21  VAL 118          HG21      VAL 118   9.290  -7.396  -2.173
  339   HG22  VAL 118          HG22      VAL 118   8.035  -8.023  -3.242
  340   HG23  VAL 118          HG23      VAL 118   7.845  -6.437  -2.495
  341    H    GLU 119           HN       GLU 119   5.869  -6.873  -4.857
  342    HA   GLU 119           HA       GLU 119   6.180  -9.342  -6.409
  343    HB2  GLU 119           HB2      GLU 119   3.615  -8.808  -5.037
  344    HB3  GLU 119           HB1      GLU 119   4.572 -10.280  -5.095
  345    HG2  GLU 119           HG2      GLU 119   4.727  -9.755  -2.879
  346    HG3  GLU 119           HG1      GLU 119   6.166  -8.950  -3.500
  347    HA   PRO 120           HA       PRO 120   4.266  -6.809  -9.626
  348    HB2  PRO 120           HB2      PRO 120   4.557  -9.287 -11.201
  349    HB3  PRO 120           HB1      PRO 120   5.186  -7.668 -11.524
  350    HG2  PRO 120           HG2      PRO 120   6.798  -9.668 -10.759
  351    HG3  PRO 120           HG1      PRO 120   7.072  -7.997 -10.231
  352    HD2  PRO 120           HD2      PRO 120   5.847 -10.285  -8.736
  353    HD3  PRO 120           HD1      PRO 120   6.979  -9.042  -8.165
  Start of MODEL    5
    1    H    PHE  12           H        PHE  12 -15.342  -2.486  -1.561
    2    HA   PHE  12           HA       PHE  12 -13.720  -3.637  -0.231
    3    HB2  PHE  12           HB2      PHE  12 -14.137  -5.840  -1.458
    4    HB3  PHE  12           HB1      PHE  12 -13.083  -5.230  -2.727
    5    HD1  PHE  12           HD2      PHE  12 -13.063  -5.594   0.987
    6    HD2  PHE  12           HD1      PHE  12 -10.893  -5.908  -2.658
    7    HE1  PHE  12           HE2      PHE  12 -11.110  -6.428   2.227
    8    HE2  PHE  12           HE1      PHE  12  -8.934  -6.743  -1.426
    9    HZ   PHE  12           HZ       PHE  12  -9.041  -7.003   1.023
   10    H    LEU  13           HN       LEU  13 -11.251  -3.400  -0.701
   11    HA   LEU  13           HA       LEU  13 -10.908  -0.849  -1.935
   12    HB2  LEU  13           HB2      LEU  13  -8.545  -1.094  -1.265
   13    HB3  LEU  13           HB1      LEU  13  -9.663  -1.364   0.054
   14    HG   LEU  13           HG       LEU  13  -9.315  -3.898  -0.616
   15   HD11  LEU  13          HD11      LEU  13  -6.759  -2.607  -1.539
   16   HD12  LEU  13          HD12      LEU  13  -7.921  -3.461  -2.554
   17   HD13  LEU  13          HD13      LEU  13  -7.022  -4.337  -1.315
   18   HD21  LEU  13          HD21      LEU  13  -7.305  -2.285   0.947
   19   HD22  LEU  13          HD22      LEU  13  -7.555  -4.026   1.070
   20   HD23  LEU  13          HD23      LEU  13  -8.834  -2.915   1.561
   21    HA   PRO  14           HA       PRO  14  -9.831  -1.548  -6.102
   22    HB2  PRO  14           HB2      PRO  14  -7.280  -0.216  -5.350
   23    HB3  PRO  14           HB1      PRO  14  -8.281   0.008  -6.789
   24    HG2  PRO  14           HG2      PRO  14  -8.505   1.668  -4.923
   25    HG3  PRO  14           HG1      PRO  14 -10.000   1.006  -5.535
   26    HD2  PRO  14           HD2      PRO  14  -8.533   0.324  -2.997
   27    HD3  PRO  14           HD1      PRO  14 -10.280   0.534  -3.256
   28    H    LYS  15           HN       LYS  15  -8.711  -2.495  -7.480
   29    HA   LYS  15           HA       LYS  15  -7.477  -4.964  -6.616
   30    HB2  LYS  15           HB2      LYS  15  -8.128  -3.826  -9.320
   31    HB3  LYS  15           HB1      LYS  15  -7.190  -5.302  -9.147
   32    HG2  LYS  15           HG2      LYS  15  -9.043  -6.316  -7.903
   33    HG3  LYS  15           HG1      LYS  15  -9.985  -4.842  -8.139
   34    HD2  LYS  15           HD2      LYS  15 -10.691  -6.362  -9.815
   35    HD3  LYS  15           HD1      LYS  15  -9.662  -5.168 -10.604
   36    HE2  LYS  15           HE2      LYS  15  -8.545  -7.778  -9.642
   37    HE3  LYS  15           HE1      LYS  15  -9.346  -7.654 -11.204
   38    HZ1  LYS  15           HZ1      LYS  15  -7.739  -5.824 -11.722
   39    HZ2  LYS  15           HZ2      LYS  15  -7.049  -7.366 -11.577
   40    HZ3  LYS  15           HZ3      LYS  15  -6.888  -6.246 -10.314
   41    H    GLY  16           HN       GLY  16  -5.409  -5.549  -6.695
   42    HA2  GLY  16           HA2      GLY  16  -3.116  -5.395  -7.082
   43    HA3  GLY  16           HA1      GLY  16  -3.378  -3.920  -8.002
   44    H    TRP  17           HN       TRP  17  -5.050  -3.599  -5.191
   45    HA   TRP  17           HA       TRP  17  -2.898  -2.066  -3.968
   46    HB2  TRP  17           HB2      TRP  17  -5.878  -2.120  -3.631
   47    HB3  TRP  17           HB1      TRP  17  -4.862  -1.408  -2.381
   48    HD1  TRP  17           HD1      TRP  17  -5.470  -0.991  -6.208
   49    HE1  TRP  17           HE1      TRP  17  -5.114   1.492  -6.799
   50    HE3  TRP  17           HE3      TRP  17  -4.005   0.732  -1.620
   51    HZ2  TRP  17           HZ2      TRP  17  -4.325   3.864  -5.489
   52    HZ3  TRP  17           HZ3      TRP  17  -3.475   3.118  -1.376
   53    HH2  TRP  17           HH2      TRP  17  -3.626   4.652  -3.268
   54    H    GLU  18           HN       GLU  18  -1.651  -3.042  -2.620
   55    HA   GLU  18           HA       GLU  18  -2.572  -5.444  -1.221
   56    HB2  GLU  18           HB2      GLU  18  -0.073  -4.553  -2.355
   57    HB3  GLU  18           HB1      GLU  18   0.133  -5.152  -0.739
   58    HG2  GLU  18           HG2      GLU  18  -1.074  -7.226  -1.462
   59    HG3  GLU  18           HG1      GLU  18  -0.975  -6.610  -3.113
   60    H    VAL  19           HN       VAL  19  -2.223  -5.736   0.897
   61    HA   VAL  19           HA       VAL  19  -1.557  -3.373   2.525
   62    HB   VAL  19           HB       VAL  19  -3.310  -5.648   3.460
   63   HG11  VAL  19          HG11      VAL  19  -2.208  -4.357   5.214
   64   HG12  VAL  19          HG12      VAL  19  -3.952  -4.089   5.226
   65   HG13  VAL  19          HG13      VAL  19  -2.878  -2.868   4.546
   66   HG21  VAL  19          HG21      VAL  19  -4.449  -4.589   1.599
   67   HG22  VAL  19          HG22      VAL  19  -4.205  -3.001   2.326
   68   HG23  VAL  19          HG23      VAL  19  -5.248  -4.182   3.117
   69    H    ARG  20           HN       ARG  20   0.643  -3.917   2.669
   70    HA   ARG  20           HA       ARG  20   1.233  -6.540   3.838
   71    HB2  ARG  20           HB2      ARG  20   2.436  -5.747   1.706
   72    HB3  ARG  20           HB1      ARG  20   3.282  -4.614   2.765
   73    HG2  ARG  20           HG2      ARG  20   3.804  -6.749   4.174
   74    HG3  ARG  20           HG1      ARG  20   3.454  -7.592   2.666
   75    HD2  ARG  20           HD2      ARG  20   5.512  -5.431   3.072
   76    HD3  ARG  20           HD1      ARG  20   5.839  -7.153   2.906
   77    HE   ARG  20           HE       ARG  20   4.469  -6.480   0.635
   78   HH11  ARG  20          HH11      ARG  20   7.419  -5.392   2.187
   79   HH12  ARG  20          HH12      ARG  20   8.177  -4.937   0.686
   80   HH21  ARG  20          HH21      ARG  20   5.488  -5.878  -1.331
   81   HH22  ARG  20          HH22      ARG  20   7.093  -5.199  -1.282
   82    H    HIS  21           HN       HIS  21   2.050  -6.749   5.824
   83    HA   HIS  21           HA       HIS  21   2.335  -4.334   7.460
   84    HB2  HIS  21           HB2      HIS  21   1.352  -6.902   7.962
   85    HB3  HIS  21           HB1      HIS  21   2.920  -6.887   8.752
   86    HD1  HIS  21           HD1      HIS  21   1.511  -7.249  10.908
   87    HD2  HIS  21           HD2      HIS  21   1.052  -3.446   9.166
   88    HE1  HIS  21           HE1      HIS  21   0.429  -5.817  12.657
   89    HE2  HIS  21           HE2      HIS  21  -0.056  -3.639  11.510
   90    H    ALA  22           HN       ALA  22   4.289  -3.413   7.341
   91    HA   ALA  22           HA       ALA  22   6.638  -4.670   6.428
   92    HB1  ALA  22           HB1      ALA  22   6.252  -2.250   6.311
   93    HB2  ALA  22           HB2      ALA  22   7.768  -2.626   7.130
   94    HB3  ALA  22           HB3      ALA  22   6.352  -2.153   8.069
   95    HA   PRO  23           HA       PRO  23   8.437  -6.680   9.929
   96    HB2  PRO  23           HB2      PRO  23  10.885  -5.021   9.714
   97    HB3  PRO  23           HB1      PRO  23  10.698  -6.776   9.635
   98    HG2  PRO  23           HG2      PRO  23  11.200  -5.346   7.438
   99    HG3  PRO  23           HG1      PRO  23  10.113  -6.746   7.394
  100    HD2  PRO  23           HD2      PRO  23   9.450  -3.828   7.426
  101    HD3  PRO  23           HD1      PRO  23   8.684  -5.149   6.518
  102    H    ASN  24           HN       ASN  24   8.231  -3.237   9.950
  103    HA   ASN  24           HA       ASN  24   8.898  -2.956  12.741
  104    HB2  ASN  24           HB2      ASN  24   8.082  -0.598  12.445
  105    HB3  ASN  24           HB1      ASN  24   9.411  -1.046  11.386
  106   HD21  ASN  24          HD21      ASN  24   8.906   0.624   9.973
  107   HD22  ASN  24          HD22      ASN  24   7.542   0.534   8.907
  108    H    GLY  25           HN       GLY  25   6.278  -3.924  10.902
  109    HA2  GLY  25           HA2      GLY  25   4.363  -4.922  11.784
  110    HA3  GLY  25           HA1      GLY  25   4.626  -4.046  13.271
  111    H    ARG  26           HN       ARG  26   4.545  -2.641  10.057
  112    HA   ARG  26           HA       ARG  26   1.949  -1.395  10.689
  113    HB2  ARG  26           HB2      ARG  26   4.357  -0.131   9.365
  114    HB3  ARG  26           HB1      ARG  26   2.764   0.607   9.406
  115    HG2  ARG  26           HG2      ARG  26   4.477  -0.052  11.794
  116    HG3  ARG  26           HG1      ARG  26   4.235   1.550  11.098
  117    HD2  ARG  26           HD2      ARG  26   1.727   1.104  11.520
  118    HD3  ARG  26           HD1      ARG  26   2.294  -0.170  12.601
  119    HE   ARG  26           HE       ARG  26   3.379   2.515  12.978
  120   HH11  ARG  26          HH11      ARG  26   1.244  -0.025  14.125
  121   HH12  ARG  26          HH12      ARG  26   0.979   0.728  15.665
  122   HH21  ARG  26          HH21      ARG  26   3.029   3.498  14.974
  123   HH22  ARG  26          HH22      ARG  26   2.007   2.736  16.163
  124    HA   PRO  27           HA       PRO  27   0.976  -2.909   6.563
  125    HB2  PRO  27           HB2      PRO  27  -1.566  -2.084   6.440
  126    HB3  PRO  27           HB1      PRO  27  -1.108  -3.375   7.555
  127    HG2  PRO  27           HG2      PRO  27  -1.471  -0.444   8.116
  128    HG3  PRO  27           HG1      PRO  27  -2.120  -1.833   9.015
  129    HD2  PRO  27           HD2      PRO  27   0.138  -0.587   9.789
  130    HD3  PRO  27           HD1      PRO  27  -0.118  -2.265  10.042
  131    H    PHE  28           HN       PHE  28   1.950  -1.800   5.012
  132    HA   PHE  28           HA       PHE  28   0.986   0.882   4.340
  133    HB2  PHE  28           HB2      PHE  28   3.014   1.035   2.888
  134    HB3  PHE  28           HB1      PHE  28   3.382   0.873   4.592
  135    HD1  PHE  28           HD1      PHE  28   3.509  -1.867   5.218
  136    HD2  PHE  28           HD2      PHE  28   4.536   0.001   1.526
  137    HE1  PHE  28           HE1      PHE  28   5.054  -3.702   4.717
  138    HE2  PHE  28           HE2      PHE  28   6.058  -1.853   1.023
  139    HZ   PHE  28           HZ       PHE  28   6.323  -3.704   2.614
  140    H    PHE  29           HN       PHE  29  -0.201   1.166   2.598
  141    HA   PHE  29           HA       PHE  29  -1.028  -1.241   1.197
  142    HB2  PHE  29           HB2      PHE  29  -2.207   1.551   1.111
  143    HB3  PHE  29           HB1      PHE  29  -2.898   0.107   0.374
  144    HD1  PHE  29           HD1      PHE  29  -1.746   1.309   3.719
  145    HD2  PHE  29           HD2      PHE  29  -4.547  -0.995   1.500
  146    HE1  PHE  29           HE1      PHE  29  -2.975   0.816   5.790
  147    HE2  PHE  29           HE2      PHE  29  -5.780  -1.493   3.566
  148    HZ   PHE  29           HZ       PHE  29  -4.991  -0.592   5.715
  149    H    ILE  30           HN       ILE  30  -0.090  -1.755  -0.602
  150    HA   ILE  30           HA       ILE  30   1.337   0.308  -2.102
  151    HB   ILE  30           HB       ILE  30   1.445  -2.652  -2.650
  152   HG12  ILE  30          HG12      ILE  30   3.307  -1.052  -0.936
  153   HG13  ILE  30          HG11      ILE  30   2.069  -2.111  -0.279
  154   HG21  ILE  30          HG21      ILE  30   3.603  -2.041  -3.658
  155   HG22  ILE  30          HG22      ILE  30   3.307  -0.352  -3.243
  156   HG23  ILE  30          HG23      ILE  30   2.263  -1.172  -4.404
  157   HD11  ILE  30          HD11      ILE  30   3.150  -4.017  -1.368
  158   HD12  ILE  30          HD12      ILE  30   4.229  -3.194  -0.243
  159   HD13  ILE  30          HD13      ILE  30   4.406  -2.942  -1.979
  160    H    ASP  31           HN       ASP  31   0.594   1.076  -3.867
  161    HA   ASP  31           HA       ASP  31  -1.586  -0.253  -5.284
  162    HB2  ASP  31           HB2      ASP  31  -2.033   2.038  -5.192
  163    HB3  ASP  31           HB1      ASP  31  -0.348   2.478  -5.448
  164    H    HIS  32           HN       HIS  32  -0.939  -1.849  -6.495
  165    HA   HIS  32           HA       HIS  32   1.716  -1.899  -7.622
  166    HB2  HIS  32           HB2      HIS  32  -0.535  -3.920  -7.574
  167    HB3  HIS  32           HB1      HIS  32   1.019  -4.227  -8.328
  168    HD1  HIS  32           HD1      HIS  32   2.014  -5.956  -6.730
  169    HD2  HIS  32           HD2      HIS  32   0.554  -2.609  -4.750
  170    HE1  HIS  32           HE1      HIS  32   2.612  -6.241  -4.276
  171    HE2  HIS  32           HE2      HIS  32   1.488  -4.359  -3.120
  172    H    ASN  33           HN       ASN  33  -1.079  -0.515  -8.572
  173    HA   ASN  33           HA       ASN  33  -0.929  -1.190 -11.399
  174    HB2  ASN  33           HB2      ASN  33  -2.608   0.926 -10.026
  175    HB3  ASN  33           HB1      ASN  33  -2.786   0.371 -11.685
  176   HD21  ASN  33          HD21      ASN  33  -3.349  -0.306  -8.355
  177   HD22  ASN  33          HD22      ASN  33  -4.406  -1.664  -8.594
  178    H    THR  34           HN       THR  34  -0.980   1.933  -9.673
  179    HA   THR  34           HA       THR  34   0.546   3.179 -11.798
  180    HB   THR  34           HB       THR  34   0.086   4.730  -9.339
  181    HG1  THR  34           HG1      THR  34  -1.824   3.716  -9.129
  182   HG21  THR  34          HG21      THR  34  -0.670   5.150 -12.237
  183   HG22  THR  34          HG22      THR  34   0.791   5.745 -11.449
  184   HG23  THR  34          HG23      THR  34  -0.786   6.359 -10.957
  185    H    LYS  35           HN       LYS  35   1.242   1.407  -9.105
  186    HA   LYS  35           HA       LYS  35   3.206   0.786  -8.156
  187    HB2  LYS  35           HB2      LYS  35   4.584   2.835  -9.901
  188    HB3  LYS  35           HB1      LYS  35   5.305   1.433  -9.127
  189    HG2  LYS  35           HG2      LYS  35   3.364   1.443 -11.430
  190    HG3  LYS  35           HG1      LYS  35   5.067   0.985 -11.465
  191    HD2  LYS  35           HD2      LYS  35   4.563  -0.907  -9.971
  192    HD3  LYS  35           HD1      LYS  35   2.860  -0.454  -9.990
  193    HE2  LYS  35           HE2      LYS  35   2.763  -0.844 -12.388
  194    HE3  LYS  35           HE1      LYS  35   4.482  -1.233 -12.412
  195    HZ1  LYS  35           HZ1      LYS  35   2.351  -2.759 -11.007
  196    HZ2  LYS  35           HZ2      LYS  35   4.004  -3.119 -10.939
  197    HZ3  LYS  35           HZ3      LYS  35   3.174  -3.245 -12.409
  198    H    THR  36           HN       THR  36   1.524   2.880  -7.123
  199    HA   THR  36           HA       THR  36   3.467   4.679  -5.821
  200    HB   THR  36           HB       THR  36   1.517   6.119  -5.273
  201    HG1  THR  36           HG1      THR  36   0.117   4.197  -6.863
  202   HG21  THR  36          HG21      THR  36   1.863   5.508  -8.209
  203   HG22  THR  36          HG22      THR  36   2.869   6.592  -7.248
  204   HG23  THR  36          HG23      THR  36   1.174   6.988  -7.542
  205    H    THR  37           HN       THR  37   3.305   5.012  -3.511
  206    HA   THR  37           HA       THR  37   1.894   2.813  -2.147
  207    HB   THR  37           HB       THR  37   3.832   3.111  -0.434
  208    HG1  THR  37           HG1      THR  37   5.743   3.849  -1.372
  209   HG21  THR  37          HG21      THR  37   5.145   1.432  -1.635
  210   HG22  THR  37          HG22      THR  37   4.267   1.804  -3.118
  211   HG23  THR  37          HG23      THR  37   3.418   1.089  -1.748
  212    H    THR  38           HN       THR  38   0.811   3.238  -0.268
  213    HA   THR  38           HA       THR  38   1.100   5.813   1.039
  214    HB   THR  38           HB       THR  38  -0.591   6.268  -0.703
  215    HG1  THR  38           HG1      THR  38  -2.346   6.739   1.003
  216   HG21  THR  38          HG21      THR  38  -2.796   5.214  -0.579
  217   HG22  THR  38          HG22      THR  38  -2.220   4.149   0.705
  218   HG23  THR  38          HG23      THR  38  -1.538   4.024  -0.918
  219    H    TRP  39           HN       TRP  39   0.192   5.824   3.188
  220    HA   TRP  39           HA       TRP  39   0.054   3.128   4.304
  221    HB2  TRP  39           HB2      TRP  39   0.013   5.768   5.772
  222    HB3  TRP  39           HB1      TRP  39   0.298   4.176   6.464
  223    HD1  TRP  39           HD1      TRP  39   1.981   6.862   4.340
  224    HE1  TRP  39           HE1      TRP  39   4.535   6.442   4.384
  225    HE3  TRP  39           HE3      TRP  39   2.030   2.360   6.756
  226    HZ2  TRP  39           HZ2      TRP  39   6.316   4.459   5.328
  227    HZ3  TRP  39           HZ3      TRP  39   4.189   1.268   7.194
  228    HH2  TRP  39           HH2      TRP  39   6.286   2.295   6.493
  229    H    GLU  40           HN       GLU  40  -2.103   5.317   3.110
  230    HA   GLU  40           HA       GLU  40  -4.066   4.955   5.224
  231    HB2  GLU  40           HB2      GLU  40  -5.280   6.777   4.179
  232    HB3  GLU  40           HB1      GLU  40  -3.601   7.223   4.449
  233    HG2  GLU  40           HG2      GLU  40  -3.934   8.064   2.371
  234    HG3  GLU  40           HG1      GLU  40  -3.311   6.467   1.967
  235    H    ASP  41           HN       ASP  41  -6.364   4.632   4.481
  236    HA   ASP  41           HA       ASP  41  -6.275   2.112   3.008
  237    HB2  ASP  41           HB2      ASP  41  -8.375   3.293   4.833
  238    HB3  ASP  41           HB1      ASP  41  -8.530   1.745   4.023
  239    HA   PRO  42           HA       PRO  42  -8.425   4.148  -0.410
  240    HB2  PRO  42           HB2      PRO  42  -8.496   1.963  -2.011
  241    HB3  PRO  42           HB1      PRO  42  -7.055   2.973  -1.840
  242    HG2  PRO  42           HG2      PRO  42  -7.723   0.386  -0.482
  243    HG3  PRO  42           HG1      PRO  42  -6.202   0.888  -1.242
  244    HD2  PRO  42           HD2      PRO  42  -6.562   0.994   1.433
  245    HD3  PRO  42           HD1      PRO  42  -5.590   2.209   0.574
  246    H    ARG  43           HN       ARG  43  -9.316   1.592   1.640
  247    HA   ARG  43           HA       ARG  43 -11.858   0.965   0.511
  248    HB2  ARG  43           HB2      ARG  43 -12.328   0.015   2.811
  249    HB3  ARG  43           HB1      ARG  43 -10.926  -0.652   1.987
  250    HG2  ARG  43           HG2      ARG  43  -9.432   0.606   3.339
  251    HG3  ARG  43           HG1      ARG  43 -10.755   1.548   4.024
  252    HD2  ARG  43           HD2      ARG  43  -9.888  -0.192   5.558
  253    HD3  ARG  43           HD1      ARG  43 -11.598  -0.374   5.185
  254    HE   ARG  43           HE       ARG  43 -11.089  -2.266   3.868
  255   HH11  ARG  43          HH11      ARG  43  -8.212  -0.929   5.411
  256   HH12  ARG  43          HH12      ARG  43  -7.370  -2.453   5.394
  257   HH21  ARG  43          HH21      ARG  43  -9.959  -4.252   3.883
  258   HH22  ARG  43          HH22      ARG  43  -8.342  -4.313   4.528
  259    H    LEU  44           HN       LEU  44 -10.659   3.479   2.569
  260    HA   LEU  44           HA       LEU  44 -13.254   4.316   3.474
  261    HB2  LEU  44           HB2      LEU  44 -10.600   5.729   3.653
  262    HB3  LEU  44           HB1      LEU  44 -12.069   6.224   4.471
  263    HG   LEU  44           HG       LEU  44 -10.537   3.673   4.976
  264   HD11  LEU  44          HD11      LEU  44 -10.045   4.679   7.145
  265   HD12  LEU  44          HD12      LEU  44 -10.879   6.153   6.650
  266   HD13  LEU  44          HD13      LEU  44  -9.403   5.652   5.821
  267   HD21  LEU  44          HD21      LEU  44 -12.093   3.337   6.831
  268   HD22  LEU  44          HD22      LEU  44 -12.939   3.356   5.285
  269   HD23  LEU  44          HD23      LEU  44 -12.998   4.769   6.339
  270    H    LYS  45           HN       LYS  45 -11.673   4.537   0.660
  271    HA   LYS  45           HA       LYS  45 -13.235   6.760  -0.317
  272    HB2  LYS  45           HB2      LYS  45 -11.021   7.743  -1.314
  273    HB3  LYS  45           HB1      LYS  45 -11.500   8.152   0.327
  274    HG2  LYS  45           HG2      LYS  45  -9.873   6.799   1.276
  275    HG3  LYS  45           HG1      LYS  45  -9.680   5.837  -0.190
  276    HD2  LYS  45           HD2      LYS  45  -9.060   8.717  -0.422
  277    HD3  LYS  45           HD1      LYS  45  -7.954   7.757   0.563
  278    HE2  LYS  45           HE2      LYS  45  -7.238   7.893  -1.789
  279    HE3  LYS  45           HE1      LYS  45  -7.576   6.238  -1.285
  280    HZ1  LYS  45           HZ1      LYS  45  -8.479   6.731  -3.478
  281    HZ2  LYS  45           HZ2      LYS  45  -9.427   7.977  -2.833
  282    HZ3  LYS  45           HZ3      LYS  45  -9.720   6.365  -2.382
  283    H    GLN 112           H        GLN 112   8.525  10.995   5.719
  284    HA   GLN 112           HA       GLN 112   7.695   8.300   6.617
  285    HB2  GLN 112           HB2      GLN 112   6.149  10.119   7.264
  286    HB3  GLN 112           HB1      GLN 112   6.064  10.632   5.584
  287    HG2  GLN 112           HG2      GLN 112   5.153   8.368   5.033
  288    HG3  GLN 112           HG1      GLN 112   5.065   8.056   6.766
  289   HE21  GLN 112          HE21      GLN 112   3.543   9.150   8.011
  290   HE22  GLN 112          HE22      GLN 112   2.208   9.993   7.295
  291    H    ILE 113           HN       ILE 113   8.067   6.845   5.093
  292    HA   ILE 113           HA       ILE 113   7.395   7.434   2.341
  293    HB   ILE 113           HB       ILE 113   9.680   8.179   2.319
  294   HG12  ILE 113          HG12      ILE 113  10.703   6.530   0.721
  295   HG13  ILE 113          HG11      ILE 113   9.377   5.434   1.088
  296   HG21  ILE 113          HG21      ILE 113  11.560   6.738   2.952
  297   HG22  ILE 113          HG22      ILE 113  10.422   5.520   3.526
  298   HG23  ILE 113          HG23      ILE 113  10.500   7.094   4.317
  299   HD11  ILE 113          HD11      ILE 113   8.990   6.634  -0.988
  300   HD12  ILE 113          HD12      ILE 113   9.110   8.173  -0.133
  301   HD13  ILE 113          HD13      ILE 113   7.785   7.064   0.225
  302    HA   PRO 114           HA       PRO 114   6.292   3.153   3.088
  303    HB2  PRO 114           HB2      PRO 114   4.355   3.048   1.192
  304    HB3  PRO 114           HB1      PRO 114   4.113   3.743   2.796
  305    HG2  PRO 114           HG2      PRO 114   4.368   5.084   0.190
  306    HG3  PRO 114           HG1      PRO 114   3.617   5.661   1.683
  307    HD2  PRO 114           HD2      PRO 114   6.180   6.335   0.641
  308    HD3  PRO 114           HD1      PRO 114   5.468   6.841   2.183
  309    HA   PRO 115           HA       PRO 115   9.022   1.446  -0.123
  310    HB2  PRO 115           HB2      PRO 115   8.076  -1.006   1.269
  311    HB3  PRO 115           HB1      PRO 115   9.712  -0.516   0.853
  312    HG2  PRO 115           HG2      PRO 115   8.868  -0.370   3.357
  313    HG3  PRO 115           HG1      PRO 115   9.890   0.911   2.678
  314    HD2  PRO 115           HD2      PRO 115   6.944   0.897   3.175
  315    HD3  PRO 115           HD1      PRO 115   8.123   2.210   3.383
  316    HA   PRO 116           HA       PRO 116   5.951   0.182  -3.201
  317    HB2  PRO 116           HB2      PRO 116   8.029  -1.073  -4.640
  318    HB3  PRO 116           HB1      PRO 116   7.371   0.546  -4.926
  319    HG2  PRO 116           HG2      PRO 116   9.698  -0.287  -3.252
  320    HG3  PRO 116           HG1      PRO 116   9.550   1.094  -4.371
  321    HD2  PRO 116           HD2      PRO 116   9.233   1.584  -1.896
  322    HD3  PRO 116           HD1      PRO 116   7.980   2.142  -2.978
  323    H    TYR 117           HN       TYR 117   6.012  -1.442  -4.434
  324    HA   TYR 117           HA       TYR 117   5.338  -3.889  -3.022
  325    HB2  TYR 117           HB2      TYR 117   4.345  -4.639  -5.101
  326    HB3  TYR 117           HB1      TYR 117   3.876  -2.972  -4.794
  327    HD1  TYR 117           HD2      TYR 117   5.197  -1.136  -6.029
  328    HD2  TYR 117           HD1      TYR 117   5.294  -5.241  -7.128
  329    HE1  TYR 117           HE2      TYR 117   5.984  -0.516  -8.267
  330    HE2  TYR 117           HE1      TYR 117   6.071  -4.639  -9.367
  331    HH   TYR 117           HH       TYR 117   7.245  -1.560 -10.147
  332    H    VAL 118           HN       VAL 118   6.329  -5.856  -3.121
  333    HA   VAL 118           HA       VAL 118   8.817  -6.039  -4.665
  334    HB   VAL 118           HB       VAL 118   8.895  -6.612  -2.225
  335   HG11  VAL 118          HG11      VAL 118   7.188  -8.958  -3.042
  336   HG12  VAL 118          HG12      VAL 118   6.704  -7.633  -1.983
  337   HG13  VAL 118          HG13      VAL 118   7.969  -8.753  -1.476
  338   HG21  VAL 118          HG21      VAL 118   9.537  -8.862  -4.125
  339   HG22  VAL 118          HG22      VAL 118  10.193  -8.674  -2.498
  340   HG23  VAL 118          HG23      VAL 118  10.572  -7.486  -3.745
  341    H    GLU 119           HN       GLU 119   5.605  -7.140  -4.400
  342    HA   GLU 119           HA       GLU 119   5.921  -9.253  -6.391
  343    HB2  GLU 119           HB2      GLU 119   3.469  -8.315  -4.881
  344    HB3  GLU 119           HB1      GLU 119   3.570  -9.737  -5.905
  345    HG2  GLU 119           HG2      GLU 119   5.296  -9.388  -3.484
  346    HG3  GLU 119           HG1      GLU 119   3.679 -10.082  -3.394
  347    HA   PRO 120           HA       PRO 120   5.147  -6.130  -9.511
  348    HB2  PRO 120           HB2      PRO 120   4.439  -7.956 -11.492
  349    HB3  PRO 120           HB1      PRO 120   6.078  -7.401 -11.146
  350    HG2  PRO 120           HG2      PRO 120   4.704  -9.906 -10.290
  351    HG3  PRO 120           HG1      PRO 120   6.394  -9.654 -10.765
  352    HD2  PRO 120           HD2      PRO 120   5.690  -9.931  -8.192
  353    HD3  PRO 120           HD1      PRO 120   6.986  -8.817  -8.682
  Start of MODEL    6
    1    H    PHE  12           H        PHE  12 -12.203  -6.922  -1.847
    2    HA   PHE  12           HA       PHE  12 -14.071  -5.509  -2.167
    3    HB2  PHE  12           HB2      PHE  12 -14.834  -4.072  -0.228
    4    HB3  PHE  12           HB1      PHE  12 -15.301  -5.764  -0.162
    5    HD1  PHE  12           HD2      PHE  12 -12.659  -3.439   1.076
    6    HD2  PHE  12           HD1      PHE  12 -14.944  -6.963   1.766
    7    HE1  PHE  12           HE2      PHE  12 -11.697  -3.619   3.330
    8    HE2  PHE  12           HE1      PHE  12 -13.986  -7.143   4.024
    9    HZ   PHE  12           HZ       PHE  12 -12.360  -5.473   4.809
   10    H    LEU  13           HN       LEU  13 -10.940  -5.461  -1.451
   11    HA   LEU  13           HA       LEU  13 -10.757  -2.541  -1.721
   12    HB2  LEU  13           HB2      LEU  13  -8.454  -2.694  -1.003
   13    HB3  LEU  13           HB1      LEU  13  -9.500  -3.470   0.164
   14    HG   LEU  13           HG       LEU  13  -8.781  -5.632  -1.238
   15   HD11  LEU  13          HD11      LEU  13  -7.391  -4.410  -2.808
   16   HD12  LEU  13          HD12      LEU  13  -6.416  -5.495  -1.816
   17   HD13  LEU  13          HD13      LEU  13  -6.433  -3.765  -1.475
   18   HD21  LEU  13          HD21      LEU  13  -7.099  -6.035   0.486
   19   HD22  LEU  13          HD22      LEU  13  -8.565  -5.330   1.170
   20   HD23  LEU  13          HD23      LEU  13  -7.135  -4.327   0.922
   21    HA   PRO  14           HA       PRO  14  -9.884  -2.490  -5.965
   22    HB2  PRO  14           HB2      PRO  14  -7.527  -0.899  -5.088
   23    HB3  PRO  14           HB1      PRO  14  -8.615  -0.627  -6.459
   24    HG2  PRO  14           HG2      PRO  14  -9.036   0.692  -4.371
   25    HG3  PRO  14           HG1      PRO  14 -10.426  -0.158  -5.016
   26    HD2  PRO  14           HD2      PRO  14  -8.670  -0.914  -2.678
   27    HD3  PRO  14           HD1      PRO  14 -10.443  -0.954  -2.795
   28    H    LYS  15           HN       LYS  15  -8.733  -3.032  -7.517
   29    HA   LYS  15           HA       LYS  15  -7.139  -5.410  -7.092
   30    HB2  LYS  15           HB2      LYS  15  -8.828  -5.384  -8.856
   31    HB3  LYS  15           HB1      LYS  15  -8.007  -4.048  -9.652
   32    HG2  LYS  15           HG2      LYS  15  -6.167  -5.413 -10.248
   33    HG3  LYS  15           HG1      LYS  15  -6.705  -6.718  -9.192
   34    HD2  LYS  15           HD2      LYS  15  -7.182  -7.254 -11.510
   35    HD3  LYS  15           HD1      LYS  15  -8.682  -7.038 -10.610
   36    HE2  LYS  15           HE2      LYS  15  -8.827  -5.982 -12.794
   37    HE3  LYS  15           HE1      LYS  15  -8.897  -4.775 -11.512
   38    HZ1  LYS  15           HZ1      LYS  15  -6.371  -5.444 -12.908
   39    HZ2  LYS  15           HZ2      LYS  15  -6.720  -4.081 -11.961
   40    HZ3  LYS  15           HZ3      LYS  15  -7.435  -4.260 -13.486
   41    H    GLY  16           HN       GLY  16  -5.006  -5.649  -7.296
   42    HA2  GLY  16           HA2      GLY  16  -2.793  -5.079  -7.688
   43    HA3  GLY  16           HA1      GLY  16  -3.325  -3.615  -8.504
   44    H    TRP  17           HN       TRP  17  -4.611  -4.321  -5.398
   45    HA   TRP  17           HA       TRP  17  -2.760  -2.394  -4.173
   46    HB2  TRP  17           HB2      TRP  17  -5.695  -2.833  -3.833
   47    HB3  TRP  17           HB1      TRP  17  -4.770  -2.235  -2.460
   48    HD1  TRP  17           HD1      TRP  17  -5.666  -1.258  -6.092
   49    HE1  TRP  17           HE1      TRP  17  -5.485   1.298  -6.302
   50    HE3  TRP  17           HE3      TRP  17  -3.760  -0.194  -1.465
   51    HZ2  TRP  17           HZ2      TRP  17  -4.636   3.477  -4.721
   52    HZ3  TRP  17           HZ3      TRP  17  -3.288   2.152  -0.897
   53    HH2  TRP  17           HH2      TRP  17  -3.718   3.949  -2.494
   54    H    GLU  18           HN       GLU  18  -1.466  -3.160  -2.669
   55    HA   GLU  18           HA       GLU  18  -2.093  -5.805  -1.531
   56    HB2  GLU  18           HB2      GLU  18  -0.295  -5.582  -3.316
   57    HB3  GLU  18           HB1      GLU  18   0.716  -4.879  -2.121
   58    HG2  GLU  18           HG2      GLU  18  -0.542  -7.578  -1.802
   59    HG3  GLU  18           HG1      GLU  18   0.988  -7.318  -2.649
   60    H    VAL  19           HN       VAL  19  -1.781  -6.077   0.474
   61    HA   VAL  19           HA       VAL  19  -1.210  -3.682   2.095
   62    HB   VAL  19           HB       VAL  19  -2.868  -6.025   3.020
   63   HG11  VAL  19          HG11      VAL  19  -2.665  -3.180   3.983
   64   HG12  VAL  19          HG12      VAL  19  -1.984  -4.604   4.770
   65   HG13  VAL  19          HG13      VAL  19  -3.733  -4.418   4.646
   66   HG21  VAL  19          HG21      VAL  19  -3.858  -3.495   1.712
   67   HG22  VAL  19          HG22      VAL  19  -4.868  -4.723   2.474
   68   HG23  VAL  19          HG23      VAL  19  -3.936  -5.120   1.030
   69    H    ARG  20           HN       ARG  20   0.976  -4.047   2.354
   70    HA   ARG  20           HA       ARG  20   1.814  -6.585   3.541
   71    HB2  ARG  20           HB2      ARG  20   2.988  -5.540   1.529
   72    HB3  ARG  20           HB1      ARG  20   3.577  -4.313   2.649
   73    HG2  ARG  20           HG2      ARG  20   5.272  -5.973   2.386
   74    HG3  ARG  20           HG1      ARG  20   4.611  -6.099   4.011
   75    HD2  ARG  20           HD2      ARG  20   4.960  -8.293   2.927
   76    HD3  ARG  20           HD1      ARG  20   3.283  -7.997   3.385
   77    HE   ARG  20           HE       ARG  20   3.156  -7.228   0.882
   78   HH11  ARG  20          HH11      ARG  20   4.918  -9.955   2.188
   79   HH12  ARG  20          HH12      ARG  20   4.751 -10.919   0.751
   80   HH21  ARG  20          HH21      ARG  20   2.938  -8.448  -0.983
   81   HH22  ARG  20          HH22      ARG  20   3.613 -10.051  -1.082
   82    H    HIS  21           HN       HIS  21   3.090  -6.609   5.479
   83    HA   HIS  21           HA       HIS  21   2.541  -4.247   7.181
   84    HB2  HIS  21           HB2      HIS  21   1.518  -6.732   7.565
   85    HB3  HIS  21           HB1      HIS  21   3.027  -6.882   8.450
   86    HD1  HIS  21           HD1      HIS  21   1.871  -7.189  10.632
   87    HD2  HIS  21           HD2      HIS  21   0.947  -3.468   8.872
   88    HE1  HIS  21           HE1      HIS  21   0.578  -5.903  12.354
   89    HE2  HIS  21           HE2      HIS  21  -0.142  -3.789  11.208
   90    H    ALA  22           HN       ALA  22   4.358  -3.168   7.455
   91    HA   ALA  22           HA       ALA  22   6.937  -4.103   6.928
   92    HB1  ALA  22           HB1      ALA  22   6.077  -1.751   8.613
   93    HB2  ALA  22           HB2      ALA  22   6.304  -1.745   6.865
   94    HB3  ALA  22           HB3      ALA  22   7.685  -1.999   7.930
   95    HA   PRO  23           HA       PRO  23   8.343  -6.208  10.541
   96    HB2  PRO  23           HB2      PRO  23  10.695  -4.951  11.212
   97    HB3  PRO  23           HB1      PRO  23  10.529  -6.143   9.919
   98    HG2  PRO  23           HG2      PRO  23  10.566  -3.157   9.752
   99    HG3  PRO  23           HG1      PRO  23  11.336  -4.350   8.690
  100    HD2  PRO  23           HD2      PRO  23   9.062  -3.109   7.989
  101    HD3  PRO  23           HD1      PRO  23   9.362  -4.807   7.563
  102    H    ASN  24           HN       ASN  24   7.934  -2.780  10.783
  103    HA   ASN  24           HA       ASN  24   8.054  -2.719  13.669
  104    HB2  ASN  24           HB2      ASN  24   7.135  -0.386  13.380
  105    HB3  ASN  24           HB1      ASN  24   8.682  -0.671  12.596
  106   HD21  ASN  24          HD21      ASN  24   8.279   1.122  11.259
  107   HD22  ASN  24          HD22      ASN  24   7.218   0.989   9.900
  108    H    GLY  25           HN       GLY  25   5.958  -3.778  11.358
  109    HA2  GLY  25           HA2      GLY  25   3.898  -4.771  11.643
  110    HA3  GLY  25           HA1      GLY  25   3.830  -4.099  13.250
  111    H    ARG  26           HN       ARG  26   4.340  -2.400  10.213
  112    HA   ARG  26           HA       ARG  26   1.664  -1.199  10.503
  113    HB2  ARG  26           HB2      ARG  26   4.208   0.049   9.427
  114    HB3  ARG  26           HB1      ARG  26   2.612   0.750   9.202
  115    HG2  ARG  26           HG2      ARG  26   4.009   0.287  11.827
  116    HG3  ARG  26           HG1      ARG  26   3.708   1.838  11.038
  117    HD2  ARG  26           HD2      ARG  26   1.686  -0.059  12.216
  118    HD3  ARG  26           HD1      ARG  26   2.069   1.577  12.750
  119    HE   ARG  26           HE       ARG  26   1.233   1.966  10.214
  120   HH11  ARG  26          HH11      ARG  26  -0.160   0.242  12.926
  121   HH12  ARG  26          HH12      ARG  26  -1.802   0.479  12.395
  122   HH21  ARG  26          HH21      ARG  26  -0.910   2.267   9.504
  123   HH22  ARG  26          HH22      ARG  26  -2.234   1.639  10.450
  124    HA   PRO  27           HA       PRO  27   1.176  -2.928   6.402
  125    HB2  PRO  27           HB2      PRO  27  -1.442  -2.467   6.112
  126    HB3  PRO  27           HB1      PRO  27  -0.866  -3.672   7.272
  127    HG2  PRO  27           HG2      PRO  27  -1.717  -0.834   7.765
  128    HG3  PRO  27           HG1      PRO  27  -2.160  -2.300   8.663
  129    HD2  PRO  27           HD2      PRO  27  -0.162  -0.656   9.453
  130    HD3  PRO  27           HD1      PRO  27  -0.189  -2.323   9.832
  131    H    PHE  28           HN       PHE  28   1.999  -1.845   4.841
  132    HA   PHE  28           HA       PHE  28   1.010   0.805   4.133
  133    HB2  PHE  28           HB2      PHE  28   3.100   0.928   2.723
  134    HB3  PHE  28           HB1      PHE  28   3.374   0.864   4.450
  135    HD1  PHE  28           HD1      PHE  28   3.610  -1.776   5.286
  136    HD2  PHE  28           HD2      PHE  28   4.656  -0.215   1.451
  137    HE1  PHE  28           HE1      PHE  28   5.223  -3.591   4.982
  138    HE2  PHE  28           HE2      PHE  28   6.242  -2.056   1.150
  139    HZ   PHE  28           HZ       PHE  28   6.536  -3.743   2.911
  140    H    PHE  29           HN       PHE  29  -0.322   0.964   2.488
  141    HA   PHE  29           HA       PHE  29  -0.902  -1.447   0.970
  142    HB2  PHE  29           HB2      PHE  29  -2.365   1.205   0.986
  143    HB3  PHE  29           HB1      PHE  29  -2.906  -0.283   0.219
  144    HD1  PHE  29           HD2      PHE  29  -1.874   0.922   3.611
  145    HD2  PHE  29           HD1      PHE  29  -4.467  -1.528   1.292
  146    HE1  PHE  29           HE2      PHE  29  -3.093   0.287   5.652
  147    HE2  PHE  29           HE1      PHE  29  -5.696  -2.159   3.326
  148    HZ   PHE  29           HZ       PHE  29  -5.007  -1.255   5.506
  149    H    ILE  30           HN       ILE  30  -0.166  -1.756  -0.963
  150    HA   ILE  30           HA       ILE  30   1.201   0.451  -2.309
  151    HB   ILE  30           HB       ILE  30   1.361  -2.478  -2.998
  152   HG12  ILE  30          HG12      ILE  30   3.066  -0.905  -1.110
  153   HG13  ILE  30          HG11      ILE  30   1.904  -2.118  -0.620
  154   HG21  ILE  30          HG21      ILE  30   3.524  -1.829  -3.959
  155   HG22  ILE  30          HG22      ILE  30   3.235  -0.157  -3.478
  156   HG23  ILE  30          HG23      ILE  30   2.200  -0.918  -4.686
  157   HD11  ILE  30          HD11      ILE  30   4.156  -3.004  -0.553
  158   HD12  ILE  30          HD12      ILE  30   4.386  -2.596  -2.253
  159   HD13  ILE  30          HD13      ILE  30   3.205  -3.822  -1.792
  160    H    ASP  31           HN       ASP  31   0.502   1.254  -4.149
  161    HA   ASP  31           HA       ASP  31  -1.643  -0.117  -5.607
  162    HB2  ASP  31           HB2      ASP  31  -1.888   2.324  -5.312
  163    HB3  ASP  31           HB1      ASP  31  -0.362   2.578  -6.155
  164    H    HIS  32           HN       HIS  32  -1.170  -1.448  -7.210
  165    HA   HIS  32           HA       HIS  32   1.643  -1.604  -8.030
  166    HB2  HIS  32           HB2      HIS  32  -0.590  -3.651  -8.236
  167    HB3  HIS  32           HB1      HIS  32   1.079  -3.933  -8.710
  168    HD1  HIS  32           HD1      HIS  32  -0.522  -2.516  -5.583
  169    HD2  HIS  32           HD2      HIS  32   2.265  -5.391  -6.629
  170    HE1  HIS  32           HE1      HIS  32   0.422  -3.393  -3.451
  171    HE2  HIS  32           HE2      HIS  32   1.867  -5.321  -4.125
  172    H    ASN  33           HN       ASN  33  -0.973  -0.105  -9.070
  173    HA   ASN  33           HA       ASN  33  -0.787  -0.792 -11.897
  174    HB2  ASN  33           HB2      ASN  33  -2.468   1.348 -10.567
  175    HB3  ASN  33           HB1      ASN  33  -2.630   0.766 -12.220
  176   HD21  ASN  33          HD21      ASN  33  -3.373   0.215  -8.911
  177   HD22  ASN  33          HD22      ASN  33  -4.382  -1.176  -9.142
  178    H    THR  34           HN       THR  34  -0.481   2.103  -9.860
  179    HA   THR  34           HA       THR  34   1.249   3.295 -11.930
  180    HB   THR  34           HB       THR  34  -0.778   4.595 -11.450
  181    HG1  THR  34           HG1      THR  34   0.578   6.521 -10.464
  182   HG21  THR  34          HG21      THR  34   0.292   4.778  -8.635
  183   HG22  THR  34          HG22      THR  34  -1.156   3.908  -9.145
  184   HG23  THR  34          HG23      THR  34  -1.094   5.666  -9.270
  185    H    LYS  35           HN       LYS  35   1.460   1.622  -9.155
  186    HA   LYS  35           HA       LYS  35   3.135   1.157  -7.713
  187    HB2  LYS  35           HB2      LYS  35   4.682   2.756  -9.732
  188    HB3  LYS  35           HB1      LYS  35   5.453   2.105  -8.302
  189    HG2  LYS  35           HG2      LYS  35   5.868   0.593 -10.068
  190    HG3  LYS  35           HG1      LYS  35   4.667  -0.161  -9.025
  191    HD2  LYS  35           HD2      LYS  35   4.058  -0.522 -11.326
  192    HD3  LYS  35           HD1      LYS  35   2.901   0.590 -10.593
  193    HE2  LYS  35           HE2      LYS  35   4.054   2.479 -11.608
  194    HE3  LYS  35           HE1      LYS  35   5.248   1.389 -12.311
  195    HZ1  LYS  35           HZ1      LYS  35   3.538   2.042 -13.907
  196    HZ2  LYS  35           HZ2      LYS  35   2.340   1.364 -12.923
  197    HZ3  LYS  35           HZ3      LYS  35   3.517   0.369 -13.632
  198    H    THR  36           HN       THR  36   1.455   2.992  -6.766
  199    HA   THR  36           HA       THR  36   3.235   4.899  -5.389
  200    HB   THR  36           HB       THR  36   1.172   6.264  -4.935
  201    HG1  THR  36           HG1      THR  36  -0.217   4.352  -5.589
  202   HG21  THR  36          HG21      THR  36   1.094   7.278  -7.176
  203   HG22  THR  36          HG22      THR  36   1.929   5.870  -7.831
  204   HG23  THR  36          HG23      THR  36   2.748   6.920  -6.676
  205    H    THR  37           HN       THR  37   3.377   4.734  -3.239
  206    HA   THR  37           HA       THR  37   1.733   2.678  -1.941
  207    HB   THR  37           HB       THR  37   3.676   2.915  -0.208
  208    HG1  THR  37           HG1      THR  37   5.598   3.635  -1.177
  209   HG21  THR  37          HG21      THR  37   4.094   1.653  -2.922
  210   HG22  THR  37          HG22      THR  37   3.255   0.915  -1.556
  211   HG23  THR  37          HG23      THR  37   4.984   1.253  -1.452
  212    H    THR  38           HN       THR  38   0.605   3.091  -0.090
  213    HA   THR  38           HA       THR  38   0.968   5.608   1.316
  214    HB   THR  38           HB       THR  38  -0.698   5.960  -0.603
  215    HG1  THR  38           HG1      THR  38  -1.014   6.636   2.079
  216   HG21  THR  38          HG21      THR  38  -3.000   5.226  -0.206
  217   HG22  THR  38          HG22      THR  38  -2.461   4.292   1.190
  218   HG23  THR  38          HG23      THR  38  -1.909   3.858  -0.428
  219    H    TRP  39           HN       TRP  39   0.249   5.467   3.500
  220    HA   TRP  39           HA       TRP  39  -0.025   2.730   4.449
  221    HB2  TRP  39           HB2      TRP  39  -0.134   5.225   6.134
  222    HB3  TRP  39           HB1      TRP  39   0.280   3.596   6.647
  223    HD1  TRP  39           HD1      TRP  39   1.713   6.635   4.851
  224    HE1  TRP  39           HE1      TRP  39   4.302   6.414   4.845
  225    HE3  TRP  39           HE3      TRP  39   2.132   1.899   6.702
  226    HZ2  TRP  39           HZ2      TRP  39   6.244   4.466   5.548
  227    HZ3  TRP  39           HZ3      TRP  39   4.362   0.927   7.023
  228    HH2  TRP  39           HH2      TRP  39   6.373   2.178   6.464
  229    H    GLU  40           HN       GLU  40  -1.893   5.537   3.981
  230    HA   GLU  40           HA       GLU  40  -4.025   4.759   5.728
  231    HB2  GLU  40           HB2      GLU  40  -5.092   6.837   4.527
  232    HB3  GLU  40           HB1      GLU  40  -3.803   7.039   5.712
  233    HG2  GLU  40           HG2      GLU  40  -3.152   6.793   2.824
  234    HG3  GLU  40           HG1      GLU  40  -3.689   8.331   3.485
  235    H    ASP  41           HN       ASP  41  -5.659   3.625   5.261
  236    HA   ASP  41           HA       ASP  41  -5.830   1.909   3.134
  237    HB2  ASP  41           HB2      ASP  41  -8.126   2.890   4.839
  238    HB3  ASP  41           HB1      ASP  41  -8.122   1.423   3.882
  239    HA   PRO  42           HA       PRO  42  -7.677   4.282  -0.217
  240    HB2  PRO  42           HB2      PRO  42  -8.456   2.107  -1.687
  241    HB3  PRO  42           HB1      PRO  42  -6.810   2.751  -1.695
  242    HG2  PRO  42           HG2      PRO  42  -7.932   0.438  -0.163
  243    HG3  PRO  42           HG1      PRO  42  -6.387   0.567  -1.025
  244    HD2  PRO  42           HD2      PRO  42  -6.540   0.817   1.648
  245    HD3  PRO  42           HD1      PRO  42  -5.390   1.769   0.687
  246    H    ARG  43           HN       ARG  43  -9.068   2.164   1.979
  247    HA   ARG  43           HA       ARG  43 -11.777   2.187   1.035
  248    HB2  ARG  43           HB2      ARG  43 -10.617   1.472   3.733
  249    HB3  ARG  43           HB1      ARG  43 -12.263   1.131   3.203
  250    HG2  ARG  43           HG2      ARG  43 -11.391  -0.248   1.407
  251    HG3  ARG  43           HG1      ARG  43  -9.750   0.073   1.942
  252    HD2  ARG  43           HD2      ARG  43 -11.762  -1.113   3.814
  253    HD3  ARG  43           HD1      ARG  43 -10.886  -2.130   2.671
  254    HE   ARG  43           HE       ARG  43  -9.406  -0.387   4.520
  255   HH11  ARG  43          HH11      ARG  43 -10.270  -3.584   3.409
  256   HH12  ARG  43          HH12      ARG  43  -8.978  -4.378   4.251
  257   HH21  ARG  43          HH21      ARG  43  -7.681  -1.393   5.615
  258   HH22  ARG  43          HH22      ARG  43  -7.495  -3.129   5.518
  259    H    LEU  44           HN       LEU  44  -9.775   4.320   2.632
  260    HA   LEU  44           HA       LEU  44 -11.799   5.745   4.085
  261    HB2  LEU  44           HB2      LEU  44  -8.978   6.548   3.392
  262    HB3  LEU  44           HB1      LEU  44 -10.033   7.427   4.482
  263    HG   LEU  44           HG       LEU  44  -9.093   4.598   4.945
  264   HD11  LEU  44          HD11      LEU  44  -7.618   5.565   6.643
  265   HD12  LEU  44          HD12      LEU  44  -8.104   7.184   6.136
  266   HD13  LEU  44          HD13      LEU  44  -7.216   6.141   5.025
  267   HD21  LEU  44          HD21      LEU  44 -10.508   6.560   6.746
  268   HD22  LEU  44          HD22      LEU  44  -9.931   4.959   7.213
  269   HD23  LEU  44          HD23      LEU  44 -11.219   5.119   6.018
  270    H    LYS  45           HN       LYS  45 -11.031   5.481   0.950
  271    HA   LYS  45           HA       LYS  45 -11.700   8.241   0.247
  272    HB2  LYS  45           HB2      LYS  45 -10.586   6.018  -1.468
  273    HB3  LYS  45           HB1      LYS  45 -10.933   7.647  -2.027
  274    HG2  LYS  45           HG2      LYS  45  -8.867   6.818  -0.006
  275    HG3  LYS  45           HG1      LYS  45  -8.588   7.450  -1.627
  276    HD2  LYS  45           HD2      LYS  45  -9.909   8.977   0.617
  277    HD3  LYS  45           HD1      LYS  45  -8.210   9.118   0.173
  278    HE2  LYS  45           HE2      LYS  45  -9.214  10.935  -0.882
  279    HE3  LYS  45           HE1      LYS  45  -9.072   9.735  -2.162
  280    HZ1  LYS  45           HZ1      LYS  45 -11.556  10.084  -0.575
  281    HZ2  LYS  45           HZ2      LYS  45 -11.362   9.259  -2.048
  282    HZ3  LYS  45           HZ3      LYS  45 -11.253  10.950  -2.001
  283    H    GLN 112           H        GLN 112   7.423  11.410   3.609
  284    HA   GLN 112           HA       GLN 112   7.827   8.960   5.203
  285    HB2  GLN 112           HB2      GLN 112   6.245  10.487   6.340
  286    HB3  GLN 112           HB1      GLN 112   5.284  10.562   4.870
  287    HG2  GLN 112           HG2      GLN 112   4.353   9.037   6.549
  288    HG3  GLN 112           HG1      GLN 112   4.751   8.226   5.037
  289   HE21  GLN 112          HE21      GLN 112   5.598   8.630   8.383
  290   HE22  GLN 112          HE22      GLN 112   6.638   7.247   8.492
  291    H    ILE 113           HN       ILE 113   8.311   7.600   3.566
  292    HA   ILE 113           HA       ILE 113   6.217   7.231   1.553
  293    HB   ILE 113           HB       ILE 113   7.927   6.707  -0.196
  294   HG12  ILE 113          HG12      ILE 113   9.853   6.559   1.490
  295   HG13  ILE 113          HG11      ILE 113  10.179   7.364  -0.039
  296   HG21  ILE 113          HG21      ILE 113   8.312   9.046  -0.829
  297   HG22  ILE 113          HG22      ILE 113   7.814   9.545   0.789
  298   HG23  ILE 113          HG23      ILE 113   6.662   8.749  -0.283
  299   HD11  ILE 113          HD11      ILE 113   9.611   8.726   2.586
  300   HD12  ILE 113          HD12      ILE 113   9.951   9.532   1.054
  301   HD13  ILE 113          HD13      ILE 113  11.191   8.543   1.825
  302    HA   PRO 114           HA       PRO 114   6.993   3.093   3.041
  303    HB2  PRO 114           HB2      PRO 114   4.739   2.010   1.928
  304    HB3  PRO 114           HB1      PRO 114   4.782   2.846   3.480
  305    HG2  PRO 114           HG2      PRO 114   3.667   3.720   0.921
  306    HG3  PRO 114           HG1      PRO 114   3.336   4.312   2.553
  307    HD2  PRO 114           HD2      PRO 114   4.964   5.512   0.553
  308    HD3  PRO 114           HD1      PRO 114   4.700   6.066   2.215
  309    HA   PRO 115           HA       PRO 115   9.138   1.169  -0.413
  310    HB2  PRO 115           HB2      PRO 115   8.182  -1.189   1.166
  311    HB3  PRO 115           HB1      PRO 115   9.758  -0.896   0.446
  312    HG2  PRO 115           HG2      PRO 115   9.436  -0.534   3.029
  313    HG3  PRO 115           HG1      PRO 115  10.363   0.655   2.091
  314    HD2  PRO 115           HD2      PRO 115   7.593   0.838   3.177
  315    HD3  PRO 115           HD1      PRO 115   8.825   2.103   2.991
  316    HA   PRO 116           HA       PRO 116   5.810  -0.146  -3.251
  317    HB2  PRO 116           HB2      PRO 116   7.905  -1.152  -4.881
  318    HB3  PRO 116           HB1      PRO 116   7.013   0.364  -5.104
  319    HG2  PRO 116           HG2      PRO 116   9.575  -0.149  -3.669
  320    HG3  PRO 116           HG1      PRO 116   9.117   1.219  -4.718
  321    HD2  PRO 116           HD2      PRO 116   8.997   1.602  -2.204
  322    HD3  PRO 116           HD1      PRO 116   7.584   2.012  -3.143
  323    H    TYR 117           HN       TYR 117   5.974  -1.771  -4.551
  324    HA   TYR 117           HA       TYR 117   5.623  -4.205  -3.001
  325    HB2  TYR 117           HB2      TYR 117   4.392  -5.099  -4.852
  326    HB3  TYR 117           HB1      TYR 117   3.901  -3.428  -4.623
  327    HD1  TYR 117           HD1      TYR 117   4.466  -1.723  -6.306
  328    HD2  TYR 117           HD2      TYR 117   5.579  -5.799  -6.820
  329    HE1  TYR 117           HE1      TYR 117   4.896  -1.306  -8.677
  330    HE2  TYR 117           HE2      TYR 117   6.024  -5.388  -9.194
  331    HH   TYR 117           HH       TYR 117   5.416  -3.823 -10.948
  332    H    VAL 118           HN       VAL 118   6.890  -5.958  -2.972
  333    HA   VAL 118           HA       VAL 118   9.241  -6.047  -4.677
  334    HB   VAL 118           HB       VAL 118   8.396  -8.015  -2.538
  335   HG11  VAL 118          HG11      VAL 118  11.090  -7.478  -3.784
  336   HG12  VAL 118          HG12      VAL 118  10.066  -8.879  -4.093
  337   HG13  VAL 118          HG13      VAL 118  10.761  -8.631  -2.490
  338   HG21  VAL 118          HG21      VAL 118   9.928  -6.820  -1.039
  339   HG22  VAL 118          HG22      VAL 118   8.595  -5.794  -1.564
  340   HG23  VAL 118          HG23      VAL 118  10.191  -5.602  -2.287
  341    H    GLU 119           HN       GLU 119   6.080  -7.217  -4.616
  342    HA   GLU 119           HA       GLU 119   6.630  -9.008  -6.847
  343    HB2  GLU 119           HB2      GLU 119   4.958 -10.645  -5.855
  344    HB3  GLU 119           HB1      GLU 119   6.539 -10.581  -5.094
  345    HG2  GLU 119           HG2      GLU 119   5.651  -9.238  -3.287
  346    HG3  GLU 119           HG1      GLU 119   4.073  -9.195  -4.069
  347    HA   PRO 120           HA       PRO 120   3.039  -6.770  -8.331
  348    HB2  PRO 120           HB2      PRO 120   3.364  -8.364 -10.746
  349    HB3  PRO 120           HB1      PRO 120   3.581  -6.627 -10.528
  350    HG2  PRO 120           HG2      PRO 120   5.643  -8.325 -11.014
  351    HG3  PRO 120           HG1      PRO 120   5.818  -6.829 -10.080
  352    HD2  PRO 120           HD2      PRO 120   5.568  -9.650  -9.111
  353    HD3  PRO 120           HD1      PRO 120   6.613  -8.340  -8.519
  Start of MODEL    7
    1    H    PHE  12           H        PHE  12 -12.964  -7.162  -0.422
    2    HA   PHE  12           HA       PHE  12 -14.022  -5.579  -1.912
    3    HB2  PHE  12           HB2      PHE  12 -15.152  -4.281  -0.203
    4    HB3  PHE  12           HB1      PHE  12 -14.854  -5.906   0.397
    5    HD1  PHE  12           HD1      PHE  12 -13.052  -6.281   2.076
    6    HD2  PHE  12           HD2      PHE  12 -14.260  -2.381   0.872
    7    HE1  PHE  12           HE1      PHE  12 -12.002  -5.337   4.090
    8    HE2  PHE  12           HE2      PHE  12 -13.206  -1.431   2.881
    9    HZ   PHE  12           HZ       PHE  12 -12.077  -2.910   4.492
   10    H    LEU  13           HN       LEU  13 -10.941  -4.853  -1.375
   11    HA   LEU  13           HA       LEU  13 -11.286  -2.010  -2.052
   12    HB2  LEU  13           HB2      LEU  13  -8.947  -1.710  -1.321
   13    HB3  LEU  13           HB1      LEU  13  -9.991  -2.277  -0.035
   14    HG   LEU  13           HG       LEU  13  -9.037  -4.636  -0.797
   15   HD11  LEU  13          HD11      LEU  13  -6.692  -4.483  -1.409
   16   HD12  LEU  13          HD12      LEU  13  -6.832  -2.729  -1.526
   17   HD13  LEU  13          HD13      LEU  13  -7.724  -3.762  -2.644
   18   HD21  LEU  13          HD21      LEU  13  -7.356  -4.426   0.960
   19   HD22  LEU  13          HD22      LEU  13  -8.882  -3.683   1.442
   20   HD23  LEU  13          HD23      LEU  13  -7.533  -2.672   0.921
   21    HA   PRO  14           HA       PRO  14  -9.984  -2.367  -6.184
   22    HB2  PRO  14           HB2      PRO  14  -7.650  -0.686  -5.426
   23    HB3  PRO  14           HB1      PRO  14  -8.692  -0.585  -6.855
   24    HG2  PRO  14           HG2      PRO  14  -9.135   0.998  -4.962
   25    HG3  PRO  14           HG1      PRO  14 -10.526   0.114  -5.558
   26    HD2  PRO  14           HD2      PRO  14  -8.888  -0.395  -3.072
   27    HD3  PRO  14           HD1      PRO  14 -10.655  -0.401  -3.254
   28    H    LYS  15           HN       LYS  15  -8.719  -3.117  -7.570
   29    HA   LYS  15           HA       LYS  15  -7.260  -5.451  -6.680
   30    HB2  LYS  15           HB2      LYS  15  -7.134  -6.053  -9.047
   31    HB3  LYS  15           HB1      LYS  15  -8.774  -5.601  -8.607
   32    HG2  LYS  15           HG2      LYS  15  -8.496  -3.437  -9.643
   33    HG3  LYS  15           HG1      LYS  15  -6.806  -3.802 -10.005
   34    HD2  LYS  15           HD2      LYS  15  -8.154  -4.141 -11.983
   35    HD3  LYS  15           HD1      LYS  15  -7.545  -5.693 -11.403
   36    HE2  LYS  15           HE2      LYS  15  -9.723  -6.057 -10.263
   37    HE3  LYS  15           HE1      LYS  15 -10.313  -4.568 -10.999
   38    HZ1  LYS  15           HZ1      LYS  15 -11.037  -6.337 -12.353
   39    HZ2  LYS  15           HZ2      LYS  15  -9.511  -7.071 -12.362
   40    HZ3  LYS  15           HZ3      LYS  15  -9.750  -5.613 -13.194
   41    H    GLY  16           HN       GLY  16  -5.083  -5.869  -6.897
   42    HA2  GLY  16           HA2      GLY  16  -2.847  -5.416  -7.285
   43    HA3  GLY  16           HA1      GLY  16  -3.306  -3.955  -8.149
   44    H    TRP  17           HN       TRP  17  -5.000  -3.673  -5.435
   45    HA   TRP  17           HA       TRP  17  -2.948  -2.092  -4.111
   46    HB2  TRP  17           HB2      TRP  17  -5.934  -2.299  -3.840
   47    HB3  TRP  17           HB1      TRP  17  -4.981  -1.556  -2.560
   48    HD1  TRP  17           HD1      TRP  17  -5.745  -1.079  -6.325
   49    HE1  TRP  17           HE1      TRP  17  -5.437   1.413  -6.885
   50    HE3  TRP  17           HE3      TRP  17  -3.917   0.549  -1.829
   51    HZ2  TRP  17           HZ2      TRP  17  -4.524   3.753  -5.603
   52    HZ3  TRP  17           HZ3      TRP  17  -3.345   2.928  -1.588
   53    HH2  TRP  17           HH2      TRP  17  -3.641   4.497  -3.435
   54    H    GLU  18           HN       GLU  18  -1.687  -3.053  -2.734
   55    HA   GLU  18           HA       GLU  18  -2.660  -5.499  -1.443
   56    HB2  GLU  18           HB2      GLU  18  -0.073  -4.696  -2.585
   57    HB3  GLU  18           HB1      GLU  18  -0.014  -5.692  -1.152
   58    HG2  GLU  18           HG2      GLU  18  -1.464  -6.359  -3.698
   59    HG3  GLU  18           HG1      GLU  18   0.076  -7.025  -3.165
   60    H    VAL  19           HN       VAL  19  -2.295  -5.919   0.580
   61    HA   VAL  19           HA       VAL  19  -1.480  -3.693   2.331
   62    HB   VAL  19           HB       VAL  19  -3.316  -5.943   3.150
   63   HG11  VAL  19          HG11      VAL  19  -2.820  -3.208   4.322
   64   HG12  VAL  19          HG12      VAL  19  -2.204  -4.735   4.952
   65   HG13  VAL  19          HG13      VAL  19  -3.939  -4.417   4.955
   66   HG21  VAL  19          HG21      VAL  19  -4.395  -4.775   1.301
   67   HG22  VAL  19          HG22      VAL  19  -4.138  -3.231   2.113
   68   HG23  VAL  19          HG23      VAL  19  -5.215  -4.432   2.825
   69    H    ARG  20           HN       ARG  20   0.587  -4.165   2.905
   70    HA   ARG  20           HA       ARG  20   1.026  -6.846   4.046
   71    HB2  ARG  20           HB2      ARG  20   2.152  -6.447   1.779
   72    HB3  ARG  20           HB1      ARG  20   3.170  -5.281   2.619
   73    HG2  ARG  20           HG2      ARG  20   3.995  -7.007   4.102
   74    HG3  ARG  20           HG1      ARG  20   2.925  -8.193   3.349
   75    HD2  ARG  20           HD2      ARG  20   5.170  -6.708   2.027
   76    HD3  ARG  20           HD1      ARG  20   5.180  -8.409   2.484
   77    HE   ARG  20           HE       ARG  20   3.071  -7.575   0.658
   78   HH11  ARG  20          HH11      ARG  20   6.250  -9.044   0.984
   79   HH12  ARG  20          HH12      ARG  20   6.144  -9.846  -0.561
   80   HH21  ARG  20          HH21      ARG  20   2.944  -8.658  -1.311
   81   HH22  ARG  20          HH22      ARG  20   4.277  -9.644  -1.842
   82    H    HIS  21           HN       HIS  21   2.493  -6.936   5.800
   83    HA   HIS  21           HA       HIS  21   2.606  -4.400   7.284
   84    HB2  HIS  21           HB2      HIS  21   2.429  -7.235   8.046
   85    HB3  HIS  21           HB1      HIS  21   3.576  -6.314   8.999
   86    HD1  HIS  21           HD1      HIS  21   1.264  -7.532  10.394
   87    HD2  HIS  21           HD2      HIS  21   1.081  -3.610   8.865
   88    HE1  HIS  21           HE1      HIS  21  -0.527  -6.347  11.683
   89    HE2  HIS  21           HE2      HIS  21  -0.814  -4.147  10.538
   90    H    ALA  22           HN       ALA  22   4.432  -3.292   7.125
   91    HA   ALA  22           HA       ALA  22   6.941  -4.378   6.356
   92    HB1  ALA  22           HB1      ALA  22   7.831  -2.176   6.979
   93    HB2  ALA  22           HB2      ALA  22   6.297  -1.774   7.752
   94    HB3  ALA  22           HB3      ALA  22   6.365  -2.022   6.006
   95    HA   PRO  23           HA       PRO  23   8.634  -6.126   9.975
   96    HB2  PRO  23           HB2      PRO  23  10.932  -4.247   9.934
   97    HB3  PRO  23           HB1      PRO  23  10.915  -6.014   9.886
   98    HG2  PRO  23           HG2      PRO  23  11.456  -4.600   7.697
   99    HG3  PRO  23           HG1      PRO  23  10.477  -6.077   7.611
  100    HD2  PRO  23           HD2      PRO  23   9.603  -3.216   7.530
  101    HD3  PRO  23           HD1      PRO  23   9.006  -4.604   6.596
  102    H    ASN  24           HN       ASN  24   8.047  -2.739  10.035
  103    HA   ASN  24           HA       ASN  24   8.674  -2.396  12.829
  104    HB2  ASN  24           HB2      ASN  24   7.844  -0.133  12.575
  105    HB3  ASN  24           HB1      ASN  24   8.931  -0.506  11.244
  106   HD21  ASN  24          HD21      ASN  24   6.861   1.510  11.454
  107   HD22  ASN  24          HD22      ASN  24   5.781   1.223  10.137
  108    H    GLY  25           HN       GLY  25   6.179  -3.658  10.988
  109    HA2  GLY  25           HA2      GLY  25   4.369  -4.818  11.971
  110    HA3  GLY  25           HA1      GLY  25   4.490  -3.752  13.355
  111    H    ARG  26           HN       ARG  26   4.498  -2.500  10.111
  112    HA   ARG  26           HA       ARG  26   1.740  -1.530  10.517
  113    HB2  ARG  26           HB2      ARG  26   4.161  -0.073   9.437
  114    HB3  ARG  26           HB1      ARG  26   2.526   0.476   9.110
  115    HG2  ARG  26           HG2      ARG  26   3.667   0.129  11.871
  116    HG3  ARG  26           HG1      ARG  26   3.652   1.652  10.980
  117    HD2  ARG  26           HD2      ARG  26   1.764   1.824  12.306
  118    HD3  ARG  26           HD1      ARG  26   1.107   1.231  10.782
  119    HE   ARG  26           HE       ARG  26   1.776  -0.842  12.681
  120   HH11  ARG  26          HH11      ARG  26  -0.717   1.278  11.429
  121   HH12  ARG  26          HH12      ARG  26  -2.015   0.400  12.180
  122   HH21  ARG  26          HH21      ARG  26   0.043  -1.997  13.672
  123   HH22  ARG  26          HH22      ARG  26  -1.592  -1.440  13.449
  124    HA   PRO  27           HA       PRO  27   1.127  -3.111   6.362
  125    HB2  PRO  27           HB2      PRO  27  -1.436  -2.393   6.063
  126    HB3  PRO  27           HB1      PRO  27  -0.999  -3.662   7.211
  127    HG2  PRO  27           HG2      PRO  27  -1.518  -0.747   7.736
  128    HG3  PRO  27           HG1      PRO  27  -2.162  -2.160   8.600
  129    HD2  PRO  27           HD2      PRO  27  -0.014  -0.822   9.506
  130    HD3  PRO  27           HD1      PRO  27  -0.198  -2.517   9.737
  131    H    PHE  28           HN       PHE  28   2.131  -2.008   4.874
  132    HA   PHE  28           HA       PHE  28   1.231   0.672   4.154
  133    HB2  PHE  28           HB2      PHE  28   3.284   0.761   2.750
  134    HB3  PHE  28           HB1      PHE  28   3.633   0.518   4.450
  135    HD1  PHE  28           HD2      PHE  28   3.578  -2.243   4.972
  136    HD2  PHE  28           HD1      PHE  28   4.786  -0.311   1.376
  137    HE1  PHE  28           HE2      PHE  28   4.987  -4.176   4.410
  138    HE2  PHE  28           HE1      PHE  28   6.193  -2.247   0.813
  139    HZ   PHE  28           HZ       PHE  28   6.297  -4.179   2.328
  140    H    PHE  29           HN       PHE  29  -0.010   0.959   2.439
  141    HA   PHE  29           HA       PHE  29  -0.839  -1.425   1.001
  142    HB2  PHE  29           HB2      PHE  29  -2.000   1.375   0.958
  143    HB3  PHE  29           HB1      PHE  29  -2.686  -0.042   0.166
  144    HD1  PHE  29           HD2      PHE  29  -1.620   1.092   3.564
  145    HD2  PHE  29           HD1      PHE  29  -4.336  -1.203   1.229
  146    HE1  PHE  29           HE2      PHE  29  -2.902   0.549   5.593
  147    HE2  PHE  29           HE1      PHE  29  -5.620  -1.745   3.252
  148    HZ   PHE  29           HZ       PHE  29  -4.905  -0.871   5.434
  149    H    ILE  30           HN       ILE  30   0.152  -1.920  -0.755
  150    HA   ILE  30           HA       ILE  30   1.543   0.153  -2.266
  151    HB   ILE  30           HB       ILE  30   1.692  -2.812  -2.785
  152   HG12  ILE  30          HG12      ILE  30   3.596  -1.196  -1.136
  153   HG13  ILE  30          HG11      ILE  30   2.335  -2.180  -0.414
  154   HG21  ILE  30          HG21      ILE  30   3.827  -2.195  -3.832
  155   HG22  ILE  30          HG22      ILE  30   3.532  -0.504  -3.429
  156   HG23  ILE  30          HG23      ILE  30   2.473  -1.336  -4.568
  157   HD11  ILE  30          HD11      ILE  30   3.325  -4.166  -1.441
  158   HD12  ILE  30          HD12      ILE  30   4.468  -3.333  -0.386
  159   HD13  ILE  30          HD13      ILE  30   4.599  -3.165  -2.138
  160    H    ASP  31           HN       ASP  31   0.871   0.841  -4.112
  161    HA   ASP  31           HA       ASP  31  -1.373  -0.461  -5.447
  162    HB2  ASP  31           HB2      ASP  31  -1.614   1.906  -5.380
  163    HB3  ASP  31           HB1      ASP  31   0.045   2.165  -5.912
  164    H    HIS  32           HN       HIS  32  -0.821  -2.149  -6.584
  165    HA   HIS  32           HA       HIS  32   1.793  -2.341  -7.819
  166    HB2  HIS  32           HB2      HIS  32  -0.488  -4.318  -7.554
  167    HB3  HIS  32           HB1      HIS  32   1.043  -4.694  -8.327
  168    HD1  HIS  32           HD1      HIS  32   1.918  -6.418  -6.629
  169    HD2  HIS  32           HD2      HIS  32   0.777  -2.821  -4.870
  170    HE1  HIS  32           HE1      HIS  32   2.668  -6.520  -4.198
  171    HE2  HIS  32           HE2      HIS  32   1.767  -4.446  -3.156
  172    H    ASN  33           HN       ASN  33  -0.973  -0.917  -8.665
  173    HA   ASN  33           HA       ASN  33  -1.089  -1.803 -11.436
  174    HB2  ASN  33           HB2      ASN  33  -2.609   0.455 -10.110
  175    HB3  ASN  33           HB1      ASN  33  -2.963  -0.277 -11.668
  176   HD21  ASN  33          HD21      ASN  33  -3.237  -0.538  -8.246
  177   HD22  ASN  33          HD22      ASN  33  -4.318  -1.906  -8.233
  178    H    THR  34           HN       THR  34  -0.826   1.369  -9.834
  179    HA   THR  34           HA       THR  34   0.521   2.403 -12.235
  180    HB   THR  34           HB       THR  34  -0.398   4.201 -10.042
  181    HG1  THR  34           HG1      THR  34  -2.208   2.965 -10.153
  182   HG21  THR  34          HG21      THR  34  -1.047   5.608 -11.953
  183   HG22  THR  34          HG22      THR  34  -0.566   4.320 -13.058
  184   HG23  THR  34          HG23      THR  34   0.645   5.119 -12.056
  185    H    LYS  35           HN       LYS  35   1.310   1.167  -9.320
  186    HA   LYS  35           HA       LYS  35   3.119   1.163  -7.983
  187    HB2  LYS  35           HB2      LYS  35   4.328   2.779 -10.220
  188    HB3  LYS  35           HB1      LYS  35   5.225   2.340  -8.781
  189    HG2  LYS  35           HG2      LYS  35   5.807   0.752 -10.402
  190    HG3  LYS  35           HG1      LYS  35   4.674  -0.065  -9.329
  191    HD2  LYS  35           HD2      LYS  35   4.117  -0.642 -11.588
  192    HD3  LYS  35           HD1      LYS  35   2.865   0.438 -10.972
  193    HE2  LYS  35           HE2      LYS  35   3.481   1.043 -13.245
  194    HE3  LYS  35           HE1      LYS  35   3.931   2.321 -12.120
  195    HZ1  LYS  35           HZ1      LYS  35   5.654   1.837 -13.784
  196    HZ2  LYS  35           HZ2      LYS  35   5.803   0.262 -13.163
  197    HZ3  LYS  35           HZ3      LYS  35   6.203   1.597 -12.196
  198    H    THR  36           HN       THR  36   1.997   2.188  -6.403
  199    HA   THR  36           HA       THR  36   2.898   4.880  -5.735
  200    HB   THR  36           HB       THR  36   0.010   4.313  -5.275
  201    HG1  THR  36           HG1      THR  36  -0.010   3.914  -7.454
  202   HG21  THR  36          HG21      THR  36   1.549   6.813  -5.974
  203   HG22  THR  36          HG22      THR  36   1.041   6.324  -4.356
  204   HG23  THR  36          HG23      THR  36  -0.167   6.743  -5.573
  205    H    THR  37           HN       THR  37   2.771   5.251  -3.424
  206    HA   THR  37           HA       THR  37   2.076   2.856  -1.880
  207    HB   THR  37           HB       THR  37   4.099   3.336  -0.427
  208    HG1  THR  37           HG1      THR  37   5.778   4.485  -1.425
  209   HG21  THR  37          HG21      THR  37   3.978   1.419  -1.927
  210   HG22  THR  37          HG22      THR  37   5.609   2.091  -1.905
  211   HG23  THR  37          HG23      THR  37   4.538   2.417  -3.269
  212    H    THR  38           HN       THR  38   0.949   3.198  -0.086
  213    HA   THR  38           HA       THR  38   1.022   5.766   1.270
  214    HB   THR  38           HB       THR  38  -0.694   6.083  -0.469
  215    HG1  THR  38           HG1      THR  38  -2.522   6.323   1.231
  216   HG21  THR  38          HG21      THR  38  -2.779   4.790  -0.397
  217   HG22  THR  38          HG22      THR  38  -2.096   3.761   0.863
  218   HG23  THR  38          HG23      THR  38  -1.392   3.759  -0.755
  219    H    TRP  39           HN       TRP  39   0.152   5.639   3.444
  220    HA   TRP  39           HA       TRP  39   0.193   2.909   4.483
  221    HB2  TRP  39           HB2      TRP  39  -0.091   5.497   6.015
  222    HB3  TRP  39           HB1      TRP  39   0.244   3.910   6.690
  223    HD1  TRP  39           HD1      TRP  39   1.879   6.885   5.094
  224    HE1  TRP  39           HE1      TRP  39   4.451   6.577   5.183
  225    HE3  TRP  39           HE3      TRP  39   2.050   2.007   6.577
  226    HZ2  TRP  39           HZ2      TRP  39   6.294   4.511   5.812
  227    HZ3  TRP  39           HZ3      TRP  39   4.235   0.936   6.914
  228    HH2  TRP  39           HH2      TRP  39   6.308   2.154   6.543
  229    H    GLU  40           HN       GLU  40  -2.089   5.055   3.359
  230    HA   GLU  40           HA       GLU  40  -4.019   4.310   5.408
  231    HB2  GLU  40           HB2      GLU  40  -5.323   6.271   4.641
  232    HB3  GLU  40           HB1      GLU  40  -3.721   6.655   5.256
  233    HG2  GLU  40           HG2      GLU  40  -4.189   8.029   3.386
  234    HG3  GLU  40           HG1      GLU  40  -2.912   6.901   2.957
  235    H    ASP  41           HN       ASP  41  -6.254   4.016   4.736
  236    HA   ASP  41           HA       ASP  41  -6.208   1.858   2.808
  237    HB2  ASP  41           HB2      ASP  41  -8.375   2.790   4.702
  238    HB3  ASP  41           HB1      ASP  41  -8.484   1.375   3.669
  239    HA   PRO  42           HA       PRO  42  -8.054   4.328  -0.455
  240    HB2  PRO  42           HB2      PRO  42  -8.786   2.175  -2.009
  241    HB3  PRO  42           HB1      PRO  42  -7.175   2.899  -2.004
  242    HG2  PRO  42           HG2      PRO  42  -8.164   0.462  -0.578
  243    HG3  PRO  42           HG1      PRO  42  -6.620   0.724  -1.413
  244    HD2  PRO  42           HD2      PRO  42  -6.816   0.829   1.266
  245    HD3  PRO  42           HD1      PRO  42  -5.713   1.896   0.373
  246    H    ARG  43           HN       ARG  43  -9.586   2.096   1.608
  247    HA   ARG  43           HA       ARG  43 -12.229   2.380   0.509
  248    HB2  ARG  43           HB2      ARG  43 -12.928   1.345   2.714
  249    HB3  ARG  43           HB1      ARG  43 -11.853   0.372   1.719
  250    HG2  ARG  43           HG2      ARG  43  -9.956   1.046   3.095
  251    HG3  ARG  43           HG1      ARG  43 -11.026   2.042   4.084
  252    HD2  ARG  43           HD2      ARG  43 -12.174   0.149   4.912
  253    HD3  ARG  43           HD1      ARG  43 -11.440  -0.911   3.710
  254    HE   ARG  43           HE       ARG  43  -9.271  -0.108   5.014
  255   HH11  ARG  43          HH11      ARG  43 -12.383  -1.105   6.313
  256   HH12  ARG  43          HH12      ARG  43 -11.682  -1.788   7.754
  257   HH21  ARG  43          HH21      ARG  43  -8.382  -1.012   6.904
  258   HH22  ARG  43          HH22      ARG  43  -9.433  -1.740   8.086
  259    H    LEU  44           HN       LEU  44 -10.187   4.220   2.541
  260    HA   LEU  44           HA       LEU  44 -12.298   5.664   3.846
  261    HB2  LEU  44           HB2      LEU  44  -9.356   6.278   3.687
  262    HB3  LEU  44           HB1      LEU  44 -10.505   7.085   4.736
  263    HG   LEU  44           HG       LEU  44  -9.774   4.159   4.897
  264   HD11  LEU  44          HD11      LEU  44  -8.957   6.479   6.635
  265   HD12  LEU  44          HD12      LEU  44  -7.910   5.580   5.538
  266   HD13  LEU  44          HD13      LEU  44  -8.602   4.780   6.949
  267   HD21  LEU  44          HD21      LEU  44 -11.445   5.893   6.710
  268   HD22  LEU  44          HD22      LEU  44 -10.986   4.220   7.021
  269   HD23  LEU  44          HD23      LEU  44 -12.041   4.607   5.661
  270    H    LYS  45           HN       LYS  45 -11.060   5.662   0.853
  271    HA   LYS  45           HA       LYS  45 -11.852   8.438   0.358
  272    HB2  LYS  45           HB2      LYS  45 -10.034   8.457  -1.431
  273    HB3  LYS  45           HB1      LYS  45  -9.506   8.569   0.238
  274    HG2  LYS  45           HG2      LYS  45  -9.051   6.109   0.154
  275    HG3  LYS  45           HG1      LYS  45  -9.385   6.177  -1.578
  276    HD2  LYS  45           HD2      LYS  45  -7.606   7.895  -1.801
  277    HD3  LYS  45           HD1      LYS  45  -7.228   7.675  -0.091
  278    HE2  LYS  45           HE2      LYS  45  -6.822   5.258  -0.581
  279    HE3  LYS  45           HE1      LYS  45  -7.004   5.632  -2.293
  280    HZ1  LYS  45           HZ1      LYS  45  -5.167   7.279  -1.969
  281    HZ2  LYS  45           HZ2      LYS  45  -4.718   5.661  -1.821
  282    HZ3  LYS  45           HZ3      LYS  45  -4.914   6.605  -0.430
  283    H    GLN 112           H        GLN 112   8.049  10.886   5.379
  284    HA   GLN 112           HA       GLN 112   8.220   8.060   6.237
  285    HB2  GLN 112           HB2      GLN 112   5.930  10.032   6.353
  286    HB3  GLN 112           HB1      GLN 112   5.789   8.312   6.691
  287    HG2  GLN 112           HG2      GLN 112   7.386   8.571   8.548
  288    HG3  GLN 112           HG1      GLN 112   7.443  10.302   8.228
  289   HE21  GLN 112          HE21      GLN 112   4.620  10.507   7.605
  290   HE22  GLN 112          HE22      GLN 112   3.768  10.348   9.109
  291    H    ILE 113           HN       ILE 113   8.554   7.031   4.378
  292    HA   ILE 113           HA       ILE 113   6.610   7.461   2.213
  293    HB   ILE 113           HB       ILE 113   9.577   7.025   1.835
  294   HG12  ILE 113          HG12      ILE 113   7.859   9.408   1.103
  295   HG13  ILE 113          HG11      ILE 113   8.950   9.342   2.483
  296   HG21  ILE 113          HG21      ILE 113   8.282   5.836   0.155
  297   HG22  ILE 113          HG22      ILE 113   9.100   7.223  -0.565
  298   HG23  ILE 113          HG23      ILE 113   7.375   7.305  -0.210
  299   HD11  ILE 113          HD11      ILE 113   9.940  10.553   0.629
  300   HD12  ILE 113          HD12      ILE 113   9.749   9.142  -0.409
  301   HD13  ILE 113          HD13      ILE 113  10.845   9.078   0.971
  302    HA   PRO 114           HA       PRO 114   6.237   3.029   3.062
  303    HB2  PRO 114           HB2      PRO 114   4.358   3.164   0.802
  304    HB3  PRO 114           HB1      PRO 114   4.093   2.597   2.453
  305    HG2  PRO 114           HG2      PRO 114   3.065   4.914   1.563
  306    HG3  PRO 114           HG1      PRO 114   3.600   4.702   3.240
  307    HD2  PRO 114           HD2      PRO 114   4.952   6.115   0.984
  308    HD3  PRO 114           HD1      PRO 114   4.886   6.532   2.708
  309    HA   PRO 115           HA       PRO 115   9.026   1.634  -0.250
  310    HB2  PRO 115           HB2      PRO 115   8.398  -0.949   1.073
  311    HB3  PRO 115           HB1      PRO 115   9.962  -0.244   0.673
  312    HG2  PRO 115           HG2      PRO 115   9.099  -0.310   3.187
  313    HG3  PRO 115           HG1      PRO 115   9.995   1.090   2.567
  314    HD2  PRO 115           HD2      PRO 115   7.062   0.777   3.055
  315    HD3  PRO 115           HD1      PRO 115   8.117   2.184   3.317
  316    HA   PRO 116           HA       PRO 116   5.997   0.144  -3.268
  317    HB2  PRO 116           HB2      PRO 116   8.140  -0.868  -4.799
  318    HB3  PRO 116           HB1      PRO 116   7.318   0.685  -5.024
  319    HG2  PRO 116           HG2      PRO 116   9.764   0.039  -3.438
  320    HG3  PRO 116           HG1      PRO 116   9.449   1.426  -4.514
  321    HD2  PRO 116           HD2      PRO 116   9.160   1.829  -2.022
  322    HD3  PRO 116           HD1      PRO 116   7.823   2.284  -3.050
  323    H    TYR 117           HN       TYR 117   6.178  -1.439  -4.559
  324    HA   TYR 117           HA       TYR 117   5.776  -3.954  -3.174
  325    HB2  TYR 117           HB2      TYR 117   4.800  -4.802  -5.209
  326    HB3  TYR 117           HB1      TYR 117   4.214  -3.165  -4.956
  327    HD1  TYR 117           HD2      TYR 117   5.081  -1.306  -6.392
  328    HD2  TYR 117           HD1      TYR 117   6.072  -5.383  -7.124
  329    HE1  TYR 117           HE2      TYR 117   5.814  -0.724  -8.649
  330    HE2  TYR 117           HE1      TYR 117   6.813  -4.803  -9.387
  331    HH   TYR 117           HH       TYR 117   7.476  -1.701 -10.351
  332    H    VAL 118           HN       VAL 118   7.221  -5.551  -2.958
  333    HA   VAL 118           HA       VAL 118   9.633  -5.549  -4.575
  334    HB   VAL 118           HB       VAL 118  10.343  -7.449  -3.160
  335   HG11  VAL 118          HG11      VAL 118  10.576  -6.187  -1.069
  336   HG12  VAL 118          HG12      VAL 118   9.355  -5.046  -1.629
  337   HG13  VAL 118          HG13      VAL 118  10.889  -5.184  -2.483
  338   HG21  VAL 118          HG21      VAL 118   9.005  -8.073  -1.199
  339   HG22  VAL 118          HG22      VAL 118   8.164  -8.434  -2.705
  340   HG23  VAL 118          HG23      VAL 118   7.704  -7.020  -1.756
  341    H    GLU 119           HN       GLU 119   6.599  -6.555  -5.000
  342    HA   GLU 119           HA       GLU 119   7.279  -8.429  -7.059
  343    HB2  GLU 119           HB2      GLU 119   5.713 -10.188  -6.140
  344    HB3  GLU 119           HB1      GLU 119   7.239 -10.013  -5.289
  345    HG2  GLU 119           HG2      GLU 119   6.055  -8.601  -3.610
  346    HG3  GLU 119           HG1      GLU 119   4.540  -9.009  -4.411
  347    HA   PRO 120           HA       PRO 120   3.824  -6.210  -8.683
  348    HB2  PRO 120           HB2      PRO 120   3.482  -7.639 -10.967
  349    HB3  PRO 120           HB1      PRO 120   4.799  -6.483 -10.736
  350    HG2  PRO 120           HG2      PRO 120   4.834  -9.462 -10.513
  351    HG3  PRO 120           HG1      PRO 120   6.040  -8.377 -11.226
  352    HD2  PRO 120           HD2      PRO 120   6.298  -9.466  -8.748
  353    HD3  PRO 120           HD1      PRO 120   6.991  -7.896  -9.194
  Start of MODEL    8
    1    H    PHE  12           H        PHE  12 -11.729  -7.343   0.032
    2    HA   PHE  12           HA       PHE  12 -12.716  -6.663  -1.957
    3    HB2  PHE  12           HB2      PHE  12 -14.284  -4.700  -2.004
    4    HB3  PHE  12           HB1      PHE  12 -14.942  -6.146  -1.255
    5    HD1  PHE  12           HD2      PHE  12 -15.026  -6.254   1.277
    6    HD2  PHE  12           HD1      PHE  12 -14.229  -2.659  -0.860
    7    HE1  PHE  12           HE2      PHE  12 -15.641  -4.940   3.263
    8    HE2  PHE  12           HE1      PHE  12 -14.849  -1.340   1.122
    9    HZ   PHE  12           HZ       PHE  12 -15.555  -2.480   3.188
   10    H    LEU  13           HN       LEU  13 -10.625  -6.150  -2.408
   11    HA   LEU  13           HA       LEU  13  -9.899  -3.334  -1.908
   12    HB2  LEU  13           HB2      LEU  13  -8.149  -5.774  -2.101
   13    HB3  LEU  13           HB1      LEU  13  -7.512  -4.164  -2.360
   14    HG   LEU  13           HG       LEU  13  -8.465  -3.644  -0.012
   15   HD11  LEU  13          HD11      LEU  13  -8.549  -5.565   1.486
   16   HD12  LEU  13          HD12      LEU  13  -8.325  -6.648   0.113
   17   HD13  LEU  13          HD13      LEU  13  -9.788  -5.669   0.235
   18   HD21  LEU  13          HD21      LEU  13  -6.098  -3.723  -0.550
   19   HD22  LEU  13          HD22      LEU  13  -6.103  -5.477  -0.378
   20   HD23  LEU  13          HD23      LEU  13  -6.404  -4.454   1.026
   21    HA   PRO  14           HA       PRO  14  -9.857  -2.640  -6.357
   22    HB2  PRO  14           HB2      PRO  14  -7.584  -1.018  -5.308
   23    HB3  PRO  14           HB1      PRO  14  -8.695  -0.641  -6.631
   24    HG2  PRO  14           HG2      PRO  14  -9.173   0.372  -4.411
   25    HG3  PRO  14           HG1      PRO  14 -10.512  -0.500  -5.124
   26    HD2  PRO  14           HD2      PRO  14  -8.624  -1.394  -2.941
   27    HD3  PRO  14           HD1      PRO  14 -10.400  -1.556  -3.002
   28    H    LYS  15           HN       LYS  15  -8.637  -2.922  -7.986
   29    HA   LYS  15           HA       LYS  15  -7.196  -5.376  -7.884
   30    HB2  LYS  15           HB2      LYS  15  -7.596  -3.417 -10.143
   31    HB3  LYS  15           HB1      LYS  15  -6.739  -4.939 -10.334
   32    HG2  LYS  15           HG2      LYS  15  -8.831  -5.506 -11.052
   33    HG3  LYS  15           HG1      LYS  15  -8.920  -5.973  -9.355
   34    HD2  LYS  15           HD2      LYS  15 -10.935  -4.807  -9.924
   35    HD3  LYS  15           HD1      LYS  15  -9.973  -3.764  -8.876
   36    HE2  LYS  15           HE2      LYS  15 -10.952  -2.529 -10.760
   37    HE3  LYS  15           HE1      LYS  15  -9.189  -2.508 -10.796
   38    HZ1  LYS  15           HZ1      LYS  15 -10.301  -2.926 -12.978
   39    HZ2  LYS  15           HZ2      LYS  15 -10.817  -4.427 -12.370
   40    HZ3  LYS  15           HZ3      LYS  15  -9.161  -4.099 -12.526
   41    H    GLY  16           HN       GLY  16  -5.159  -5.687  -7.361
   42    HA2  GLY  16           HA2      GLY  16  -2.848  -5.447  -7.533
   43    HA3  GLY  16           HA1      GLY  16  -3.081  -3.911  -8.352
   44    H    TRP  17           HN       TRP  17  -4.979  -3.918  -5.621
   45    HA   TRP  17           HA       TRP  17  -3.002  -2.359  -4.152
   46    HB2  TRP  17           HB2      TRP  17  -5.970  -2.705  -3.928
   47    HB3  TRP  17           HB1      TRP  17  -5.047  -2.032  -2.587
   48    HD1  TRP  17           HD1      TRP  17  -5.738  -1.288  -6.336
   49    HE1  TRP  17           HE1      TRP  17  -5.611   1.253  -6.648
   50    HE3  TRP  17           HE3      TRP  17  -4.203   0.046  -1.638
   51    HZ2  TRP  17           HZ2      TRP  17  -4.903   3.533  -5.133
   52    HZ3  TRP  17           HZ3      TRP  17  -3.807   2.428  -1.161
   53    HH2  TRP  17           HH2      TRP  17  -4.150   4.132  -2.873
   54    H    GLU  18           HN       GLU  18  -1.918  -3.104  -2.493
   55    HA   GLU  18           HA       GLU  18  -2.749  -5.681  -1.343
   56    HB2  GLU  18           HB2      GLU  18  -0.143  -4.807  -2.468
   57    HB3  GLU  18           HB1      GLU  18  -0.134  -5.915  -1.110
   58    HG2  GLU  18           HG2      GLU  18  -1.420  -6.329  -3.788
   59    HG3  GLU  18           HG1      GLU  18  -0.021  -7.155  -3.117
   60    H    VAL  19           HN       VAL  19  -2.205  -6.089   0.759
   61    HA   VAL  19           HA       VAL  19  -1.369  -3.744   2.348
   62    HB   VAL  19           HB       VAL  19  -3.105  -5.971   3.404
   63   HG11  VAL  19          HG11      VAL  19  -1.897  -4.684   5.076
   64   HG12  VAL  19          HG12      VAL  19  -3.628  -4.355   5.167
   65   HG13  VAL  19          HG13      VAL  19  -2.548  -3.185   4.410
   66   HG21  VAL  19          HG21      VAL  19  -4.310  -4.913   1.580
   67   HG22  VAL  19          HG22      VAL  19  -4.015  -3.326   2.291
   68   HG23  VAL  19          HG23      VAL  19  -5.032  -4.496   3.134
   69    H    ARG  20           HN       ARG  20   0.704  -4.106   2.879
   70    HA   ARG  20           HA       ARG  20   1.353  -6.750   3.996
   71    HB2  ARG  20           HB2      ARG  20   2.557  -6.067   1.833
   72    HB3  ARG  20           HB1      ARG  20   3.375  -4.852   2.814
   73    HG2  ARG  20           HG2      ARG  20   4.005  -6.834   4.344
   74    HG3  ARG  20           HG1      ARG  20   3.584  -7.832   2.953
   75    HD2  ARG  20           HD2      ARG  20   5.590  -5.592   2.947
   76    HD3  ARG  20           HD1      ARG  20   5.991  -7.299   3.080
   77    HE   ARG  20           HE       ARG  20   4.638  -7.287   0.788
   78   HH11  ARG  20          HH11      ARG  20   7.095  -5.099   1.953
   79   HH12  ARG  20          HH12      ARG  20   7.763  -4.784   0.385
   80   HH21  ARG  20          HH21      ARG  20   5.506  -6.896  -1.307
   81   HH22  ARG  20          HH22      ARG  20   6.840  -5.789  -1.468
   82    H    HIS  21           HN       HIS  21   2.329  -6.821   5.981
   83    HA   HIS  21           HA       HIS  21   2.414  -4.297   7.486
   84    HB2  HIS  21           HB2      HIS  21   1.733  -6.973   8.127
   85    HB3  HIS  21           HB1      HIS  21   3.221  -6.628   8.990
   86    HD1  HIS  21           HD1      HIS  21   1.373  -7.200  10.913
   87    HD2  HIS  21           HD2      HIS  21   1.135  -3.373   9.166
   88    HE1  HIS  21           HE1      HIS  21   0.084  -5.778  12.529
   89    HE2  HIS  21           HE2      HIS  21   0.071  -3.473  11.526
   90    H    ALA  22           HN       ALA  22   4.305  -3.240   7.335
   91    HA   ALA  22           HA       ALA  22   6.767  -4.412   6.575
   92    HB1  ALA  22           HB1      ALA  22   7.736  -2.238   7.153
   93    HB2  ALA  22           HB2      ALA  22   6.236  -1.781   7.964
   94    HB3  ALA  22           HB3      ALA  22   6.251  -2.044   6.219
   95    HA   PRO  23           HA       PRO  23   8.513  -6.131  10.204
   96    HB2  PRO  23           HB2      PRO  23  10.926  -4.777  10.477
   97    HB3  PRO  23           HB1      PRO  23  10.647  -6.194   9.461
   98    HG2  PRO  23           HG2      PRO  23  10.711  -3.307   8.715
   99    HG3  PRO  23           HG1      PRO  23  11.304  -4.716   7.816
  100    HD2  PRO  23           HD2      PRO  23   9.007  -3.497   7.157
  101    HD3  PRO  23           HD1      PRO  23   9.191  -5.260   7.032
  102    H    ASN  24           HN       ASN  24   8.094  -2.700  10.128
  103    HA   ASN  24           HA       ASN  24   8.712  -2.310  12.920
  104    HB2  ASN  24           HB2      ASN  24   8.103  -0.004  12.588
  105    HB3  ASN  24           HB1      ASN  24   9.090  -0.509  11.223
  106   HD21  ASN  24          HD21      ASN  24   7.220   1.689  11.435
  107   HD22  ASN  24          HD22      ASN  24   6.037   1.450  10.194
  108    H    GLY  25           HN       GLY  25   6.183  -3.493  11.105
  109    HA2  GLY  25           HA2      GLY  25   4.314  -4.537  12.062
  110    HA3  GLY  25           HA1      GLY  25   4.480  -3.486  13.449
  111    H    ARG  26           HN       ARG  26   4.581  -2.160  10.250
  112    HA   ARG  26           HA       ARG  26   1.846  -1.121  10.625
  113    HB2  ARG  26           HB2      ARG  26   4.295   0.189   9.435
  114    HB3  ARG  26           HB1      ARG  26   2.669   0.776   9.110
  115    HG2  ARG  26           HG2      ARG  26   3.749   0.460  11.896
  116    HG3  ARG  26           HG1      ARG  26   3.914   1.945  10.957
  117    HD2  ARG  26           HD2      ARG  26   1.308   0.598  11.659
  118    HD3  ARG  26           HD1      ARG  26   1.980   2.011  12.473
  119    HE   ARG  26           HE       ARG  26   1.885   2.883   9.963
  120   HH11  ARG  26          HH11      ARG  26  -0.527   1.198  11.874
  121   HH12  ARG  26          HH12      ARG  26  -1.872   1.893  11.016
  122   HH21  ARG  26          HH21      ARG  26   0.127   3.807   8.853
  123   HH22  ARG  26          HH22      ARG  26  -1.495   3.373   9.291
  124    HA   PRO  27           HA       PRO  27   1.115  -2.982   6.603
  125    HB2  PRO  27           HB2      PRO  27  -1.490  -2.412   6.407
  126    HB3  PRO  27           HB1      PRO  27  -0.930  -3.593   7.594
  127    HG2  PRO  27           HG2      PRO  27  -1.598  -0.690   7.995
  128    HG3  PRO  27           HG1      PRO  27  -2.101  -2.089   8.967
  129    HD2  PRO  27           HD2      PRO  27   0.016  -0.559   9.657
  130    HD3  PRO  27           HD1      PRO  27  -0.082  -2.229  10.040
  131    H    PHE  28           HN       PHE  28   1.951  -1.921   4.988
  132    HA   PHE  28           HA       PHE  28   0.940   0.727   4.270
  133    HB2  PHE  28           HB2      PHE  28   2.980   0.884   2.837
  134    HB3  PHE  28           HB1      PHE  28   3.332   0.734   4.548
  135    HD1  PHE  28           HD2      PHE  28   3.495  -1.968   5.215
  136    HD2  PHE  28           HD1      PHE  28   4.487  -0.186   1.476
  137    HE1  PHE  28           HE2      PHE  28   5.033  -3.817   4.744
  138    HE2  PHE  28           HE1      PHE  28   6.014  -2.049   1.003
  139    HZ   PHE  28           HZ       PHE  28   6.294  -3.861   2.636
  140    H    PHE  29           HN       PHE  29  -0.319   0.933   2.575
  141    HA   PHE  29           HA       PHE  29  -1.039  -1.498   1.159
  142    HB2  PHE  29           HB2      PHE  29  -2.351   1.234   1.099
  143    HB3  PHE  29           HB1      PHE  29  -2.985  -0.248   0.381
  144    HD1  PHE  29           HD2      PHE  29  -1.839   1.028   3.709
  145    HD2  PHE  29           HD1      PHE  29  -4.563  -1.416   1.541
  146    HE1  PHE  29           HE2      PHE  29  -3.007   0.481   5.802
  147    HE2  PHE  29           HE1      PHE  29  -5.740  -1.962   3.632
  148    HZ   PHE  29           HZ       PHE  29  -4.957  -1.022   5.763
  149    H    ILE  30           HN       ILE  30  -0.087  -1.945  -0.643
  150    HA   ILE  30           HA       ILE  30   1.274   0.171  -2.117
  151    HB   ILE  30           HB       ILE  30   1.427  -2.791  -2.668
  152   HG12  ILE  30          HG12      ILE  30   3.328  -1.157  -1.021
  153   HG13  ILE  30          HG11      ILE  30   2.094  -2.186  -0.309
  154   HG21  ILE  30          HG21      ILE  30   3.249  -0.475  -3.338
  155   HG22  ILE  30          HG22      ILE  30   2.184  -1.320  -4.462
  156   HG23  ILE  30          HG23      ILE  30   3.550  -2.167  -3.736
  157   HD11  ILE  30          HD11      ILE  30   3.127  -4.132  -1.378
  158   HD12  ILE  30          HD12      ILE  30   4.251  -3.292  -0.308
  159   HD13  ILE  30          HD13      ILE  30   4.375  -3.086  -2.056
  160    H    ASP  31           HN       ASP  31   0.554   0.931  -3.916
  161    HA   ASP  31           HA       ASP  31  -1.518  -0.484  -5.415
  162    HB2  ASP  31           HB2      ASP  31  -2.080   1.774  -5.423
  163    HB3  ASP  31           HB1      ASP  31  -0.400   2.295  -5.531
  164    H    HIS  32           HN       HIS  32  -0.800  -2.032  -6.618
  165    HA   HIS  32           HA       HIS  32   1.957  -2.106  -7.469
  166    HB2  HIS  32           HB2      HIS  32  -0.315  -4.092  -7.679
  167    HB3  HIS  32           HB1      HIS  32   1.304  -4.415  -8.277
  168    HD1  HIS  32           HD1      HIS  32   2.120  -6.174  -6.632
  169    HD2  HIS  32           HD2      HIS  32   0.458  -2.876  -4.731
  170    HE1  HIS  32           HE1      HIS  32   2.565  -6.465  -4.150
  171    HE2  HIS  32           HE2      HIS  32   1.362  -4.581  -3.053
  172    H    ASN  33           HN       ASN  33  -0.711  -0.691  -8.728
  173    HA   ASN  33           HA       ASN  33  -0.242  -1.451 -11.501
  174    HB2  ASN  33           HB2      ASN  33  -2.162   0.652 -10.501
  175    HB3  ASN  33           HB1      ASN  33  -2.175  -0.161 -12.062
  176   HD21  ASN  33          HD21      ASN  33  -3.030  -0.319  -8.740
  177   HD22  ASN  33          HD22      ASN  33  -3.968  -1.783  -8.836
  178    H    THR  34           HN       THR  34  -0.124   1.492  -9.497
  179    HA   THR  34           HA       THR  34   1.318   2.843 -11.682
  180    HB   THR  34           HB       THR  34   0.295   4.334  -9.304
  181    HG1  THR  34           HG1      THR  34  -1.459   2.992  -9.884
  182   HG21  THR  34          HG21      THR  34   1.522   5.511 -11.068
  183   HG22  THR  34          HG22      THR  34  -0.157   6.048 -11.002
  184   HG23  THR  34          HG23      THR  34   0.364   4.933 -12.265
  185    H    LYS  35           HN       LYS  35   2.044   1.102  -9.073
  186    HA   LYS  35           HA       LYS  35   3.910   0.808  -7.815
  187    HB2  LYS  35           HB2      LYS  35   4.926   2.842  -9.776
  188    HB3  LYS  35           HB1      LYS  35   5.922   2.363  -8.411
  189    HG2  LYS  35           HG2      LYS  35   6.595   1.037 -10.242
  190    HG3  LYS  35           HG1      LYS  35   5.662  -0.013  -9.181
  191    HD2  LYS  35           HD2      LYS  35   4.995  -0.481 -11.419
  192    HD3  LYS  35           HD1      LYS  35   3.680   0.411 -10.654
  193    HE2  LYS  35           HE2      LYS  35   4.103   1.205 -12.928
  194    HE3  LYS  35           HE1      LYS  35   4.416   2.461 -11.732
  195    HZ1  LYS  35           HZ1      LYS  35   6.726   2.200 -11.978
  196    HZ2  LYS  35           HZ2      LYS  35   6.110   2.222 -13.557
  197    HZ3  LYS  35           HZ3      LYS  35   6.569   0.751 -12.845
  198    H    THR  36           HN       THR  36   1.797   2.725  -7.069
  199    HA   THR  36           HA       THR  36   3.331   4.749  -5.583
  200    HB   THR  36           HB       THR  36   1.165   5.888  -5.195
  201    HG1  THR  36           HG1      THR  36   0.130   3.847  -6.922
  202   HG21  THR  36          HG21      THR  36   2.553   6.537  -7.091
  203   HG22  THR  36          HG22      THR  36   0.842   6.684  -7.492
  204   HG23  THR  36          HG23      THR  36   1.774   5.313  -8.094
  205    H    THR  37           HN       THR  37   2.918   5.066  -3.307
  206    HA   THR  37           HA       THR  37   1.702   2.728  -2.009
  207    HB   THR  37           HB       THR  37   3.675   3.022  -0.319
  208    HG1  THR  37           HG1      THR  37   5.549   3.797  -1.266
  209   HG21  THR  37          HG21      THR  37   4.968   1.350  -1.567
  210   HG22  THR  37          HG22      THR  37   4.040   1.719  -3.021
  211   HG23  THR  37          HG23      THR  37   3.241   0.999  -1.624
  212    H    THR  38           HN       THR  38   0.754   3.062  -0.022
  213    HA   THR  38           HA       THR  38   0.834   5.697   1.190
  214    HB   THR  38           HB       THR  38  -0.964   5.487  -0.738
  215    HG1  THR  38           HG1      THR  38  -2.183   6.622   1.454
  216   HG21  THR  38          HG21      THR  38  -3.175   4.859   0.121
  217   HG22  THR  38          HG22      THR  38  -2.433   4.321   1.629
  218   HG23  THR  38          HG23      THR  38  -2.067   3.486   0.119
  219    H    TRP  39           HN       TRP  39  -0.166   5.690   3.381
  220    HA   TRP  39           HA       TRP  39   0.337   3.067   4.581
  221    HB2  TRP  39           HB2      TRP  39  -0.115   5.761   5.866
  222    HB3  TRP  39           HB1      TRP  39   0.257   4.282   6.736
  223    HD1  TRP  39           HD1      TRP  39   1.825   7.133   4.926
  224    HE1  TRP  39           HE1      TRP  39   4.403   6.872   4.998
  225    HE3  TRP  39           HE3      TRP  39   2.097   2.350   6.679
  226    HZ2  TRP  39           HZ2      TRP  39   6.291   4.870   5.727
  227    HZ3  TRP  39           HZ3      TRP  39   4.302   1.333   7.049
  228    HH2  TRP  39           HH2      TRP  39   6.352   2.562   6.588
  229    H    GLU  40           HN       GLU  40  -2.302   4.997   3.719
  230    HA   GLU  40           HA       GLU  40  -3.914   3.822   5.853
  231    HB2  GLU  40           HB2      GLU  40  -5.183   5.899   5.970
  232    HB3  GLU  40           HB1      GLU  40  -3.492   6.138   6.325
  233    HG2  GLU  40           HG2      GLU  40  -5.132   7.180   4.080
  234    HG3  GLU  40           HG1      GLU  40  -3.941   7.982   5.100
  235    H    ASP  41           HN       ASP  41  -5.793   2.970   5.459
  236    HA   ASP  41           HA       ASP  41  -6.187   1.476   3.273
  237    HB2  ASP  41           HB2      ASP  41  -8.446   2.659   4.897
  238    HB3  ASP  41           HB1      ASP  41  -8.514   1.193   3.931
  239    HA   PRO  42           HA       PRO  42  -7.684   4.043  -0.088
  240    HB2  PRO  42           HB2      PRO  42  -8.622   1.965  -1.602
  241    HB3  PRO  42           HB1      PRO  42  -6.924   2.450  -1.559
  242    HG2  PRO  42           HG2      PRO  42  -8.300   0.233  -0.092
  243    HG3  PRO  42           HG1      PRO  42  -6.719   0.231  -0.898
  244    HD2  PRO  42           HD2      PRO  42  -6.957   0.469   1.775
  245    HD3  PRO  42           HD1      PRO  42  -5.678   1.304   0.867
  246    H    ARG  43           HN       ARG  43  -9.358   2.018   2.038
  247    HA   ARG  43           HA       ARG  43 -12.010   2.329   1.039
  248    HB2  ARG  43           HB2      ARG  43 -11.132   1.749   3.876
  249    HB3  ARG  43           HB1      ARG  43 -12.706   1.407   3.166
  250    HG2  ARG  43           HG2      ARG  43 -11.690  -0.205   1.666
  251    HG3  ARG  43           HG1      ARG  43 -10.103   0.147   2.341
  252    HD2  ARG  43           HD2      ARG  43 -10.795  -0.671   4.508
  253    HD3  ARG  43           HD1      ARG  43 -12.437  -0.930   3.920
  254    HE   ARG  43           HE       ARG  43 -11.701  -2.801   2.723
  255   HH11  ARG  43          HH11      ARG  43  -9.048  -1.271   4.450
  256   HH12  ARG  43          HH12      ARG  43  -8.022  -2.663   4.341
  257   HH21  ARG  43          HH21      ARG  43 -10.345  -4.633   2.620
  258   HH22  ARG  43          HH22      ARG  43  -8.742  -4.563   3.303
  259    H    LEU  44           HN       LEU  44  -9.823   4.305   2.701
  260    HA   LEU  44           HA       LEU  44 -11.768   6.006   3.947
  261    HB2  LEU  44           HB2      LEU  44  -8.830   6.466   3.471
  262    HB3  LEU  44           HB1      LEU  44  -9.860   7.478   4.464
  263    HG   LEU  44           HG       LEU  44  -9.170   4.592   5.028
  264   HD11  LEU  44          HD11      LEU  44  -7.274   6.083   5.345
  265   HD12  LEU  44          HD12      LEU  44  -7.886   5.510   6.897
  266   HD13  LEU  44          HD13      LEU  44  -8.261   7.145   6.350
  267   HD21  LEU  44          HD21      LEU  44 -10.736   6.592   6.658
  268   HD22  LEU  44          HD22      LEU  44 -10.280   4.968   7.172
  269   HD23  LEU  44          HD23      LEU  44 -11.401   5.185   5.828
  270    H    LYS  45           HN       LYS  45 -10.744   5.564   0.907
  271    HA   LYS  45           HA       LYS  45 -11.371   8.315   0.093
  272    HB2  LYS  45           HB2      LYS  45  -9.516   6.270  -1.080
  273    HB3  LYS  45           HB1      LYS  45 -10.254   7.465  -2.135
  274    HG2  LYS  45           HG2      LYS  45  -8.161   8.344  -1.557
  275    HG3  LYS  45           HG1      LYS  45  -9.325   9.227  -0.573
  276    HD2  LYS  45           HD2      LYS  45  -7.531   8.714   0.869
  277    HD3  LYS  45           HD1      LYS  45  -8.803   7.563   1.274
  278    HE2  LYS  45           HE2      LYS  45  -7.707   5.820   0.046
  279    HE3  LYS  45           HE1      LYS  45  -6.524   6.955  -0.604
  280    HZ1  LYS  45           HZ1      LYS  45  -6.807   6.141   2.239
  281    HZ2  LYS  45           HZ2      LYS  45  -5.738   7.330   1.684
  282    HZ3  LYS  45           HZ3      LYS  45  -5.543   5.723   1.197
  283    H    GLN 112           H        GLN 112   7.734  10.729   5.196
  284    HA   GLN 112           HA       GLN 112   8.252   7.914   5.931
  285    HB2  GLN 112           HB2      GLN 112   5.808   7.887   6.410
  286    HB3  GLN 112           HB1      GLN 112   6.725   8.946   7.471
  287    HG2  GLN 112           HG2      GLN 112   6.020  10.870   6.091
  288    HG3  GLN 112           HG1      GLN 112   5.028   9.776   5.129
  289   HE21  GLN 112          HE21      GLN 112   5.396  11.383   8.174
  290   HE22  GLN 112          HE22      GLN 112   3.810  11.046   8.777
  291    H    ILE 113           HN       ILE 113   8.467   6.731   4.191
  292    HA   ILE 113           HA       ILE 113   6.538   7.094   2.007
  293    HB   ILE 113           HB       ILE 113   8.364   6.439   0.385
  294   HG12  ILE 113          HG12      ILE 113  10.185   7.365   2.618
  295   HG13  ILE 113          HG11      ILE 113   9.980   5.684   2.136
  296   HG21  ILE 113          HG21      ILE 113   8.583   9.113   1.760
  297   HG22  ILE 113          HG22      ILE 113   7.460   8.686   0.469
  298   HG23  ILE 113          HG23      ILE 113   9.194   8.735   0.149
  299   HD11  ILE 113          HD11      ILE 113  10.844   6.223  -0.083
  300   HD12  ILE 113          HD12      ILE 113  11.997   6.630   1.189
  301   HD13  ILE 113          HD13      ILE 113  11.054   7.902   0.412
  302    HA   PRO 114           HA       PRO 114   6.097   2.723   3.048
  303    HB2  PRO 114           HB2      PRO 114   4.152   2.808   0.838
  304    HB3  PRO 114           HB1      PRO 114   3.923   2.322   2.519
  305    HG2  PRO 114           HG2      PRO 114   2.925   4.623   1.550
  306    HG3  PRO 114           HG1      PRO 114   3.491   4.466   3.222
  307    HD2  PRO 114           HD2      PRO 114   4.822   5.753   0.880
  308    HD3  PRO 114           HD1      PRO 114   4.801   6.244   2.588
  309    HA   PRO 115           HA       PRO 115   8.863   1.200  -0.214
  310    HB2  PRO 115           HB2      PRO 115   8.019  -1.340   1.095
  311    HB3  PRO 115           HB1      PRO 115   9.634  -0.770   0.689
  312    HG2  PRO 115           HG2      PRO 115   8.795  -0.729   3.201
  313    HG3  PRO 115           HG1      PRO 115   9.765   0.606   2.554
  314    HD2  PRO 115           HD2      PRO 115   6.830   0.476   3.082
  315    HD3  PRO 115           HD1      PRO 115   7.961   1.830   3.292
  316    HA   PRO 116           HA       PRO 116   5.782   0.001  -3.306
  317    HB2  PRO 116           HB2      PRO 116   7.871  -1.066  -4.875
  318    HB3  PRO 116           HB1      PRO 116   7.135   0.536  -5.039
  319    HG2  PRO 116           HG2      PRO 116   9.544  -0.295  -3.487
  320    HG3  PRO 116           HG1      PRO 116   9.297   1.150  -4.503
  321    HD2  PRO 116           HD2      PRO 116   9.031   1.459  -1.991
  322    HD3  PRO 116           HD1      PRO 116   7.725   2.028  -3.001
  323    H    TYR 117           HN       TYR 117   5.882  -1.546  -4.646
  324    HA   TYR 117           HA       TYR 117   5.359  -4.082  -3.330
  325    HB2  TYR 117           HB2      TYR 117   4.154  -4.728  -5.229
  326    HB3  TYR 117           HB1      TYR 117   3.918  -2.987  -5.173
  327    HD1  TYR 117           HD1      TYR 117   5.078  -1.532  -6.808
  328    HD2  TYR 117           HD2      TYR 117   5.325  -5.772  -7.016
  329    HE1  TYR 117           HE1      TYR 117   5.889  -1.370  -9.120
  330    HE2  TYR 117           HE2      TYR 117   6.138  -5.628  -9.320
  331    HH   TYR 117           HH       TYR 117   7.224  -2.719 -10.691
  332    H    VAL 118           HN       VAL 118   6.382  -6.007  -3.620
  333    HA   VAL 118           HA       VAL 118   8.850  -5.990  -5.251
  334    HB   VAL 118           HB       VAL 118   8.232  -7.859  -2.950
  335   HG11  VAL 118          HG11      VAL 118   9.853  -8.719  -4.544
  336   HG12  VAL 118          HG12      VAL 118  10.638  -8.328  -3.013
  337   HG13  VAL 118          HG13      VAL 118  10.806  -7.244  -4.395
  338   HG21  VAL 118          HG21      VAL 118   9.781  -6.521  -1.596
  339   HG22  VAL 118          HG22      VAL 118   8.362  -5.593  -2.082
  340   HG23  VAL 118          HG23      VAL 118   9.901  -5.347  -2.907
  341    H    GLU 119           HN       GLU 119   5.747  -7.061  -4.878
  342    HA   GLU 119           HA       GLU 119   6.123  -9.371  -6.650
  343    HB2  GLU 119           HB2      GLU 119   4.137 -10.357  -5.570
  344    HB3  GLU 119           HB1      GLU 119   5.441 -10.086  -4.433
  345    HG2  GLU 119           HG2      GLU 119   3.085  -8.236  -4.744
  346    HG3  GLU 119           HG1      GLU 119   3.150  -9.553  -3.580
  347    HA   PRO 120           HA       PRO 120   3.862  -6.795  -9.537
  348    HB2  PRO 120           HB2      PRO 120   3.336  -9.463 -10.752
  349    HB3  PRO 120           HB1      PRO 120   3.953  -7.985 -11.502
  350    HG2  PRO 120           HG2      PRO 120   5.592 -10.006 -10.963
  351    HG3  PRO 120           HG1      PRO 120   6.107  -8.329 -10.712
  352    HD2  PRO 120           HD2      PRO 120   5.258 -10.371  -8.704
  353    HD3  PRO 120           HD1      PRO 120   6.524  -9.131  -8.585
  Start of MODEL    9
    1    H    PHE  12           H        PHE  12 -12.372  -6.432  -1.459
    2    HA   PHE  12           HA       PHE  12 -14.167  -4.928  -1.930
    3    HB2  PHE  12           HB2      PHE  12 -14.856  -3.280  -0.206
    4    HB3  PHE  12           HB1      PHE  12 -15.285  -4.932   0.212
    5    HD1  PHE  12           HD2      PHE  12 -14.197  -6.065   2.062
    6    HD2  PHE  12           HD1      PHE  12 -13.214  -2.043   1.076
    7    HE1  PHE  12           HE2      PHE  12 -13.105  -5.798   4.249
    8    HE2  PHE  12           HE1      PHE  12 -12.126  -1.771   3.260
    9    HZ   PHE  12           HZ       PHE  12 -12.067  -3.647   4.853
   10    H    LEU  13           HN       LEU  13 -11.038  -5.130  -1.403
   11    HA   LEU  13           HA       LEU  13 -10.453  -2.271  -1.602
   12    HB2  LEU  13           HB2      LEU  13  -8.771  -4.693  -1.113
   13    HB3  LEU  13           HB1      LEU  13  -8.028  -3.241  -1.753
   14    HG   LEU  13           HG       LEU  13  -8.990  -2.009   0.242
   15   HD11  LEU  13          HD11      LEU  13 -10.664  -3.652   0.893
   16   HD12  LEU  13          HD12      LEU  13  -9.532  -3.335   2.208
   17   HD13  LEU  13          HD13      LEU  13  -9.390  -4.816   1.262
   18   HD21  LEU  13          HD21      LEU  13  -6.641  -2.573   0.057
   19   HD22  LEU  13          HD22      LEU  13  -6.954  -4.180   0.708
   20   HD23  LEU  13          HD23      LEU  13  -7.187  -2.758   1.723
   21    HA   PRO  14           HA       PRO  14 -10.106  -2.011  -6.005
   22    HB2  PRO  14           HB2      PRO  14  -7.753  -0.454  -5.038
   23    HB3  PRO  14           HB1      PRO  14  -8.827  -0.111  -6.401
   24    HG2  PRO  14           HG2      PRO  14  -9.302   1.081  -4.263
   25    HG3  PRO  14           HG1      PRO  14 -10.669   0.215  -4.934
   26    HD2  PRO  14           HD2      PRO  14  -8.854  -0.603  -2.661
   27    HD3  PRO  14           HD1      PRO  14 -10.628  -0.681  -2.746
   28    H    LYS  15           HN       LYS  15  -8.965  -2.469  -7.606
   29    HA   LYS  15           HA       LYS  15  -7.421  -4.887  -7.344
   30    HB2  LYS  15           HB2      LYS  15  -8.977  -4.618  -9.206
   31    HB3  LYS  15           HB1      LYS  15  -8.063  -3.237  -9.797
   32    HG2  LYS  15           HG2      LYS  15  -6.148  -4.672 -10.239
   33    HG3  LYS  15           HG1      LYS  15  -7.034  -6.059  -9.606
   34    HD2  LYS  15           HD2      LYS  15  -8.679  -5.842 -11.385
   35    HD3  LYS  15           HD1      LYS  15  -7.845  -4.412 -11.999
   36    HE2  LYS  15           HE2      LYS  15  -5.888  -5.721 -12.517
   37    HE3  LYS  15           HE1      LYS  15  -6.607  -7.151 -11.778
   38    HZ1  LYS  15           HZ1      LYS  15  -6.752  -7.163 -14.205
   39    HZ2  LYS  15           HZ2      LYS  15  -7.688  -5.750 -14.167
   40    HZ3  LYS  15           HZ3      LYS  15  -8.283  -7.183 -13.482
   41    H    GLY  16           HN       GLY  16  -5.292  -5.134  -7.243
   42    HA2  GLY  16           HA2      GLY  16  -3.039  -4.694  -7.632
   43    HA3  GLY  16           HA1      GLY  16  -3.478  -3.163  -8.380
   44    H    TRP  17           HN       TRP  17  -4.932  -3.830  -5.367
   45    HA   TRP  17           HA       TRP  17  -2.965  -2.122  -4.006
   46    HB2  TRP  17           HB2      TRP  17  -5.937  -2.441  -3.599
   47    HB3  TRP  17           HB1      TRP  17  -4.907  -1.723  -2.365
   48    HD1  TRP  17           HD1      TRP  17  -5.971  -1.099  -6.040
   49    HE1  TRP  17           HE1      TRP  17  -5.783   1.426  -6.501
   50    HE3  TRP  17           HE3      TRP  17  -3.936   0.391  -1.590
   51    HZ2  TRP  17           HZ2      TRP  17  -4.889   3.743  -5.157
   52    HZ3  TRP  17           HZ3      TRP  17  -3.440   2.780  -1.263
   53    HH2  TRP  17           HH2      TRP  17  -3.909   4.418  -3.010
   54    H    GLU  18           HN       GLU  18  -1.715  -3.128  -2.616
   55    HA   GLU  18           HA       GLU  18  -2.648  -5.679  -1.477
   56    HB2  GLU  18           HB2      GLU  18  -0.848  -5.597  -3.293
   57    HB3  GLU  18           HB1      GLU  18   0.260  -5.162  -2.063
   58    HG2  GLU  18           HG2      GLU  18  -1.394  -7.669  -2.129
   59    HG3  GLU  18           HG1      GLU  18   0.274  -7.517  -2.690
   60    H    VAL  19           HN       VAL  19  -2.459  -5.931   0.481
   61    HA   VAL  19           HA       VAL  19  -1.456  -3.710   2.153
   62    HB   VAL  19           HB       VAL  19  -3.421  -5.808   3.055
   63   HG11  VAL  19          HG11      VAL  19  -3.924  -4.224   4.831
   64   HG12  VAL  19          HG12      VAL  19  -2.760  -3.082   4.161
   65   HG13  VAL  19          HG13      VAL  19  -2.203  -4.620   4.823
   66   HG21  VAL  19          HG21      VAL  19  -4.410  -4.635   1.178
   67   HG22  VAL  19          HG22      VAL  19  -4.029  -3.085   1.929
   68   HG23  VAL  19          HG23      VAL  19  -5.196  -4.170   2.687
   69    H    ARG  20           HN       ARG  20   0.471  -4.158   2.966
   70    HA   ARG  20           HA       ARG  20   0.852  -6.835   4.116
   71    HB2  ARG  20           HB2      ARG  20   1.991  -6.253   1.807
   72    HB3  ARG  20           HB1      ARG  20   3.129  -5.394   2.850
   73    HG2  ARG  20           HG2      ARG  20   3.560  -7.440   4.110
   74    HG3  ARG  20           HG1      ARG  20   2.431  -8.313   3.066
   75    HD2  ARG  20           HD2      ARG  20   5.014  -7.010   2.310
   76    HD3  ARG  20           HD1      ARG  20   4.628  -8.732   2.254
   77    HE   ARG  20           HE       ARG  20   2.755  -7.622   0.636
   78   HH11  ARG  20          HH11      ARG  20   6.274  -7.565   0.643
   79   HH12  ARG  20          HH12      ARG  20   6.368  -7.167  -1.041
   80   HH21  ARG  20          HH21      ARG  20   2.882  -7.102  -1.500
   81   HH22  ARG  20          HH22      ARG  20   4.426  -6.927  -2.290
   82    H    HIS  21           HN       HIS  21   2.145  -6.922   5.945
   83    HA   HIS  21           HA       HIS  21   2.470  -4.348   7.331
   84    HB2  HIS  21           HB2      HIS  21   1.922  -7.091   8.168
   85    HB3  HIS  21           HB1      HIS  21   3.248  -6.383   9.069
   86    HD1  HIS  21           HD1      HIS  21   1.008  -7.121  10.706
   87    HD2  HIS  21           HD2      HIS  21   1.011  -3.356   8.803
   88    HE1  HIS  21           HE1      HIS  21  -0.473  -5.632  12.081
   89    HE2  HIS  21           HE2      HIS  21  -0.326  -3.376  11.014
   90    H    ALA  22           HN       ALA  22   4.386  -3.435   7.091
   91    HA   ALA  22           HA       ALA  22   6.723  -4.868   6.253
   92    HB1  ALA  22           HB1      ALA  22   7.831  -2.685   6.457
   93    HB2  ALA  22           HB2      ALA  22   6.398  -2.035   7.253
   94    HB3  ALA  22           HB3      ALA  22   6.312  -2.555   5.571
   95    HA   PRO  23           HA       PRO  23   8.731  -5.850  10.125
   96    HB2  PRO  23           HB2      PRO  23  11.139  -4.490   9.900
   97    HB3  PRO  23           HB1      PRO  23  10.809  -6.100   9.256
   98    HG2  PRO  23           HG2      PRO  23  10.775  -3.456   7.874
   99    HG3  PRO  23           HG1      PRO  23  11.341  -5.028   7.280
  100    HD2  PRO  23           HD2      PRO  23   8.989  -4.012   6.508
  101    HD3  PRO  23           HD1      PRO  23   9.195  -5.754   6.787
  102    H    ASN  24           HN       ASN  24   8.026  -2.653   9.268
  103    HA   ASN  24           HA       ASN  24   8.865  -1.394  11.721
  104    HB2  ASN  24           HB2      ASN  24   8.789  -0.125   9.594
  105    HB3  ASN  24           HB1      ASN  24   7.057  -0.413   9.488
  106   HD21  ASN  24          HD21      ASN  24   6.501   1.713   9.490
  107   HD22  ASN  24          HD22      ASN  24   6.645   2.739  10.874
  108    H    GLY  25           HN       GLY  25   6.380  -3.388  10.689
  109    HA2  GLY  25           HA2      GLY  25   4.693  -4.268  12.047
  110    HA3  GLY  25           HA1      GLY  25   4.911  -2.913  13.134
  111    H    ARG  26           HN       ARG  26   4.749  -1.877   9.993
  112    HA   ARG  26           HA       ARG  26   1.942  -1.072  10.337
  113    HB2  ARG  26           HB2      ARG  26   4.330   0.282   9.117
  114    HB3  ARG  26           HB1      ARG  26   2.713   0.723   8.592
  115    HG2  ARG  26           HG2      ARG  26   3.692   0.851  11.438
  116    HG3  ARG  26           HG1      ARG  26   3.607   2.219  10.326
  117    HD2  ARG  26           HD2      ARG  26   1.322   0.579  11.405
  118    HD3  ARG  26           HD1      ARG  26   1.658   2.283  11.707
  119    HE   ARG  26           HE       ARG  26   1.214   1.598   8.932
  120   HH11  ARG  26          HH11      ARG  26  -0.186   2.760  11.917
  121   HH12  ARG  26          HH12      ARG  26  -1.627   3.370  11.151
  122   HH21  ARG  26          HH21      ARG  26  -0.694   2.401   7.915
  123   HH22  ARG  26          HH22      ARG  26  -1.903   3.172   8.889
  124    HA   PRO  27           HA       PRO  27   1.216  -3.014   6.342
  125    HB2  PRO  27           HB2      PRO  27  -1.366  -2.374   6.074
  126    HB3  PRO  27           HB1      PRO  27  -0.865  -3.544   7.301
  127    HG2  PRO  27           HG2      PRO  27  -1.487  -0.623   7.617
  128    HG3  PRO  27           HG1      PRO  27  -2.013  -1.988   8.623
  129    HD2  PRO  27           HD2      PRO  27   0.123  -0.451   9.258
  130    HD3  PRO  27           HD1      PRO  27  -0.016  -2.085   9.749
  131    H    PHE  28           HN       PHE  28   2.086  -2.045   4.700
  132    HA   PHE  28           HA       PHE  28   1.242   0.642   3.940
  133    HB2  PHE  28           HB2      PHE  28   3.221   0.587   2.413
  134    HB3  PHE  28           HB1      PHE  28   3.636   0.461   4.108
  135    HD1  PHE  28           HD1      PHE  28   3.517  -2.270   4.811
  136    HD2  PHE  28           HD2      PHE  28   4.702  -0.590   1.079
  137    HE1  PHE  28           HE1      PHE  28   4.882  -4.259   4.348
  138    HE2  PHE  28           HE2      PHE  28   6.047  -2.588   0.613
  139    HZ   PHE  28           HZ       PHE  28   6.145  -4.424   2.244
  140    H    PHE  29           HN       PHE  29  -0.141   0.885   2.384
  141    HA   PHE  29           HA       PHE  29  -1.067  -1.465   0.944
  142    HB2  PHE  29           HB2      PHE  29  -2.197   1.347   1.013
  143    HB3  PHE  29           HB1      PHE  29  -2.952  -0.053   0.258
  144    HD1  PHE  29           HD1      PHE  29  -1.616   0.974   3.598
  145    HD2  PHE  29           HD2      PHE  29  -4.611  -1.109   1.409
  146    HE1  PHE  29           HE1      PHE  29  -2.792   0.467   5.697
  147    HE2  PHE  29           HE2      PHE  29  -5.788  -1.625   3.505
  148    HZ   PHE  29           HZ       PHE  29  -4.877  -0.842   5.647
  149    H    ILE  30           HN       ILE  30  -0.214  -1.903  -0.917
  150    HA   ILE  30           HA       ILE  30   1.316   0.173  -2.271
  151    HB   ILE  30           HB       ILE  30   1.282  -2.750  -3.000
  152   HG12  ILE  30          HG12      ILE  30   2.971  -1.374  -0.934
  153   HG13  ILE  30          HG11      ILE  30   1.734  -2.567  -0.602
  154   HG21  ILE  30          HG21      ILE  30   3.550  -2.233  -3.806
  155   HG22  ILE  30          HG22      ILE  30   3.347  -0.558  -3.292
  156   HG23  ILE  30          HG23      ILE  30   2.339  -1.213  -4.584
  157   HD11  ILE  30          HD11      ILE  30   4.296  -3.035  -2.108
  158   HD12  ILE  30          HD12      ILE  30   3.037  -4.236  -1.827
  159   HD13  ILE  30          HD13      ILE  30   3.931  -3.561  -0.464
  160    H    ASP  31           HN       ASP  31   0.852   0.968  -4.157
  161    HA   ASP  31           HA       ASP  31  -1.428  -0.024  -5.696
  162    HB2  ASP  31           HB2      ASP  31  -1.564   2.298  -5.668
  163    HB3  ASP  31           HB1      ASP  31   0.187   2.502  -5.731
  164    H    HIS  32           HN       HIS  32  -1.096  -1.491  -7.141
  165    HA   HIS  32           HA       HIS  32   1.637  -2.008  -8.067
  166    HB2  HIS  32           HB2      HIS  32  -0.818  -3.792  -8.063
  167    HB3  HIS  32           HB1      HIS  32   0.790  -4.280  -8.577
  168    HD1  HIS  32           HD1      HIS  32  -0.676  -2.694  -5.442
  169    HD2  HIS  32           HD2      HIS  32   2.021  -5.638  -6.506
  170    HE1  HIS  32           HE1      HIS  32   0.289  -3.584  -3.308
  171    HE2  HIS  32           HE2      HIS  32   1.677  -5.555  -4.007
  172    H    ASN  33           HN       ASN  33  -0.996  -0.383  -9.088
  173    HA   ASN  33           HA       ASN  33  -1.094  -1.274 -11.826
  174    HB2  ASN  33           HB2      ASN  33  -2.104   1.357 -10.723
  175    HB3  ASN  33           HB1      ASN  33  -2.583   0.582 -12.227
  176   HD21  ASN  33          HD21      ASN  33  -2.945   0.684  -8.807
  177   HD22  ASN  33          HD22      ASN  33  -4.296  -0.408  -8.710
  178    H    THR  34           HN       THR  34   0.447   1.226  -9.948
  179    HA   THR  34           HA       THR  34   2.129   1.846 -12.273
  180    HB   THR  34           HB       THR  34   1.262   3.786 -10.114
  181    HG1  THR  34           HG1      THR  34   0.479   3.467 -12.837
  182   HG21  THR  34          HG21      THR  34   2.872   4.217 -12.630
  183   HG22  THR  34          HG22      THR  34   3.493   4.273 -10.980
  184   HG23  THR  34          HG23      THR  34   2.329   5.480 -11.525
  185    H    LYS  35           HN       LYS  35   2.299   2.789  -8.846
  186    HA   LYS  35           HA       LYS  35   4.150   1.051  -7.839
  187    HB2  LYS  35           HB2      LYS  35   6.275   2.459  -7.990
  188    HB3  LYS  35           HB1      LYS  35   5.823   1.543  -9.414
  189    HG2  LYS  35           HG2      LYS  35   6.530   3.613 -10.230
  190    HG3  LYS  35           HG1      LYS  35   4.772   3.705 -10.273
  191    HD2  LYS  35           HD2      LYS  35   5.674   5.783  -9.441
  192    HD3  LYS  35           HD1      LYS  35   4.821   4.952  -8.139
  193    HE2  LYS  35           HE2      LYS  35   6.921   5.897  -7.344
  194    HE3  LYS  35           HE1      LYS  35   6.945   4.137  -7.257
  195    HZ1  LYS  35           HZ1      LYS  35   9.023   5.043  -8.111
  196    HZ2  LYS  35           HZ2      LYS  35   8.200   5.765  -9.406
  197    HZ3  LYS  35           HZ3      LYS  35   8.258   4.073  -9.274
  198    H    THR  36           HN       THR  36   1.979   2.691  -7.029
  199    HA   THR  36           HA       THR  36   3.166   4.953  -5.576
  200    HB   THR  36           HB       THR  36   0.247   4.374  -5.487
  201    HG1  THR  36           HG1      THR  36   0.550   4.204  -7.680
  202   HG21  THR  36          HG21      THR  36   0.104   6.823  -5.523
  203   HG22  THR  36          HG22      THR  36   1.856   6.917  -5.700
  204   HG23  THR  36          HG23      THR  36   1.155   6.256  -4.224
  205    H    THR  37           HN       THR  37   2.787   5.222  -3.300
  206    HA   THR  37           HA       THR  37   1.910   2.812  -1.915
  207    HB   THR  37           HB       THR  37   3.944   3.155  -0.347
  208    HG1  THR  37           HG1      THR  37   5.787   3.930  -1.538
  209   HG21  THR  37          HG21      THR  37   5.273   1.599  -1.687
  210   HG22  THR  37          HG22      THR  37   4.300   1.982  -3.108
  211   HG23  THR  37          HG23      THR  37   3.564   1.165  -1.728
  212    H    THR  38           HN       THR  38   0.956   3.114   0.008
  213    HA   THR  38           HA       THR  38   1.082   5.679   1.361
  214    HB   THR  38           HB       THR  38  -0.709   6.049  -0.259
  215    HG1  THR  38           HG1      THR  38  -2.504   6.053   1.542
  216   HG21  THR  38          HG21      THR  38  -1.353   3.733  -0.675
  217   HG22  THR  38          HG22      THR  38  -2.755   4.698  -0.216
  218   HG23  THR  38          HG23      THR  38  -2.011   3.610   0.957
  219    H    TRP  39           HN       TRP  39   0.322   5.545   3.570
  220    HA   TRP  39           HA       TRP  39   0.360   2.796   4.573
  221    HB2  TRP  39           HB2      TRP  39   0.247   5.357   6.167
  222    HB3  TRP  39           HB1      TRP  39   0.614   3.749   6.775
  223    HD1  TRP  39           HD1      TRP  39   2.161   6.765   5.208
  224    HE1  TRP  39           HE1      TRP  39   4.721   6.432   5.055
  225    HE3  TRP  39           HE3      TRP  39   2.391   1.797   6.360
  226    HZ2  TRP  39           HZ2      TRP  39   6.580   4.319   5.407
  227    HZ3  TRP  39           HZ3      TRP  39   4.584   0.695   6.441
  228    HH2  TRP  39           HH2      TRP  39   6.633   1.928   5.971
  229    H    GLU  40           HN       GLU  40  -1.945   4.987   3.616
  230    HA   GLU  40           HA       GLU  40  -3.750   4.305   5.802
  231    HB2  GLU  40           HB2      GLU  40  -5.061   6.295   5.074
  232    HB3  GLU  40           HB1      GLU  40  -3.424   6.639   5.628
  233    HG2  GLU  40           HG2      GLU  40  -3.840   8.015   3.781
  234    HG3  GLU  40           HG1      GLU  40  -2.720   6.771   3.251
  235    H    ASP  41           HN       ASP  41  -6.066   4.134   5.242
  236    HA   ASP  41           HA       ASP  41  -6.199   1.914   3.382
  237    HB2  ASP  41           HB2      ASP  41  -8.081   2.958   5.495
  238    HB3  ASP  41           HB1      ASP  41  -8.509   1.646   4.410
  239    HA   PRO  42           HA       PRO  42  -8.258   4.336   0.227
  240    HB2  PRO  42           HB2      PRO  42  -8.982   2.194  -1.317
  241    HB3  PRO  42           HB1      PRO  42  -7.379   2.935  -1.351
  242    HG2  PRO  42           HG2      PRO  42  -8.302   0.470   0.063
  243    HG3  PRO  42           HG1      PRO  42  -6.780   0.766  -0.794
  244    HD2  PRO  42           HD2      PRO  42  -6.968   0.837   1.903
  245    HD3  PRO  42           HD1      PRO  42  -5.839   1.868   1.002
  246    H    ARG  43           HN       ARG  43  -9.580   2.042   2.350
  247    HA   ARG  43           HA       ARG  43 -12.296   2.169   1.405
  248    HB2  ARG  43           HB2      ARG  43 -12.826   1.030   3.563
  249    HB3  ARG  43           HB1      ARG  43 -11.615   0.190   2.603
  250    HG2  ARG  43           HG2      ARG  43  -9.850   1.122   3.993
  251    HG3  ARG  43           HG1      ARG  43 -11.053   1.995   4.942
  252    HD2  ARG  43           HD2      ARG  43 -11.995  -0.064   5.741
  253    HD3  ARG  43           HD1      ARG  43 -10.954  -1.005   4.669
  254    HE   ARG  43           HE       ARG  43  -9.060  -0.308   5.993
  255   HH11  ARG  43          HH11      ARG  43 -12.225   0.288   7.403
  256   HH12  ARG  43          HH12      ARG  43 -11.596   0.486   9.012
  257   HH21  ARG  43          HH21      ARG  43  -8.251  -0.049   8.107
  258   HH22  ARG  43          HH22      ARG  43  -9.347   0.295   9.413
  259    H    LEU  44           HN       LEU  44 -10.269   4.176   3.267
  260    HA   LEU  44           HA       LEU  44 -12.368   5.428   4.778
  261    HB2  LEU  44           HB2      LEU  44  -9.527   6.321   4.324
  262    HB3  LEU  44           HB1      LEU  44 -10.639   7.020   5.485
  263    HG   LEU  44           HG       LEU  44  -9.612   4.184   5.566
  264   HD11  LEU  44          HD11      LEU  44  -8.333   4.930   7.515
  265   HD12  LEU  44          HD12      LEU  44  -8.885   6.583   7.239
  266   HD13  LEU  44          HD13      LEU  44  -7.853   5.789   6.050
  267   HD21  LEU  44          HD21      LEU  44 -11.844   4.412   6.523
  268   HD22  LEU  44          HD22      LEU  44 -11.277   5.735   7.542
  269   HD23  LEU  44          HD23      LEU  44 -10.639   4.107   7.776
  270    H    LYS  45           HN       LYS  45 -11.363   5.514   1.706
  271    HA   LYS  45           HA       LYS  45 -11.755   8.263   1.023
  272    HB2  LYS  45           HB2      LYS  45 -10.314   6.887  -0.349
  273    HB3  LYS  45           HB1      LYS  45 -11.609   5.734  -0.629
  274    HG2  LYS  45           HG2      LYS  45 -12.815   7.831  -1.656
  275    HG3  LYS  45           HG1      LYS  45 -11.156   8.410  -1.836
  276    HD2  LYS  45           HD2      LYS  45 -11.560   7.312  -3.851
  277    HD3  LYS  45           HD1      LYS  45 -10.696   6.104  -2.901
  278    HE2  LYS  45           HE2      LYS  45 -13.689   6.263  -3.288
  279    HE3  LYS  45           HE1      LYS  45 -12.605   5.123  -4.078
  280    HZ1  LYS  45           HZ1      LYS  45 -13.299   5.267  -1.197
  281    HZ2  LYS  45           HZ2      LYS  45 -12.024   4.320  -1.794
  282    HZ3  LYS  45           HZ3      LYS  45 -13.614   3.997  -2.279
  283    H    GLN 112           H        GLN 112   6.102   9.554   5.814
  284    HA   GLN 112           HA       GLN 112   8.570   7.917   5.920
  285    HB2  GLN 112           HB2      GLN 112   5.790   7.446   6.995
  286    HB3  GLN 112           HB1      GLN 112   6.890   6.121   6.655
  287    HG2  GLN 112           HG2      GLN 112   6.981   6.613   8.989
  288    HG3  GLN 112           HG1      GLN 112   8.503   7.105   8.251
  289   HE21  GLN 112          HE21      GLN 112   8.958   8.508   9.945
  290   HE22  GLN 112          HE22      GLN 112   8.118  10.016  10.139
  291    H    ILE 113           HN       ILE 113   8.950   6.934   4.042
  292    HA   ILE 113           HA       ILE 113   6.840   6.928   2.007
  293    HB   ILE 113           HB       ILE 113   9.829   6.574   1.755
  294   HG12  ILE 113          HG12      ILE 113   9.474   8.590   0.200
  295   HG13  ILE 113          HG11      ILE 113   7.887   8.731   0.946
  296   HG21  ILE 113          HG21      ILE 113   7.743   6.404  -0.416
  297   HG22  ILE 113          HG22      ILE 113   8.738   5.075   0.183
  298   HG23  ILE 113          HG23      ILE 113   9.490   6.426  -0.666
  299   HD11  ILE 113          HD11      ILE 113  10.517   8.868   2.397
  300   HD12  ILE 113          HD12      ILE 113   8.918   9.059   3.116
  301   HD13  ILE 113          HD13      ILE 113   9.508  10.241   1.948
  302    HA   PRO 114           HA       PRO 114   6.461   2.494   2.859
  303    HB2  PRO 114           HB2      PRO 114   4.437   2.587   0.750
  304    HB3  PRO 114           HB1      PRO 114   4.269   2.131   2.446
  305    HG2  PRO 114           HG2      PRO 114   3.244   4.417   1.427
  306    HG3  PRO 114           HG1      PRO 114   3.785   4.267   3.107
  307    HD2  PRO 114           HD2      PRO 114   5.136   5.565   0.784
  308    HD3  PRO 114           HD1      PRO 114   5.097   6.043   2.495
  309    HA   PRO 115           HA       PRO 115   8.979   1.039  -0.651
  310    HB2  PRO 115           HB2      PRO 115   8.263  -1.537   0.643
  311    HB3  PRO 115           HB1      PRO 115   9.838  -0.924   0.162
  312    HG2  PRO 115           HG2      PRO 115   9.150  -0.993   2.719
  313    HG3  PRO 115           HG1      PRO 115  10.068   0.377   2.066
  314    HD2  PRO 115           HD2      PRO 115   7.161   0.197   2.744
  315    HD3  PRO 115           HD1      PRO 115   8.300   1.541   2.970
  316    HA   PRO 116           HA       PRO 116   5.770  -0.336  -3.577
  317    HB2  PRO 116           HB2      PRO 116   7.857  -1.412  -5.159
  318    HB3  PRO 116           HB1      PRO 116   7.052   0.151  -5.383
  319    HG2  PRO 116           HG2      PRO 116   9.536  -0.509  -3.862
  320    HG3  PRO 116           HG1      PRO 116   9.204   0.871  -4.942
  321    HD2  PRO 116           HD2      PRO 116   8.995   1.302  -2.451
  322    HD3  PRO 116           HD1      PRO 116   7.634   1.756  -3.443
  323    H    TYR 117           HN       TYR 117   5.901  -1.969  -4.858
  324    HA   TYR 117           HA       TYR 117   5.582  -4.442  -3.337
  325    HB2  TYR 117           HB2      TYR 117   4.312  -5.300  -5.217
  326    HB3  TYR 117           HB1      TYR 117   3.741  -3.699  -4.779
  327    HD1  TYR 117           HD1      TYR 117   4.201  -1.771  -6.272
  328    HD2  TYR 117           HD2      TYR 117   5.258  -5.748  -7.357
  329    HE1  TYR 117           HE1      TYR 117   4.387  -1.082  -8.616
  330    HE2  TYR 117           HE2      TYR 117   5.458  -5.059  -9.705
  331    HH   TYR 117           HH       TYR 117   4.578  -3.275 -11.175
  332    H    VAL 118           HN       VAL 118   6.254  -6.520  -4.170
  333    HA   VAL 118           HA       VAL 118   8.742  -6.391  -5.742
  334    HB   VAL 118           HB       VAL 118   9.197  -6.538  -3.274
  335   HG11  VAL 118          HG11      VAL 118   8.803  -8.680  -2.142
  336   HG12  VAL 118          HG12      VAL 118   7.892  -9.241  -3.543
  337   HG13  VAL 118          HG13      VAL 118   7.301  -7.875  -2.596
  338   HG21  VAL 118          HG21      VAL 118  10.083  -8.885  -4.949
  339   HG22  VAL 118          HG22      VAL 118  10.843  -8.360  -3.447
  340   HG23  VAL 118          HG23      VAL 118  10.859  -7.304  -4.859
  341    H    GLU 119           HN       GLU 119   5.697  -7.538  -5.491
  342    HA   GLU 119           HA       GLU 119   6.078 -10.267  -6.283
  343    HB2  GLU 119           HB2      GLU 119   3.528  -8.717  -6.674
  344    HB3  GLU 119           HB1      GLU 119   3.728 -10.438  -6.393
  345    HG2  GLU 119           HG2      GLU 119   2.918  -9.743  -4.373
  346    HG3  GLU 119           HG1      GLU 119   4.653  -9.660  -4.075
  347    HA   PRO 120           HA       PRO 120   6.762  -9.189 -10.623
  348    HB2  PRO 120           HB2      PRO 120   6.795 -12.120 -10.910
  349    HB3  PRO 120           HB1      PRO 120   8.037 -10.938 -11.332
  350    HG2  PRO 120           HG2      PRO 120   8.324 -12.601  -9.244
  351    HG3  PRO 120           HG1      PRO 120   8.948 -10.941  -9.213
  352    HD2  PRO 120           HD2      PRO 120   6.467 -12.058  -7.959
  353    HD3  PRO 120           HD1      PRO 120   7.630 -10.882  -7.308
  Start of MODEL   10
    1    H    PHE  12           H        PHE  12 -10.413  -6.337   0.666
    2    HA   PHE  12           HA       PHE  12 -12.573  -6.510  -1.345
    3    HB2  PHE  12           HB2      PHE  12 -13.814  -5.009   0.213
    4    HB3  PHE  12           HB1      PHE  12 -13.529  -6.615   0.863
    5    HD1  PHE  12           HD1      PHE  12 -12.533  -3.072   1.075
    6    HD2  PHE  12           HD2      PHE  12 -12.245  -6.938   2.830
    7    HE1  PHE  12           HE1      PHE  12 -11.568  -2.073   3.105
    8    HE2  PHE  12           HE2      PHE  12 -11.279  -5.945   4.864
    9    HZ   PHE  12           HZ       PHE  12 -10.940  -3.511   5.003
   10    H    LEU  13           HN       LEU  13  -9.675  -5.419  -1.301
   11    HA   LEU  13           HA       LEU  13 -10.227  -2.571  -1.676
   12    HB2  LEU  13           HB2      LEU  13  -7.710  -4.179  -1.382
   13    HB3  LEU  13           HB1      LEU  13  -7.662  -2.553  -2.031
   14    HG   LEU  13           HG       LEU  13  -8.845  -1.829   0.112
   15   HD11  LEU  13          HD11      LEU  13  -7.901  -4.552   0.992
   16   HD12  LEU  13          HD12      LEU  13  -9.576  -4.012   0.880
   17   HD13  LEU  13          HD13      LEU  13  -8.489  -3.276   2.058
   18   HD21  LEU  13          HD21      LEU  13  -6.728  -1.741   1.342
   19   HD22  LEU  13          HD22      LEU  13  -6.528  -1.326  -0.361
   20   HD23  LEU  13          HD23      LEU  13  -6.041  -2.916   0.223
   21    HA   PRO  14           HA       PRO  14  -9.931  -2.300  -6.140
   22    HB2  PRO  14           HB2      PRO  14  -7.700  -0.495  -5.319
   23    HB3  PRO  14           HB1      PRO  14  -8.841  -0.305  -6.655
   24    HG2  PRO  14           HG2      PRO  14  -9.324   0.924  -4.539
   25    HG3  PRO  14           HG1      PRO  14 -10.640  -0.058  -5.148
   26    HD2  PRO  14           HD2      PRO  14  -8.733  -0.651  -2.884
   27    HD3  PRO  14           HD1      PRO  14 -10.496  -0.898  -2.946
   28    H    LYS  15           HN       LYS  15  -8.770  -2.685  -7.785
   29    HA   LYS  15           HA       LYS  15  -7.217  -5.070  -7.559
   30    HB2  LYS  15           HB2      LYS  15  -8.690  -4.656  -9.473
   31    HB3  LYS  15           HB1      LYS  15  -7.686  -3.299  -9.965
   32    HG2  LYS  15           HG2      LYS  15  -7.119  -5.121 -11.365
   33    HG3  LYS  15           HG1      LYS  15  -5.785  -4.922 -10.227
   34    HD2  LYS  15           HD2      LYS  15  -6.209  -7.252 -10.360
   35    HD3  LYS  15           HD1      LYS  15  -6.888  -6.715  -8.822
   36    HE2  LYS  15           HE2      LYS  15  -8.446  -8.206  -9.886
   37    HE3  LYS  15           HE1      LYS  15  -9.112  -6.573  -9.904
   38    HZ1  LYS  15           HZ1      LYS  15  -7.761  -7.932 -12.177
   39    HZ2  LYS  15           HZ2      LYS  15  -8.365  -6.348 -12.209
   40    HZ3  LYS  15           HZ3      LYS  15  -9.428  -7.658 -12.033
   41    H    GLY  16           HN       GLY  16  -5.121  -5.277  -7.187
   42    HA2  GLY  16           HA2      GLY  16  -2.841  -4.942  -7.555
   43    HA3  GLY  16           HA1      GLY  16  -3.198  -3.428  -8.368
   44    H    TRP  17           HN       TRP  17  -4.977  -3.292  -5.633
   45    HA   TRP  17           HA       TRP  17  -2.926  -1.780  -4.235
   46    HB2  TRP  17           HB2      TRP  17  -5.895  -2.081  -3.834
   47    HB3  TRP  17           HB1      TRP  17  -4.869  -1.323  -2.623
   48    HD1  TRP  17           HD1      TRP  17  -5.863  -0.831  -6.340
   49    HE1  TRP  17           HE1      TRP  17  -5.784   1.685  -6.829
   50    HE3  TRP  17           HE3      TRP  17  -3.914   0.807  -1.888
   51    HZ2  TRP  17           HZ2      TRP  17  -4.949   4.053  -5.531
   52    HZ3  TRP  17           HZ3      TRP  17  -3.494   3.212  -1.612
   53    HH2  TRP  17           HH2      TRP  17  -3.997   4.801  -3.395
   54    H    GLU  18           HN       GLU  18  -1.678  -2.716  -2.848
   55    HA   GLU  18           HA       GLU  18  -2.606  -5.177  -1.550
   56    HB2  GLU  18           HB2      GLU  18  -0.029  -4.291  -2.625
   57    HB3  GLU  18           HB1      GLU  18   0.058  -5.152  -1.108
   58    HG2  GLU  18           HG2      GLU  18  -1.373  -6.179  -3.537
   59    HG3  GLU  18           HG1      GLU  18   0.292  -6.562  -3.121
   60    H    VAL  19           HN       VAL  19  -2.239  -5.526   0.542
   61    HA   VAL  19           HA       VAL  19  -1.546  -3.191   2.208
   62    HB   VAL  19           HB       VAL  19  -3.470  -5.315   3.131
   63   HG11  VAL  19          HG11      VAL  19  -4.145  -3.617   4.739
   64   HG12  VAL  19          HG12      VAL  19  -2.979  -2.493   4.043
   65   HG13  VAL  19          HG13      VAL  19  -2.418  -3.959   4.847
   66   HG21  VAL  19          HG21      VAL  19  -4.476  -4.367   1.151
   67   HG22  VAL  19          HG22      VAL  19  -4.193  -2.739   1.761
   68   HG23  VAL  19          HG23      VAL  19  -5.323  -3.808   2.594
   69    H    ARG  20           HN       ARG  20   0.573  -3.863   2.529
   70    HA   ARG  20           HA       ARG  20   0.862  -6.528   3.719
   71    HB2  ARG  20           HB2      ARG  20   2.170  -5.922   1.592
   72    HB3  ARG  20           HB1      ARG  20   3.135  -4.882   2.644
   73    HG2  ARG  20           HG2      ARG  20   3.868  -6.720   3.947
   74    HG3  ARG  20           HG1      ARG  20   2.712  -7.807   3.178
   75    HD2  ARG  20           HD2      ARG  20   5.113  -6.513   1.939
   76    HD3  ARG  20           HD1      ARG  20   4.888  -8.225   2.268
   77    HE   ARG  20           HE       ARG  20   4.086  -6.863  -0.062
   78   HH11  ARG  20          HH11      ARG  20   2.911  -9.323   2.161
   79   HH12  ARG  20          HH12      ARG  20   1.835 -10.026   0.991
   80   HH21  ARG  20          HH21      ARG  20   2.698  -7.841  -1.609
   81   HH22  ARG  20          HH22      ARG  20   1.715  -9.191  -1.126
   82    H    HIS  21           HN       HIS  21   2.207  -6.779   5.536
   83    HA   HIS  21           HA       HIS  21   2.092  -4.401   7.278
   84    HB2  HIS  21           HB2      HIS  21   1.007  -6.927   7.625
   85    HB3  HIS  21           HB1      HIS  21   2.497  -7.018   8.546
   86    HD1  HIS  21           HD1      HIS  21   0.909  -7.384  10.586
   87    HD2  HIS  21           HD2      HIS  21   0.703  -3.520   8.933
   88    HE1  HIS  21           HE1      HIS  21  -0.321  -5.979  12.258
   89    HE2  HIS  21           HE2      HIS  21  -0.640  -3.753  11.135
   90    H    ALA  22           HN       ALA  22   4.033  -3.480   7.370
   91    HA   ALA  22           HA       ALA  22   6.483  -4.701   6.729
   92    HB1  ALA  22           HB1      ALA  22   5.977  -2.214   8.367
   93    HB2  ALA  22           HB2      ALA  22   6.089  -2.284   6.608
   94    HB3  ALA  22           HB3      ALA  22   7.501  -2.659   7.598
   95    HA   PRO  23           HA       PRO  23   7.879  -6.838  10.299
   96    HB2  PRO  23           HB2      PRO  23  10.331  -5.704  10.865
   97    HB3  PRO  23           HB1      PRO  23  10.046  -6.936   9.634
   98    HG2  PRO  23           HG2      PRO  23  10.272  -3.971   9.333
   99    HG3  PRO  23           HG1      PRO  23  10.917  -5.257   8.294
  100    HD2  PRO  23           HD2      PRO  23   8.715  -3.893   7.616
  101    HD3  PRO  23           HD1      PRO  23   8.864  -5.629   7.273
  102    H    ASN  24           HN       ASN  24   7.678  -3.396  10.512
  103    HA   ASN  24           HA       ASN  24   7.983  -3.300  13.380
  104    HB2  ASN  24           HB2      ASN  24   7.198  -0.901  13.078
  105    HB3  ASN  24           HB1      ASN  24   8.712  -1.324  12.290
  106   HD21  ASN  24          HD21      ASN  24   8.539   0.358  10.855
  107   HD22  ASN  24          HD22      ASN  24   7.425   0.348   9.528
  108    H    GLY  25           HN       GLY  25   5.655  -4.214  11.217
  109    HA2  GLY  25           HA2      GLY  25   3.596  -5.142  11.761
  110    HA3  GLY  25           HA1      GLY  25   3.681  -4.339  13.312
  111    H    ARG  26           HN       ARG  26   4.018  -2.903  10.108
  112    HA   ARG  26           HA       ARG  26   1.452  -1.520  10.528
  113    HB2  ARG  26           HB2      ARG  26   4.017  -0.304   9.460
  114    HB3  ARG  26           HB1      ARG  26   2.445   0.489   9.435
  115    HG2  ARG  26           HG2      ARG  26   3.896  -0.402  11.918
  116    HG3  ARG  26           HG1      ARG  26   3.821   1.252  11.302
  117    HD2  ARG  26           HD2      ARG  26   1.509   1.411  11.712
  118    HD3  ARG  26           HD1      ARG  26   1.342  -0.332  11.914
  119    HE   ARG  26           HE       ARG  26   2.970   0.251  13.937
  120   HH11  ARG  26          HH11      ARG  26   0.033   1.828  12.854
  121   HH12  ARG  26          HH12      ARG  26  -0.409   2.369  14.443
  122   HH21  ARG  26          HH21      ARG  26   2.370   0.951  16.034
  123   HH22  ARG  26          HH22      ARG  26   0.917   1.878  16.244
  124    HA   PRO  27           HA       PRO  27   0.769  -2.909   6.316
  125    HB2  PRO  27           HB2      PRO  27  -1.730  -2.016   6.032
  126    HB3  PRO  27           HB1      PRO  27  -1.388  -3.327   7.166
  127    HG2  PRO  27           HG2      PRO  27  -1.656  -0.380   7.733
  128    HG3  PRO  27           HG1      PRO  27  -2.468  -1.737   8.546
  129    HD2  PRO  27           HD2      PRO  27  -0.225  -0.673   9.565
  130    HD3  PRO  27           HD1      PRO  27  -0.567  -2.355   9.690
  131    H    PHE  28           HN       PHE  28   1.828  -1.842   4.843
  132    HA   PHE  28           HA       PHE  28   1.092   0.913   4.192
  133    HB2  PHE  28           HB2      PHE  28   3.215   0.966   2.899
  134    HB3  PHE  28           HB1      PHE  28   3.462   0.671   4.607
  135    HD1  PHE  28           HD2      PHE  28   3.416  -2.020   5.150
  136    HD2  PHE  28           HD1      PHE  28   4.620  -0.203   1.489
  137    HE1  PHE  28           HE2      PHE  28   4.794  -3.982   4.632
  138    HE2  PHE  28           HE1      PHE  28   5.989  -2.173   0.968
  139    HZ   PHE  28           HZ       PHE  28   6.084  -4.064   2.538
  140    H    PHE  29           HN       PHE  29  -0.083   1.270   2.448
  141    HA   PHE  29           HA       PHE  29  -0.909  -1.050   0.913
  142    HB2  PHE  29           HB2      PHE  29  -2.005   1.773   0.842
  143    HB3  PHE  29           HB1      PHE  29  -2.723   0.342   0.103
  144    HD1  PHE  29           HD1      PHE  29  -1.674   1.630   3.451
  145    HD2  PHE  29           HD2      PHE  29  -4.370  -0.764   1.198
  146    HE1  PHE  29           HE1      PHE  29  -3.000   1.220   5.484
  147    HE2  PHE  29           HE2      PHE  29  -5.694  -1.182   3.220
  148    HZ   PHE  29           HZ       PHE  29  -5.013  -0.196   5.363
  149    H    ILE  30           HN       ILE  30  -0.017  -1.488  -0.926
  150    HA   ILE  30           HA       ILE  30   1.416   0.632  -2.355
  151    HB   ILE  30           HB       ILE  30   1.553  -2.326  -2.931
  152   HG12  ILE  30          HG12      ILE  30   3.482  -0.693  -1.335
  153   HG13  ILE  30          HG11      ILE  30   2.256  -1.702  -0.584
  154   HG21  ILE  30          HG21      ILE  30   2.275  -0.849  -4.737
  155   HG22  ILE  30          HG22      ILE  30   3.659  -1.691  -4.039
  156   HG23  ILE  30          HG23      ILE  30   3.357  -0.003  -3.629
  157   HD11  ILE  30          HD11      ILE  30   3.252  -3.667  -1.652
  158   HD12  ILE  30          HD12      ILE  30   4.402  -2.824  -0.613
  159   HD13  ILE  30          HD13      ILE  30   4.494  -2.639  -2.366
  160    H    ASP  31           HN       ASP  31   0.607   1.436  -4.115
  161    HA   ASP  31           HA       ASP  31  -1.514  -0.006  -5.524
  162    HB2  ASP  31           HB2      ASP  31  -1.840   2.421  -5.269
  163    HB3  ASP  31           HB1      ASP  31  -0.330   2.717  -6.127
  164    H    HIS  32           HN       HIS  32  -0.817  -1.566  -6.709
  165    HA   HIS  32           HA       HIS  32   1.899  -1.640  -7.660
  166    HB2  HIS  32           HB2      HIS  32  -0.392  -3.612  -7.795
  167    HB3  HIS  32           HB1      HIS  32   1.190  -3.944  -8.479
  168    HD1  HIS  32           HD1      HIS  32   2.018  -5.755  -6.851
  169    HD2  HIS  32           HD2      HIS  32   0.613  -2.350  -4.921
  170    HE1  HIS  32           HE1      HIS  32   2.579  -6.025  -4.389
  171    HE2  HIS  32           HE2      HIS  32   1.525  -4.075  -3.265
  172    H    ASN  33           HN       ASN  33  -0.868  -0.290  -8.837
  173    HA   ASN  33           HA       ASN  33  -0.306  -0.807 -11.652
  174    HB2  ASN  33           HB2      ASN  33  -2.313   1.120 -10.464
  175    HB3  ASN  33           HB1      ASN  33  -2.250   0.551 -12.128
  176   HD21  ASN  33          HD21      ASN  33  -3.145  -0.171  -8.873
  177   HD22  ASN  33          HD22      ASN  33  -4.058  -1.612  -9.227
  178    H    THR  34           HN       THR  34  -0.403   1.957  -9.422
  179    HA   THR  34           HA       THR  34   0.881   3.642 -11.437
  180    HB   THR  34           HB       THR  34  -0.034   4.633  -8.757
  181    HG1  THR  34           HG1      THR  34  -1.938   3.814  -9.253
  182   HG21  THR  34          HG21      THR  34  -0.575   6.647 -10.054
  183   HG22  THR  34          HG22      THR  34  -0.052   5.839 -11.530
  184   HG23  THR  34          HG23      THR  34   1.117   6.193 -10.257
  185    H    LYS  35           HN       LYS  35   1.897   1.658  -9.014
  186    HA   LYS  35           HA       LYS  35   3.863   1.366  -7.902
  187    HB2  LYS  35           HB2      LYS  35   4.748   3.623  -9.706
  188    HB3  LYS  35           HB1      LYS  35   5.824   2.853  -8.555
  189    HG2  LYS  35           HG2      LYS  35   6.263   1.862 -10.644
  190    HG3  LYS  35           HG1      LYS  35   5.341   0.675  -9.723
  191    HD2  LYS  35           HD2      LYS  35   3.348   1.167 -10.942
  192    HD3  LYS  35           HD1      LYS  35   4.100   2.562 -11.719
  193    HE2  LYS  35           HE2      LYS  35   5.654   1.090 -12.885
  194    HE3  LYS  35           HE1      LYS  35   4.944  -0.311 -12.082
  195    HZ1  LYS  35           HZ1      LYS  35   2.972  -0.087 -13.276
  196    HZ2  LYS  35           HZ2      LYS  35   4.175   0.216 -14.430
  197    HZ3  LYS  35           HZ3      LYS  35   3.309   1.506 -13.750
  198    H    THR  36           HN       THR  36   1.748   3.221  -6.965
  199    HA   THR  36           HA       THR  36   3.334   5.211  -5.489
  200    HB   THR  36           HB       THR  36   1.078   6.261  -5.003
  201    HG1  THR  36           HG1      THR  36  -0.143   4.341  -5.577
  202   HG21  THR  36          HG21      THR  36   0.895   7.292  -7.228
  203   HG22  THR  36          HG22      THR  36   1.942   6.034  -7.888
  204   HG23  THR  36          HG23      THR  36   2.573   7.171  -6.696
  205    H    THR  37           HN       THR  37   3.603   5.029  -3.356
  206    HA   THR  37           HA       THR  37   2.076   2.931  -1.982
  207    HB   THR  37           HB       THR  37   4.041   3.096  -0.319
  208    HG1  THR  37           HG1      THR  37   5.956   3.897  -1.228
  209   HG21  THR  37          HG21      THR  37   3.660   1.183  -1.784
  210   HG22  THR  37          HG22      THR  37   5.382   1.548  -1.666
  211   HG23  THR  37          HG23      THR  37   4.478   2.021  -3.106
  212    H    THR  38           HN       THR  38   0.987   3.344  -0.139
  213    HA   THR  38           HA       THR  38   1.207   5.944   1.150
  214    HB   THR  38           HB       THR  38  -0.386   6.428  -0.608
  215    HG1  THR  38           HG1      THR  38  -2.360   6.630   0.875
  216   HG21  THR  38          HG21      THR  38  -2.491   5.186  -0.832
  217   HG22  THR  38          HG22      THR  38  -1.951   4.053   0.408
  218   HG23  THR  38          HG23      THR  38  -1.094   4.150  -1.130
  219    H    TRP  39           HN       TRP  39   0.257   5.961   3.263
  220    HA   TRP  39           HA       TRP  39  -0.114   3.276   4.369
  221    HB2  TRP  39           HB2      TRP  39   0.001   5.883   5.888
  222    HB3  TRP  39           HB1      TRP  39   0.166   4.258   6.541
  223    HD1  TRP  39           HD1      TRP  39   2.061   6.955   4.687
  224    HE1  TRP  39           HE1      TRP  39   4.585   6.369   4.717
  225    HE3  TRP  39           HE3      TRP  39   1.768   2.248   6.643
  226    HZ2  TRP  39           HZ2      TRP  39   6.213   4.174   5.490
  227    HZ3  TRP  39           HZ3      TRP  39   3.836   0.975   7.015
  228    HH2  TRP  39           HH2      TRP  39   6.011   1.914   6.450
  229    H    GLU  40           HN       GLU  40  -1.973   5.704   3.118
  230    HA   GLU  40           HA       GLU  40  -4.055   5.397   5.110
  231    HB2  GLU  40           HB2      GLU  40  -5.176   7.270   4.047
  232    HB3  GLU  40           HB1      GLU  40  -3.503   7.650   4.448
  233    HG2  GLU  40           HG2      GLU  40  -4.030   8.638   2.379
  234    HG3  GLU  40           HG1      GLU  40  -2.897   7.332   2.087
  235    H    ASP  41           HN       ASP  41  -6.274   5.004   4.381
  236    HA   ASP  41           HA       ASP  41  -5.981   2.500   2.873
  237    HB2  ASP  41           HB2      ASP  41  -6.552   2.491   5.351
  238    HB3  ASP  41           HB1      ASP  41  -8.097   3.161   4.912
  239    HA   PRO  42           HA       PRO  42  -8.691   4.197  -0.197
  240    HB2  PRO  42           HB2      PRO  42  -9.286   1.853  -1.472
  241    HB3  PRO  42           HB1      PRO  42  -7.789   2.760  -1.714
  242    HG2  PRO  42           HG2      PRO  42  -8.298   0.368   0.005
  243    HG3  PRO  42           HG1      PRO  42  -6.905   0.728  -1.031
  244    HD2  PRO  42           HD2      PRO  42  -6.830   1.066   1.644
  245    HD3  PRO  42           HD1      PRO  42  -5.945   2.130   0.534
  246    H    ARG  43           HN       ARG  43  -9.635   1.876   2.189
  247    HA   ARG  43           HA       ARG  43 -12.415   1.792   1.394
  248    HB2  ARG  43           HB2      ARG  43 -12.689   0.252   3.035
  249    HB3  ARG  43           HB1      ARG  43 -10.938   0.158   2.963
  250    HG2  ARG  43           HG2      ARG  43 -10.852   1.829   4.815
  251    HG3  ARG  43           HG1      ARG  43 -12.606   1.712   4.933
  252    HD2  ARG  43           HD2      ARG  43 -11.879   0.238   6.565
  253    HD3  ARG  43           HD1      ARG  43 -12.187  -0.822   5.189
  254    HE   ARG  43           HE       ARG  43  -9.555  -0.158   4.935
  255   HH11  ARG  43          HH11      ARG  43 -11.500  -1.602   7.468
  256   HH12  ARG  43          HH12      ARG  43 -10.168  -2.453   8.181
  257   HH21  ARG  43          HH21      ARG  43  -7.804  -1.231   5.879
  258   HH22  ARG  43          HH22      ARG  43  -8.048  -2.228   7.291
  259    H    LEU  44           HN       LEU  44 -10.385   3.896   3.062
  260    HA   LEU  44           HA       LEU  44 -12.338   5.166   4.696
  261    HB2  LEU  44           HB2      LEU  44  -9.561   5.953   3.859
  262    HB3  LEU  44           HB1      LEU  44 -10.544   6.961   4.892
  263    HG   LEU  44           HG       LEU  44  -9.711   4.146   5.556
  264   HD11  LEU  44          HD11      LEU  44  -8.642   6.784   6.554
  265   HD12  LEU  44          HD12      LEU  44  -7.792   5.651   5.503
  266   HD13  LEU  44          HD13      LEU  44  -8.187   5.191   7.159
  267   HD21  LEU  44          HD21      LEU  44 -11.818   4.818   6.593
  268   HD22  LEU  44          HD22      LEU  44 -11.048   6.276   7.220
  269   HD23  LEU  44          HD23      LEU  44 -10.527   4.690   7.790
  270    H    LYS  45           HN       LYS  45 -11.796   5.123   1.502
  271    HA   LYS  45           HA       LYS  45 -12.700   7.825   0.926
  272    HB2  LYS  45           HB2      LYS  45 -10.969   6.709  -0.502
  273    HB3  LYS  45           HB1      LYS  45 -12.188   5.541  -0.993
  274    HG2  LYS  45           HG2      LYS  45 -13.537   7.384  -1.918
  275    HG3  LYS  45           HG1      LYS  45 -12.246   8.508  -1.498
  276    HD2  LYS  45           HD2      LYS  45 -11.990   6.168  -3.386
  277    HD3  LYS  45           HD1      LYS  45 -12.185   7.851  -3.866
  278    HE2  LYS  45           HE2      LYS  45  -9.900   7.561  -4.040
  279    HE3  LYS  45           HE1      LYS  45 -10.060   8.241  -2.424
  280    HZ1  LYS  45           HZ1      LYS  45  -9.810   5.346  -3.033
  281    HZ2  LYS  45           HZ2      LYS  45  -9.864   6.043  -1.490
  282    HZ3  LYS  45           HZ3      LYS  45  -8.540   6.338  -2.505
  283    H    GLN 112           H        GLN 112   6.299  10.417   4.246
  284    HA   GLN 112           HA       GLN 112   8.202   9.212   5.066
  285    HB2  GLN 112           HB2      GLN 112   6.786   8.781   7.295
  286    HB3  GLN 112           HB1      GLN 112   6.396   7.286   6.463
  287    HG2  GLN 112           HG2      GLN 112   9.200   8.233   7.000
  288    HG3  GLN 112           HG1      GLN 112   8.306   7.138   8.048
  289   HE21  GLN 112          HE21      GLN 112   7.044   5.717   5.846
  290   HE22  GLN 112          HE22      GLN 112   8.276   4.750   5.116
  291    H    ILE 113           HN       ILE 113   8.676   8.253   3.199
  292    HA   ILE 113           HA       ILE 113   6.718   7.199   1.471
  293    HB   ILE 113           HB       ILE 113   8.700   8.190   0.561
  294   HG12  ILE 113          HG12      ILE 113   8.704   5.226  -0.044
  295   HG13  ILE 113          HG11      ILE 113   7.573   6.390  -0.723
  296   HG21  ILE 113          HG21      ILE 113  10.907   7.134   0.740
  297   HG22  ILE 113          HG22      ILE 113  10.236   5.945   1.856
  298   HG23  ILE 113          HG23      ILE 113  10.287   7.649   2.309
  299   HD11  ILE 113          HD11      ILE 113  10.555   6.394  -1.122
  300   HD12  ILE 113          HD12      ILE 113   9.418   7.553  -1.813
  301   HD13  ILE 113          HD13      ILE 113   9.347   5.856  -2.290
  302    HA   PRO 114           HA       PRO 114   6.689   2.964   3.083
  303    HB2  PRO 114           HB2      PRO 114   4.604   2.498   1.121
  304    HB3  PRO 114           HB1      PRO 114   4.498   2.449   2.881
  305    HG2  PRO 114           HG2      PRO 114   3.315   4.365   1.339
  306    HG3  PRO 114           HG1      PRO 114   3.809   4.615   3.023
  307    HD2  PRO 114           HD2      PRO 114   5.142   5.491   0.507
  308    HD3  PRO 114           HD1      PRO 114   5.016   6.313   2.075
  309    HA   PRO 115           HA       PRO 115   9.206   1.055  -0.163
  310    HB2  PRO 115           HB2      PRO 115   8.071  -1.365   1.164
  311    HB3  PRO 115           HB1      PRO 115   9.739  -1.004   0.730
  312    HG2  PRO 115           HG2      PRO 115   8.956  -0.824   3.251
  313    HG3  PRO 115           HG1      PRO 115  10.052   0.392   2.566
  314    HD2  PRO 115           HD2      PRO 115   7.133   0.584   3.151
  315    HD3  PRO 115           HD1      PRO 115   8.407   1.814   3.303
  316    HA   PRO 116           HA       PRO 116   6.046   0.159  -3.301
  317    HB2  PRO 116           HB2      PRO 116   8.108  -0.921  -4.893
  318    HB3  PRO 116           HB1      PRO 116   7.434   0.714  -4.998
  319    HG2  PRO 116           HG2      PRO 116   9.792  -0.270  -3.455
  320    HG3  PRO 116           HG1      PRO 116   9.617   1.218  -4.423
  321    HD2  PRO 116           HD2      PRO 116   9.332   1.451  -1.906
  322    HD3  PRO 116           HD1      PRO 116   8.057   2.103  -2.907
  323    H    TYR 117           HN       TYR 117   6.099  -1.331  -4.701
  324    HA   TYR 117           HA       TYR 117   5.561  -3.935  -3.509
  325    HB2  TYR 117           HB2      TYR 117   4.346  -4.489  -5.482
  326    HB3  TYR 117           HB1      TYR 117   3.974  -2.812  -5.113
  327    HD1  TYR 117           HD1      TYR 117   5.028  -0.997  -6.494
  328    HD2  TYR 117           HD2      TYR 117   5.328  -5.113  -7.524
  329    HE1  TYR 117           HE1      TYR 117   5.650  -0.375  -8.791
  330    HE2  TYR 117           HE2      TYR 117   5.957  -4.505  -9.813
  331    HH   TYR 117           HH       TYR 117   5.702  -2.630 -11.346
  332    H    VAL 118           HN       VAL 118   6.725  -5.753  -3.742
  333    HA   VAL 118           HA       VAL 118   9.068  -5.631  -5.530
  334    HB   VAL 118           HB       VAL 118  10.095  -7.354  -4.079
  335   HG11  VAL 118          HG11      VAL 118  10.623  -5.013  -3.715
  336   HG12  VAL 118          HG12      VAL 118  10.583  -5.876  -2.178
  337   HG13  VAL 118          HG13      VAL 118   9.231  -4.845  -2.644
  338   HG21  VAL 118          HG21      VAL 118   7.702  -6.882  -2.300
  339   HG22  VAL 118          HG22      VAL 118   9.128  -7.831  -1.877
  340   HG23  VAL 118          HG23      VAL 118   8.066  -8.367  -3.181
  341    H    GLU 119           HN       GLU 119   6.075  -7.016  -5.064
  342    HA   GLU 119           HA       GLU 119   6.536  -9.626  -6.084
  343    HB2  GLU 119           HB2      GLU 119   3.956  -8.058  -6.166
  344    HB3  GLU 119           HB1      GLU 119   4.137  -9.804  -6.244
  345    HG2  GLU 119           HG2      GLU 119   3.583  -9.641  -4.066
  346    HG3  GLU 119           HG1      GLU 119   5.317  -9.373  -3.893
  347    HA   PRO 120           HA       PRO 120   7.191  -8.255 -10.282
  348    HB2  PRO 120           HB2      PRO 120   7.515 -11.086 -10.910
  349    HB3  PRO 120           HB1      PRO 120   8.717  -9.795 -10.942
  350    HG2  PRO 120           HG2      PRO 120   8.760 -11.789  -9.108
  351    HG3  PRO 120           HG1      PRO 120   9.356 -10.155  -8.765
  352    HD2  PRO 120           HD2      PRO 120   6.733 -11.409  -8.027
  353    HD3  PRO 120           HD1      PRO 120   7.798 -10.368  -7.056
  Start of MODEL   11
    1    H    PHE  12           H        PHE  12 -12.099  -8.530  -0.315
    2    HA   PHE  12           HA       PHE  12 -13.345  -6.808  -1.500
    3    HB2  PHE  12           HB2      PHE  12 -13.882  -5.472   0.484
    4    HB3  PHE  12           HB1      PHE  12 -13.684  -7.166   0.912
    5    HD1  PHE  12           HD2      PHE  12 -11.781  -7.899   2.240
    6    HD2  PHE  12           HD1      PHE  12 -12.334  -3.795   1.253
    7    HE1  PHE  12           HE2      PHE  12 -10.153  -7.265   3.971
    8    HE2  PHE  12           HE1      PHE  12 -10.705  -3.156   2.984
    9    HZ   PHE  12           HZ       PHE  12  -9.613  -4.893   4.346
   10    H    LEU  13           HN       LEU  13 -10.165  -6.336  -1.610
   11    HA   LEU  13           HA       LEU  13 -10.088  -3.446  -1.498
   12    HB2  LEU  13           HB2      LEU  13  -8.046  -5.557  -2.125
   13    HB3  LEU  13           HB1      LEU  13  -7.712  -3.854  -2.367
   14    HG   LEU  13           HG       LEU  13  -8.414  -5.138   0.257
   15   HD11  LEU  13          HD11      LEU  13  -6.084  -4.679   0.844
   16   HD12  LEU  13          HD12      LEU  13  -5.799  -4.098  -0.795
   17   HD13  LEU  13          HD13      LEU  13  -6.211  -5.790  -0.521
   18   HD21  LEU  13          HD21      LEU  13  -9.193  -2.830   0.128
   19   HD22  LEU  13          HD22      LEU  13  -7.588  -2.315  -0.388
   20   HD23  LEU  13          HD23      LEU  13  -7.823  -2.974   1.229
   21    HA   PRO  14           HA       PRO  14 -10.395  -2.390  -5.886
   22    HB2  PRO  14           HB2      PRO  14  -8.153  -0.784  -4.730
   23    HB3  PRO  14           HB1      PRO  14  -9.281  -0.332  -6.017
   24    HG2  PRO  14           HG2      PRO  14  -9.803   0.472  -3.718
   25    HG3  PRO  14           HG1      PRO  14 -11.107  -0.402  -4.492
   26    HD2  PRO  14           HD2      PRO  14  -9.172  -1.376  -2.388
   27    HD3  PRO  14           HD1      PRO  14 -10.933  -1.634  -2.479
   28    H    LYS  15           HN       LYS  15  -9.203  -2.493  -7.562
   29    HA   LYS  15           HA       LYS  15  -7.696  -4.908  -7.695
   30    HB2  LYS  15           HB2      LYS  15  -9.038  -4.242  -9.589
   31    HB3  LYS  15           HB1      LYS  15  -8.115  -2.756  -9.776
   32    HG2  LYS  15           HG2      LYS  15  -7.525  -4.482 -11.434
   33    HG3  LYS  15           HG1      LYS  15  -6.158  -3.990 -10.432
   34    HD2  LYS  15           HD2      LYS  15  -6.663  -5.997  -8.978
   35    HD3  LYS  15           HD1      LYS  15  -7.782  -6.520 -10.239
   36    HE2  LYS  15           HE2      LYS  15  -5.993  -6.636 -11.846
   37    HE3  LYS  15           HE1      LYS  15  -4.857  -5.948 -10.686
   38    HZ1  LYS  15           HZ1      LYS  15  -6.223  -8.578 -10.444
   39    HZ2  LYS  15           HZ2      LYS  15  -5.171  -7.912  -9.290
   40    HZ3  LYS  15           HZ3      LYS  15  -4.589  -8.329 -10.826
   41    H    GLY  16           HN       GLY  16  -5.625  -5.240  -7.265
   42    HA2  GLY  16           HA2      GLY  16  -3.334  -4.949  -7.465
   43    HA3  GLY  16           HA1      GLY  16  -3.610  -3.374  -8.187
   44    H    TRP  17           HN       TRP  17  -5.384  -3.657  -5.345
   45    HA   TRP  17           HA       TRP  17  -3.417  -2.051  -3.930
   46    HB2  TRP  17           HB2      TRP  17  -6.333  -2.631  -3.464
   47    HB3  TRP  17           HB1      TRP  17  -5.327  -1.992  -2.166
   48    HD1  TRP  17           HD1      TRP  17  -6.315  -1.006  -5.801
   49    HE1  TRP  17           HE1      TRP  17  -6.273   1.559  -5.952
   50    HE3  TRP  17           HE3      TRP  17  -4.603   0.064  -1.091
   51    HZ2  TRP  17           HZ2      TRP  17  -5.610   3.751  -4.292
   52    HZ3  TRP  17           HZ3      TRP  17  -4.295   2.419  -0.459
   53    HH2  TRP  17           HH2      TRP  17  -4.787   4.225  -2.027
   54    H    GLU  18           HN       GLU  18  -2.460  -2.562  -2.064
   55    HA   GLU  18           HA       GLU  18  -2.691  -5.349  -1.155
   56    HB2  GLU  18           HB2      GLU  18  -0.526  -4.131  -2.468
   57    HB3  GLU  18           HB1      GLU  18  -0.028  -4.374  -0.819
   58    HG2  GLU  18           HG2      GLU  18  -1.280  -6.604  -2.350
   59    HG3  GLU  18           HG1      GLU  18   0.413  -6.189  -2.615
   60    H    VAL  19           HN       VAL  19  -2.207  -5.688   0.915
   61    HA   VAL  19           HA       VAL  19  -1.695  -3.396   2.674
   62    HB   VAL  19           HB       VAL  19  -3.563  -5.629   3.475
   63   HG11  VAL  19          HG11      VAL  19  -3.010  -2.940   4.717
   64   HG12  VAL  19          HG12      VAL  19  -2.388  -4.486   5.292
   65   HG13  VAL  19          HG13      VAL  19  -4.123  -4.162   5.335
   66   HG21  VAL  19          HG21      VAL  19  -5.418  -4.059   3.206
   67   HG22  VAL  19          HG22      VAL  19  -4.622  -4.386   1.666
   68   HG23  VAL  19          HG23      VAL  19  -4.312  -2.872   2.517
   69    H    ARG  20           HN       ARG  20   0.459  -4.015   2.861
   70    HA   ARG  20           HA       ARG  20   0.866  -6.651   4.104
   71    HB2  ARG  20           HB2      ARG  20   1.863  -6.194   1.751
   72    HB3  ARG  20           HB1      ARG  20   3.011  -5.171   2.617
   73    HG2  ARG  20           HG2      ARG  20   3.667  -7.100   3.999
   74    HG3  ARG  20           HG1      ARG  20   2.567  -8.114   3.064
   75    HD2  ARG  20           HD2      ARG  20   4.962  -6.619   2.050
   76    HD3  ARG  20           HD1      ARG  20   4.811  -8.366   2.217
   77    HE   ARG  20           HE       ARG  20   2.734  -7.574   0.561
   78   HH11  ARG  20          HH11      ARG  20   6.249  -7.508   0.434
   79   HH12  ARG  20          HH12      ARG  20   6.281  -7.534  -1.298
   80   HH21  ARG  20          HH21      ARG  20   2.772  -7.580  -1.629
   81   HH22  ARG  20          HH22      ARG  20   4.279  -7.524  -2.504
   82    H    HIS  21           HN       HIS  21   2.295  -6.790   5.832
   83    HA   HIS  21           HA       HIS  21   2.702  -4.246   7.243
   84    HB2  HIS  21           HB2      HIS  21   2.457  -7.085   8.081
   85    HB3  HIS  21           HB1      HIS  21   3.565  -6.093   9.010
   86    HD1  HIS  21           HD1      HIS  21   0.998  -7.389  10.163
   87    HD2  HIS  21           HD2      HIS  21   1.239  -3.380   8.904
   88    HE1  HIS  21           HE1      HIS  21  -0.674  -6.106  11.521
   89    HE2  HIS  21           HE2      HIS  21  -0.457  -3.733  10.817
   90    H    ALA  22           HN       ALA  22   4.609  -3.299   7.019
   91    HA   ALA  22           HA       ALA  22   6.938  -4.612   6.041
   92    HB1  ALA  22           HB1      ALA  22   6.547  -2.224   5.699
   93    HB2  ALA  22           HB2      ALA  22   8.069  -2.495   6.553
   94    HB3  ALA  22           HB3      ALA  22   6.642  -1.951   7.440
   95    HA   PRO  23           HA       PRO  23   8.835  -6.338   9.629
   96    HB2  PRO  23           HB2      PRO  23  11.311  -5.100   9.747
   97    HB3  PRO  23           HB1      PRO  23  10.915  -6.497   8.744
   98    HG2  PRO  23           HG2      PRO  23  11.036  -3.606   8.004
   99    HG3  PRO  23           HG1      PRO  23  11.562  -5.024   7.079
  100    HD2  PRO  23           HD2      PRO  23   9.269  -3.768   6.509
  101    HD3  PRO  23           HD1      PRO  23   9.402  -5.537   6.397
  102    H    ASN  24           HN       ASN  24   8.357  -2.963   9.489
  103    HA   ASN  24           HA       ASN  24   9.165  -2.420  12.201
  104    HB2  ASN  24           HB2      ASN  24   8.082  -0.175  11.783
  105    HB3  ASN  24           HB1      ASN  24   9.426  -0.570  10.719
  106   HD21  ASN  24          HD21      ASN  24   8.726   0.889   9.182
  107   HD22  ASN  24          HD22      ASN  24   7.358   0.589   8.172
  108    H    GLY  25           HN       GLY  25   6.491  -3.701  10.599
  109    HA2  GLY  25           HA2      GLY  25   4.782  -4.819  11.789
  110    HA3  GLY  25           HA1      GLY  25   5.042  -3.708  13.118
  111    H    ARG  26           HN       ARG  26   4.813  -2.416   9.927
  112    HA   ARG  26           HA       ARG  26   2.075  -1.488  10.529
  113    HB2  ARG  26           HB2      ARG  26   4.447  -0.006   9.383
  114    HB3  ARG  26           HB1      ARG  26   2.810   0.583   9.155
  115    HG2  ARG  26           HG2      ARG  26   4.141   0.127  11.816
  116    HG3  ARG  26           HG1      ARG  26   3.973   1.687  11.008
  117    HD2  ARG  26           HD2      ARG  26   1.707  -0.092  11.906
  118    HD3  ARG  26           HD1      ARG  26   2.266   1.360  12.734
  119    HE   ARG  26           HE       ARG  26   1.680   2.314  10.299
  120   HH11  ARG  26          HH11      ARG  26  -0.114   0.205  12.437
  121   HH12  ARG  26          HH12      ARG  26  -1.670   0.788  11.925
  122   HH21  ARG  26          HH21      ARG  26  -0.407   3.088   9.607
  123   HH22  ARG  26          HH22      ARG  26  -1.834   2.403  10.325
  124    HA   PRO  27           HA       PRO  27   1.169  -2.916   6.389
  125    HB2  PRO  27           HB2      PRO  27  -1.373  -2.124   6.250
  126    HB3  PRO  27           HB1      PRO  27  -0.905  -3.383   7.397
  127    HG2  PRO  27           HG2      PRO  27  -1.293  -0.440   7.895
  128    HG3  PRO  27           HG1      PRO  27  -1.939  -1.815   8.817
  129    HD2  PRO  27           HD2      PRO  27   0.320  -0.546   9.572
  130    HD3  PRO  27           HD1      PRO  27   0.070  -2.228   9.858
  131    H    PHE  28           HN       PHE  28   1.944  -1.942   4.729
  132    HA   PHE  28           HA       PHE  28   1.175   0.815   4.125
  133    HB2  PHE  28           HB2      PHE  28   3.154   0.834   2.622
  134    HB3  PHE  28           HB1      PHE  28   3.578   0.557   4.302
  135    HD1  PHE  28           HD1      PHE  28   3.630  -2.112   4.898
  136    HD2  PHE  28           HD2      PHE  28   4.319  -0.377   1.071
  137    HE1  PHE  28           HE1      PHE  28   4.958  -4.072   4.247
  138    HE2  PHE  28           HE2      PHE  28   5.623  -2.350   0.415
  139    HZ   PHE  28           HZ       PHE  28   5.950  -4.200   2.003
  140    H    PHE  29           HN       PHE  29  -0.185   1.134   2.514
  141    HA   PHE  29           HA       PHE  29  -1.124  -1.216   1.089
  142    HB2  PHE  29           HB2      PHE  29  -2.278   1.586   1.113
  143    HB3  PHE  29           HB1      PHE  29  -3.023   0.145   0.423
  144    HD1  PHE  29           HD1      PHE  29  -1.646   1.292   3.711
  145    HD2  PHE  29           HD2      PHE  29  -4.645  -0.883   1.625
  146    HE1  PHE  29           HE1      PHE  29  -2.780   0.820   5.842
  147    HE2  PHE  29           HE2      PHE  29  -5.782  -1.360   3.750
  148    HZ   PHE  29           HZ       PHE  29  -4.853  -0.516   5.861
  149    H    ILE  30           HN       ILE  30  -0.304  -1.674  -0.785
  150    HA   ILE  30           HA       ILE  30   1.051   0.435  -2.288
  151    HB   ILE  30           HB       ILE  30   1.150  -2.515  -2.903
  152   HG12  ILE  30          HG12      ILE  30   3.144  -0.992  -1.275
  153   HG13  ILE  30          HG11      ILE  30   1.857  -1.921  -0.519
  154   HG21  ILE  30          HG21      ILE  30   3.006  -0.208  -3.516
  155   HG22  ILE  30          HG22      ILE  30   1.917  -0.995  -4.658
  156   HG23  ILE  30          HG23      ILE  30   3.274  -1.890  -3.975
  157   HD11  ILE  30          HD11      ILE  30   3.926  -3.180  -0.562
  158   HD12  ILE  30          HD12      ILE  30   4.022  -2.998  -2.314
  159   HD13  ILE  30          HD13      ILE  30   2.718  -3.945  -1.595
  160    H    ASP  31           HN       ASP  31   0.368   1.136  -4.139
  161    HA   ASP  31           HA       ASP  31  -1.878  -0.193  -5.477
  162    HB2  ASP  31           HB2      ASP  31  -2.394   2.074  -5.416
  163    HB3  ASP  31           HB1      ASP  31  -0.719   2.568  -5.636
  164    H    HIS  32           HN       HIS  32  -1.305  -1.711  -6.790
  165    HA   HIS  32           HA       HIS  32   1.378  -1.820  -7.860
  166    HB2  HIS  32           HB2      HIS  32  -0.896  -3.826  -7.918
  167    HB3  HIS  32           HB1      HIS  32   0.724  -4.145  -8.510
  168    HD1  HIS  32           HD1      HIS  32   1.098  -6.057  -6.728
  169    HD2  HIS  32           HD2      HIS  32   0.322  -2.319  -5.092
  170    HE1  HIS  32           HE1      HIS  32   1.635  -6.227  -4.250
  171    HE2  HIS  32           HE2      HIS  32   0.989  -4.022  -3.300
  172    H    ASN  33           HN       ASN  33  -1.364  -0.384  -8.854
  173    HA   ASN  33           HA       ASN  33  -1.202  -1.133 -11.669
  174    HB2  ASN  33           HB2      ASN  33  -2.931   1.031 -10.467
  175    HB3  ASN  33           HB1      ASN  33  -3.141   0.217 -12.015
  176   HD21  ASN  33          HD21      ASN  33  -3.636   0.102  -8.624
  177   HD22  ASN  33          HD22      ASN  33  -4.628  -1.328  -8.607
  178    H    THR  34           HN       THR  34  -1.309   1.991  -9.960
  179    HA   THR  34           HA       THR  34   0.215   3.244 -12.097
  180    HB   THR  34           HB       THR  34  -0.781   4.532  -9.547
  181    HG1  THR  34           HG1      THR  34  -2.207   3.465 -11.589
  182   HG21  THR  34          HG21      THR  34   0.800   5.863 -10.874
  183   HG22  THR  34          HG22      THR  34  -0.816   6.568 -10.908
  184   HG23  THR  34          HG23      THR  34  -0.222   5.658 -12.296
  185    H    LYS  35           HN       LYS  35   0.832   1.577  -9.314
  186    HA   LYS  35           HA       LYS  35   2.778   0.929  -8.352
  187    HB2  LYS  35           HB2      LYS  35   4.216   2.930 -10.100
  188    HB3  LYS  35           HB1      LYS  35   4.914   1.551  -9.272
  189    HG2  LYS  35           HG2      LYS  35   3.088   1.541 -11.660
  190    HG3  LYS  35           HG1      LYS  35   4.756   0.978 -11.563
  191    HD2  LYS  35           HD2      LYS  35   3.992  -0.788  -9.976
  192    HD3  LYS  35           HD1      LYS  35   2.334  -0.264 -10.258
  193    HE2  LYS  35           HE2      LYS  35   2.847  -2.190 -11.633
  194    HE3  LYS  35           HE1      LYS  35   2.603  -0.769 -12.648
  195    HZ1  LYS  35           HZ1      LYS  35   4.545  -2.185 -13.259
  196    HZ2  LYS  35           HZ2      LYS  35   5.282  -1.727 -11.801
  197    HZ3  LYS  35           HZ3      LYS  35   4.923  -0.556 -12.979
  198    H    THR  36           HN       THR  36   1.119   2.979  -7.292
  199    HA   THR  36           HA       THR  36   3.044   4.846  -6.067
  200    HB   THR  36           HB       THR  36   1.039   6.138  -5.341
  201    HG1  THR  36           HG1      THR  36  -0.356   4.270  -7.001
  202   HG21  THR  36          HG21      THR  36   2.233   6.746  -7.384
  203   HG22  THR  36          HG22      THR  36   0.502   7.039  -7.558
  204   HG23  THR  36          HG23      THR  36   1.237   5.621  -8.309
  205    H    THR  37           HN       THR  37   3.051   5.143  -3.756
  206    HA   THR  37           HA       THR  37   1.828   2.888  -2.312
  207    HB   THR  37           HB       THR  37   3.809   3.094  -0.739
  208    HG1  THR  37           HG1      THR  37   5.639   4.119  -1.570
  209   HG21  THR  37          HG21      THR  37   5.256   1.739  -2.178
  210   HG22  THR  37          HG22      THR  37   4.316   2.229  -3.587
  211   HG23  THR  37          HG23      THR  37   3.570   1.253  -2.322
  212    H    THR  38           HN       THR  38   0.921   3.256  -0.324
  213    HA   THR  38           HA       THR  38   1.105   5.872   0.918
  214    HB   THR  38           HB       THR  38  -0.733   6.204  -0.654
  215    HG1  THR  38           HG1      THR  38  -2.472   6.405   1.113
  216   HG21  THR  38          HG21      THR  38  -2.038   3.841   0.696
  217   HG22  THR  38          HG22      THR  38  -1.414   3.874  -0.953
  218   HG23  THR  38          HG23      THR  38  -2.791   4.884  -0.509
  219    H    TRP  39           HN       TRP  39   0.430   5.841   3.146
  220    HA   TRP  39           HA       TRP  39   0.460   3.166   4.323
  221    HB2  TRP  39           HB2      TRP  39   0.366   5.869   5.670
  222    HB3  TRP  39           HB1      TRP  39   0.597   4.327   6.477
  223    HD1  TRP  39           HD1      TRP  39   2.410   7.027   4.630
  224    HE1  TRP  39           HE1      TRP  39   4.956   6.538   4.696
  225    HE3  TRP  39           HE3      TRP  39   2.249   2.279   6.470
  226    HZ2  TRP  39           HZ2      TRP  39   6.653   4.381   5.454
  227    HZ3  TRP  39           HZ3      TRP  39   4.349   1.066   6.845
  228    HH2  TRP  39           HH2      TRP  39   6.501   2.091   6.349
  229    H    GLU  40           HN       GLU  40  -1.850   5.378   3.304
  230    HA   GLU  40           HA       GLU  40  -3.573   4.857   5.594
  231    HB2  GLU  40           HB2      GLU  40  -4.820   6.880   4.823
  232    HB3  GLU  40           HB1      GLU  40  -3.151   7.150   5.319
  233    HG2  GLU  40           HG2      GLU  40  -3.432   8.466   3.455
  234    HG3  GLU  40           HG1      GLU  40  -2.559   7.059   2.865
  235    H    ASP  41           HN       ASP  41  -5.940   4.841   5.125
  236    HA   ASP  41           HA       ASP  41  -6.179   2.435   3.511
  237    HB2  ASP  41           HB2      ASP  41  -7.993   3.653   5.598
  238    HB3  ASP  41           HB1      ASP  41  -8.365   2.176   4.721
  239    HA   PRO  42           HA       PRO  42  -8.529   4.404   0.296
  240    HB2  PRO  42           HB2      PRO  42  -9.625   2.124  -0.753
  241    HB3  PRO  42           HB1      PRO  42  -7.989   2.690  -1.105
  242    HG2  PRO  42           HG2      PRO  42  -8.900   0.572   0.785
  243    HG3  PRO  42           HG1      PRO  42  -7.467   0.607  -0.254
  244    HD2  PRO  42           HD2      PRO  42  -7.373   1.112   2.417
  245    HD3  PRO  42           HD1      PRO  42  -6.248   1.843   1.257
  246    H    ARG  43           HN       ARG  43  -9.788   2.656   2.940
  247    HA   ARG  43           HA       ARG  43 -12.561   2.911   2.267
  248    HB2  ARG  43           HB2      ARG  43 -11.089   2.221   4.789
  249    HB3  ARG  43           HB1      ARG  43 -12.822   2.513   4.809
  250    HG2  ARG  43           HG2      ARG  43 -11.391   0.413   3.191
  251    HG3  ARG  43           HG1      ARG  43 -12.357   0.145   4.645
  252    HD2  ARG  43           HD2      ARG  43 -14.331   1.015   3.494
  253    HD3  ARG  43           HD1      ARG  43 -13.368   1.282   2.043
  254    HE   ARG  43           HE       ARG  43 -13.750  -1.415   3.183
  255   HH11  ARG  43          HH11      ARG  43 -13.869   0.830   0.492
  256   HH12  ARG  43          HH12      ARG  43 -14.298  -0.390  -0.673
  257   HH21  ARG  43          HH21      ARG  43 -14.322  -3.013   1.656
  258   HH22  ARG  43          HH22      ARG  43 -14.569  -2.577  -0.011
  259    H    LEU  44           HN       LEU  44 -10.201   5.080   3.299
  260    HA   LEU  44           HA       LEU  44 -11.973   6.896   4.649
  261    HB2  LEU  44           HB2      LEU  44  -9.178   7.293   3.584
  262    HB3  LEU  44           HB1      LEU  44 -10.049   8.464   4.557
  263    HG   LEU  44           HG       LEU  44  -9.284   5.695   5.495
  264   HD11  LEU  44          HD11      LEU  44  -7.309   7.074   5.111
  265   HD12  LEU  44          HD12      LEU  44  -7.586   6.825   6.836
  266   HD13  LEU  44          HD13      LEU  44  -8.013   8.365   6.087
  267   HD21  LEU  44          HD21      LEU  44 -10.386   8.082   6.980
  268   HD22  LEU  44          HD22      LEU  44  -9.882   6.555   7.707
  269   HD23  LEU  44          HD23      LEU  44 -11.262   6.596   6.610
  270    H    LYS  45           HN       LYS  45 -11.573   5.986   1.573
  271    HA   LYS  45           HA       LYS  45 -12.168   8.622   0.414
  272    HB2  LYS  45           HB2      LYS  45 -10.943   6.229  -0.973
  273    HB3  LYS  45           HB1      LYS  45 -11.106   7.860  -1.621
  274    HG2  LYS  45           HG2      LYS  45  -9.492   8.718  -0.142
  275    HG3  LYS  45           HG1      LYS  45  -9.524   7.266   0.855
  276    HD2  LYS  45           HD2      LYS  45  -8.619   6.011  -1.121
  277    HD3  LYS  45           HD1      LYS  45  -8.385   7.575  -1.913
  278    HE2  LYS  45           HE2      LYS  45  -6.945   8.302  -0.099
  279    HE3  LYS  45           HE1      LYS  45  -7.220   6.785   0.755
  280    HZ1  LYS  45           HZ1      LYS  45  -6.198   5.668  -1.211
  281    HZ2  LYS  45           HZ2      LYS  45  -5.143   6.631  -0.300
  282    HZ3  LYS  45           HZ3      LYS  45  -5.752   7.200  -1.783
  283    H    GLN 112           H        GLN 112   9.196   8.392   6.762
  284    HA   GLN 112           HA       GLN 112   7.636   6.567   7.147
  285    HB2  GLN 112           HB2      GLN 112   5.609   8.794   6.873
  286    HB3  GLN 112           HB1      GLN 112   5.221   7.081   6.806
  287    HG2  GLN 112           HG2      GLN 112   5.893   6.775   9.078
  288    HG3  GLN 112           HG1      GLN 112   6.510   8.424   9.165
  289   HE21  GLN 112          HE21      GLN 112   5.084  10.125   9.339
  290   HE22  GLN 112          HE22      GLN 112   3.426   9.908   9.784
  291    H    ILE 113           HN       ILE 113   8.744   5.999   5.289
  292    HA   ILE 113           HA       ILE 113   7.622   7.024   2.762
  293    HB   ILE 113           HB       ILE 113  10.274   5.661   3.264
  294   HG12  ILE 113          HG12      ILE 113  10.245   7.970   4.065
  295   HG13  ILE 113          HG11      ILE 113  11.254   7.831   2.630
  296   HG21  ILE 113          HG21      ILE 113  10.766   6.136   0.908
  297   HG22  ILE 113          HG22      ILE 113   9.124   6.745   0.693
  298   HG23  ILE 113          HG23      ILE 113   9.392   5.047   1.088
  299   HD11  ILE 113          HD11      ILE 113   8.439   8.897   2.710
  300   HD12  ILE 113          HD12      ILE 113   9.449   8.756   1.272
  301   HD13  ILE 113          HD13      ILE 113   9.915   9.853   2.572
  302    HA   PRO 114           HA       PRO 114   5.854   2.852   2.797
  303    HB2  PRO 114           HB2      PRO 114   4.450   3.594   0.377
  304    HB3  PRO 114           HB1      PRO 114   3.793   3.233   1.972
  305    HG2  PRO 114           HG2      PRO 114   3.778   5.726   0.846
  306    HG3  PRO 114           HG1      PRO 114   3.754   5.424   2.591
  307    HD2  PRO 114           HD2      PRO 114   6.015   6.267   0.844
  308    HD3  PRO 114           HD1      PRO 114   5.649   6.705   2.525
  309    HA   PRO 115           HA       PRO 115   8.737   1.318  -0.383
  310    HB2  PRO 115           HB2      PRO 115   7.942  -1.288   0.723
  311    HB3  PRO 115           HB1      PRO 115   9.545  -0.570   0.591
  312    HG2  PRO 115           HG2      PRO 115   8.296  -0.857   2.952
  313    HG3  PRO 115           HG1      PRO 115   9.385   0.500   2.611
  314    HD2  PRO 115           HD2      PRO 115   6.396   0.429   2.657
  315    HD3  PRO 115           HD1      PRO 115   7.519   1.692   3.210
  316    HA   PRO 116           HA       PRO 116   5.788   0.085  -3.566
  317    HB2  PRO 116           HB2      PRO 116   7.871  -1.280  -4.902
  318    HB3  PRO 116           HB1      PRO 116   7.298   0.362  -5.234
  319    HG2  PRO 116           HG2      PRO 116   9.514  -0.549  -3.454
  320    HG3  PRO 116           HG1      PRO 116   9.468   0.826  -4.589
  321    HD2  PRO 116           HD2      PRO 116   9.071   1.350  -2.130
  322    HD3  PRO 116           HD1      PRO 116   7.890   1.954  -3.270
  323    H    TYR 117           HN       TYR 117   5.835  -1.562  -4.776
  324    HA   TYR 117           HA       TYR 117   5.053  -3.975  -3.341
  325    HB2  TYR 117           HB2      TYR 117   4.129  -4.752  -5.485
  326    HB3  TYR 117           HB1      TYR 117   3.582  -3.124  -5.105
  327    HD1  TYR 117           HD2      TYR 117   4.783  -1.178  -6.247
  328    HD2  TYR 117           HD1      TYR 117   5.156  -5.220  -7.514
  329    HE1  TYR 117           HE2      TYR 117   5.574  -0.412  -8.423
  330    HE2  TYR 117           HE1      TYR 117   5.954  -4.468  -9.708
  331    HH   TYR 117           HH       TYR 117   7.071  -1.408 -10.287
  332    H    VAL 118           HN       VAL 118   6.081  -5.900  -3.318
  333    HA   VAL 118           HA       VAL 118   8.737  -5.949  -4.603
  334    HB   VAL 118           HB       VAL 118   8.017  -7.459  -2.087
  335   HG11  VAL 118          HG11      VAL 118  10.445  -7.487  -1.740
  336   HG12  VAL 118          HG12      VAL 118  10.668  -6.615  -3.258
  337   HG13  VAL 118          HG13      VAL 118   9.993  -8.244  -3.267
  338   HG21  VAL 118          HG21      VAL 118   7.645  -5.094  -1.634
  339   HG22  VAL 118          HG22      VAL 118   9.247  -4.707  -2.263
  340   HG23  VAL 118          HG23      VAL 118   9.085  -5.669  -0.795
  341    H    GLU 119           HN       GLU 119   6.425  -6.829  -5.924
  342    HA   GLU 119           HA       GLU 119   6.973  -9.719  -6.081
  343    HB2  GLU 119           HB2      GLU 119   4.451  -8.616  -7.233
  344    HB3  GLU 119           HB1      GLU 119   4.772 -10.209  -6.584
  345    HG2  GLU 119           HG2      GLU 119   3.258  -9.252  -5.097
  346    HG3  GLU 119           HG1      GLU 119   4.814  -9.072  -4.281
  347    HA   PRO 120           HA       PRO 120   8.733  -8.500 -10.028
  348    HB2  PRO 120           HB2      PRO 120   8.618 -11.432 -10.462
  349    HB3  PRO 120           HB1      PRO 120   9.990 -10.326 -10.600
  350    HG2  PRO 120           HG2      PRO 120   9.784 -12.006  -8.534
  351    HG3  PRO 120           HG1      PRO 120  10.420 -10.362  -8.325
  352    HD2  PRO 120           HD2      PRO 120   7.719 -11.453  -7.637
  353    HD3  PRO 120           HD1      PRO 120   8.726 -10.288  -6.751
  Start of MODEL   12
    1    H    PHE  12           H        PHE  12 -11.585  -7.240  -1.691
    2    HA   PHE  12           HA       PHE  12 -13.644  -6.083  -1.848
    3    HB2  PHE  12           HB2      PHE  12 -14.693  -5.011   0.028
    4    HB3  PHE  12           HB1      PHE  12 -14.414  -6.691   0.457
    5    HD1  PHE  12           HD1      PHE  12 -12.330  -7.193   1.890
    6    HD2  PHE  12           HD2      PHE  12 -13.993  -3.310   1.419
    7    HE1  PHE  12           HE1      PHE  12 -11.229  -6.476   3.971
    8    HE2  PHE  12           HE2      PHE  12 -12.893  -2.581   3.495
    9    HZ   PHE  12           HZ       PHE  12 -11.510  -4.166   4.775
   10    H    LEU  13           HN       LEU  13 -10.540  -5.711  -1.499
   11    HA   LEU  13           HA       LEU  13 -10.574  -2.771  -1.602
   12    HB2  LEU  13           HB2      LEU  13  -8.464  -4.790  -0.985
   13    HB3  LEU  13           HB1      LEU  13  -7.972  -3.282  -1.731
   14    HG   LEU  13           HG       LEU  13  -9.122  -2.080   0.162
   15   HD11  LEU  13          HD11      LEU  13  -9.540  -3.323   2.207
   16   HD12  LEU  13          HD12      LEU  13  -9.160  -4.833   1.382
   17   HD13  LEU  13          HD13      LEU  13 -10.574  -3.896   0.898
   18   HD21  LEU  13          HD21      LEU  13  -6.706  -2.343   0.068
   19   HD22  LEU  13          HD22      LEU  13  -6.836  -3.922   0.845
   20   HD23  LEU  13          HD23      LEU  13  -7.284  -2.464   1.729
   21    HA   PRO  14           HA       PRO  14 -10.051  -2.470  -5.983
   22    HB2  PRO  14           HB2      PRO  14  -7.653  -0.910  -5.140
   23    HB3  PRO  14           HB1      PRO  14  -8.784  -0.587  -6.461
   24    HG2  PRO  14           HG2      PRO  14  -9.131   0.659  -4.321
   25    HG3  PRO  14           HG1      PRO  14 -10.545  -0.175  -4.927
   26    HD2  PRO  14           HD2      PRO  14  -8.674  -1.004  -2.712
   27    HD3  PRO  14           HD1      PRO  14 -10.456  -1.045  -2.732
   28    H    LYS  15           HN       LYS  15  -8.906  -2.955  -7.603
   29    HA   LYS  15           HA       LYS  15  -7.591  -5.485  -7.313
   30    HB2  LYS  15           HB2      LYS  15  -9.012  -5.094  -9.234
   31    HB3  LYS  15           HB1      LYS  15  -8.004  -3.749  -9.751
   32    HG2  LYS  15           HG2      LYS  15  -6.153  -5.285 -10.165
   33    HG3  LYS  15           HG1      LYS  15  -7.154  -6.638  -9.637
   34    HD2  LYS  15           HD2      LYS  15  -7.837  -4.824 -11.947
   35    HD3  LYS  15           HD1      LYS  15  -7.007  -6.371 -12.116
   36    HE2  LYS  15           HE2      LYS  15  -9.745  -5.986 -10.906
   37    HE3  LYS  15           HE1      LYS  15  -9.430  -6.533 -12.553
   38    HZ1  LYS  15           HZ1      LYS  15  -8.658  -7.935 -10.050
   39    HZ2  LYS  15           HZ2      LYS  15  -8.223  -8.438 -11.608
   40    HZ3  LYS  15           HZ3      LYS  15  -9.856  -8.414 -11.151
   41    H    GLY  16           HN       GLY  16  -5.535  -5.837  -6.877
   42    HA2  GLY  16           HA2      GLY  16  -3.234  -5.725  -7.315
   43    HA3  GLY  16           HA1      GLY  16  -3.470  -4.195  -8.144
   44    H    TRP  17           HN       TRP  17  -5.196  -3.950  -5.362
   45    HA   TRP  17           HA       TRP  17  -3.046  -2.478  -4.074
   46    HB2  TRP  17           HB2      TRP  17  -6.014  -2.623  -3.626
   47    HB3  TRP  17           HB1      TRP  17  -4.945  -1.873  -2.443
   48    HD1  TRP  17           HD1      TRP  17  -5.882  -1.475  -6.199
   49    HE1  TRP  17           HE1      TRP  17  -5.654   1.013  -6.788
   50    HE3  TRP  17           HE3      TRP  17  -4.012   0.272  -1.760
   51    HZ2  TRP  17           HZ2      TRP  17  -4.783   3.396  -5.567
   52    HZ3  TRP  17           HZ3      TRP  17  -3.505   2.672  -1.565
   53    HH2  TRP  17           HH2      TRP  17  -3.882   4.201  -3.431
   54    H    GLU  18           HN       GLU  18  -1.781  -3.418  -2.716
   55    HA   GLU  18           HA       GLU  18  -2.673  -5.826  -1.299
   56    HB2  GLU  18           HB2      GLU  18  -0.142  -4.938  -2.418
   57    HB3  GLU  18           HB1      GLU  18   0.015  -5.595  -0.816
   58    HG2  GLU  18           HG2      GLU  18  -1.430  -7.537  -1.798
   59    HG3  GLU  18           HG1      GLU  18  -0.821  -6.923  -3.337
   60    H    VAL  19           HN       VAL  19  -2.327  -6.092   0.812
   61    HA   VAL  19           HA       VAL  19  -1.559  -3.748   2.425
   62    HB   VAL  19           HB       VAL  19  -3.345  -5.982   3.392
   63   HG11  VAL  19          HG11      VAL  19  -2.827  -3.216   4.475
   64   HG12  VAL  19          HG12      VAL  19  -2.164  -4.718   5.117
   65   HG13  VAL  19          HG13      VAL  19  -3.902  -4.423   5.180
   66   HG21  VAL  19          HG21      VAL  19  -4.201  -3.305   2.298
   67   HG22  VAL  19          HG22      VAL  19  -5.255  -4.481   3.086
   68   HG23  VAL  19          HG23      VAL  19  -4.485  -4.876   1.550
   69    H    ARG  20           HN       ARG  20   0.546  -4.185   2.918
   70    HA   ARG  20           HA       ARG  20   1.085  -6.841   4.077
   71    HB2  ARG  20           HB2      ARG  20   2.063  -6.380   1.735
   72    HB3  ARG  20           HB1      ARG  20   3.141  -5.256   2.553
   73    HG2  ARG  20           HG2      ARG  20   3.953  -7.087   3.975
   74    HG3  ARG  20           HG1      ARG  20   2.909  -8.211   3.097
   75    HD2  ARG  20           HD2      ARG  20   5.171  -6.590   1.977
   76    HD3  ARG  20           HD1      ARG  20   5.162  -8.331   2.233
   77    HE   ARG  20           HE       ARG  20   3.202  -7.136   0.397
   78   HH11  ARG  20          HH11      ARG  20   6.020  -9.184   0.877
   79   HH12  ARG  20          HH12      ARG  20   5.883  -9.924  -0.698
   80   HH21  ARG  20          HH21      ARG  20   3.039  -8.098  -1.655
   81   HH22  ARG  20          HH22      ARG  20   4.201  -9.314  -2.116
   82    H    HIS  21           HN       HIS  21   2.574  -6.886   5.800
   83    HA   HIS  21           HA       HIS  21   2.716  -4.313   7.228
   84    HB2  HIS  21           HB2      HIS  21   2.346  -7.089   8.030
   85    HB3  HIS  21           HB1      HIS  21   3.659  -6.339   8.912
   86    HD1  HIS  21           HD1      HIS  21   1.488  -7.250  10.569
   87    HD2  HIS  21           HD2      HIS  21   1.283  -3.412   8.835
   88    HE1  HIS  21           HE1      HIS  21  -0.075  -5.905  11.996
   89    HE2  HIS  21           HE2      HIS  21  -0.384  -3.746  10.778
   90    H    ALA  22           HN       ALA  22   4.595  -3.263   7.087
   91    HA   ALA  22           HA       ALA  22   7.035  -4.498   6.248
   92    HB1  ALA  22           HB1      ALA  22   8.034  -2.305   6.691
   93    HB2  ALA  22           HB2      ALA  22   6.551  -1.785   7.491
   94    HB3  ALA  22           HB3      ALA  22   6.542  -2.147   5.767
   95    HA   PRO  23           HA       PRO  23   8.724  -6.007  10.017
   96    HB2  PRO  23           HB2      PRO  23  11.176  -4.388   9.640
   97    HB3  PRO  23           HB1      PRO  23  10.991  -6.138   9.793
   98    HG2  PRO  23           HG2      PRO  23  11.540  -5.025   7.434
   99    HG3  PRO  23           HG1      PRO  23  10.437  -6.409   7.560
  100    HD2  PRO  23           HD2      PRO  23   9.802  -3.505   7.196
  101    HD3  PRO  23           HD1      PRO  23   9.049  -4.925   6.443
  102    H    ASN  24           HN       ASN  24   8.317  -2.649   9.643
  103    HA   ASN  24           HA       ASN  24   9.104  -1.943  12.323
  104    HB2  ASN  24           HB2      ASN  24   8.040   0.279  11.752
  105    HB3  ASN  24           HB1      ASN  24   9.400  -0.189  10.741
  106   HD21  ASN  24          HD21      ASN  24   8.762   1.162   9.093
  107   HD22  ASN  24          HD22      ASN  24   7.400   0.805   8.081
  108    H    GLY  25           HN       GLY  25   6.473  -3.364  10.809
  109    HA2  GLY  25           HA2      GLY  25   4.774  -4.394  12.120
  110    HA3  GLY  25           HA1      GLY  25   4.947  -3.089  13.274
  111    H    ARG  26           HN       ARG  26   4.911  -1.910  10.129
  112    HA   ARG  26           HA       ARG  26   2.080  -1.146  10.441
  113    HB2  ARG  26           HB2      ARG  26   4.421   0.274   9.154
  114    HB3  ARG  26           HB1      ARG  26   2.760   0.787   8.906
  115    HG2  ARG  26           HG2      ARG  26   4.176   0.646  11.562
  116    HG3  ARG  26           HG1      ARG  26   3.897   2.111  10.620
  117    HD2  ARG  26           HD2      ARG  26   1.799   0.318  11.840
  118    HD3  ARG  26           HD1      ARG  26   2.247   1.933  12.384
  119    HE   ARG  26           HE       ARG  26   1.211   1.632   9.663
  120   HH11  ARG  26          HH11      ARG  26   0.760   2.767  12.950
  121   HH12  ARG  26          HH12      ARG  26  -0.686   3.665  12.572
  122   HH21  ARG  26          HH21      ARG  26  -0.654   2.821   9.159
  123   HH22  ARG  26          HH22      ARG  26  -1.485   3.711  10.408
  124    HA   PRO  27           HA       PRO  27   1.438  -3.035   6.409
  125    HB2  PRO  27           HB2      PRO  27  -1.168  -2.497   6.155
  126    HB3  PRO  27           HB1      PRO  27  -0.616  -3.664   7.363
  127    HG2  PRO  27           HG2      PRO  27  -1.348  -0.775   7.726
  128    HG3  PRO  27           HG1      PRO  27  -1.823  -2.176   8.707
  129    HD2  PRO  27           HD2      PRO  27   0.249  -0.573   9.383
  130    HD3  PRO  27           HD1      PRO  27   0.179  -2.230   9.826
  131    H    PHE  28           HN       PHE  28   2.284  -1.977   4.787
  132    HA   PHE  28           HA       PHE  28   1.275   0.661   4.057
  133    HB2  PHE  28           HB2      PHE  28   3.259   0.794   2.581
  134    HB3  PHE  28           HB1      PHE  28   3.699   0.534   4.257
  135    HD1  PHE  28           HD2      PHE  28   3.696  -2.229   4.748
  136    HD2  PHE  28           HD1      PHE  28   4.714  -0.240   1.122
  137    HE1  PHE  28           HE2      PHE  28   5.089  -4.142   4.093
  138    HE2  PHE  28           HE1      PHE  28   6.099  -2.159   0.465
  139    HZ   PHE  28           HZ       PHE  28   6.295  -4.111   1.952
  140    H    PHE  29           HN       PHE  29  -0.066   0.872   2.436
  141    HA   PHE  29           HA       PHE  29  -0.931  -1.548   1.080
  142    HB2  PHE  29           HB2      PHE  29  -2.154   1.227   1.061
  143    HB3  PHE  29           HB1      PHE  29  -2.870  -0.230   0.378
  144    HD1  PHE  29           HD2      PHE  29  -1.546   1.020   3.643
  145    HD2  PHE  29           HD1      PHE  29  -4.427  -1.350   1.606
  146    HE1  PHE  29           HE2      PHE  29  -2.651   0.532   5.784
  147    HE2  PHE  29           HE1      PHE  29  -5.541  -1.839   3.744
  148    HZ   PHE  29           HZ       PHE  29  -4.646  -0.905   5.837
  149    H    ILE  30           HN       ILE  30  -0.216  -2.027  -0.841
  150    HA   ILE  30           HA       ILE  30   1.117   0.080  -2.392
  151    HB   ILE  30           HB       ILE  30   1.396  -2.880  -2.873
  152   HG12  ILE  30          HG12      ILE  30   3.266  -1.153  -1.295
  153   HG13  ILE  30          HG11      ILE  30   2.085  -2.204  -0.532
  154   HG21  ILE  30          HG21      ILE  30   3.471  -2.172  -3.983
  155   HG22  ILE  30          HG22      ILE  30   3.090  -0.492  -3.608
  156   HG23  ILE  30          HG23      ILE  30   2.050  -1.410  -4.698
  157   HD11  ILE  30          HD11      ILE  30   4.354  -3.059  -2.316
  158   HD12  ILE  30          HD12      ILE  30   3.152  -4.134  -1.600
  159   HD13  ILE  30          HD13      ILE  30   4.268  -3.245  -0.564
  160    H    ASP  31           HN       ASP  31   0.385   0.676  -4.259
  161    HA   ASP  31           HA       ASP  31  -1.722  -0.832  -5.608
  162    HB2  ASP  31           HB2      ASP  31  -2.173   1.458  -5.819
  163    HB3  ASP  31           HB1      ASP  31  -0.476   1.869  -6.057
  164    H    HIS  32           HN       HIS  32  -1.189  -2.407  -6.899
  165    HA   HIS  32           HA       HIS  32   1.589  -2.616  -7.763
  166    HB2  HIS  32           HB2      HIS  32  -0.664  -4.616  -7.555
  167    HB3  HIS  32           HB1      HIS  32   0.868  -5.005  -8.322
  168    HD1  HIS  32           HD1      HIS  32   1.936  -6.571  -6.633
  169    HD2  HIS  32           HD2      HIS  32   0.417  -3.117  -4.867
  170    HE1  HIS  32           HE1      HIS  32   2.694  -6.602  -4.217
  171    HE2  HIS  32           HE2      HIS  32   1.524  -4.680  -3.150
  172    H    ASN  33           HN       ASN  33  -1.028  -1.218  -9.014
  173    HA   ASN  33           HA       ASN  33  -0.775  -2.264 -11.725
  174    HB2  ASN  33           HB2      ASN  33  -2.459   0.058 -10.762
  175    HB3  ASN  33           HB1      ASN  33  -2.576  -0.752 -12.319
  176   HD21  ASN  33          HD21      ASN  33  -3.331  -0.844  -8.973
  177   HD22  ASN  33          HD22      ASN  33  -4.404  -2.217  -9.038
  178    H    THR  34           HN       THR  34  -0.585   0.962 -10.198
  179    HA   THR  34           HA       THR  34   1.140   1.809 -12.443
  180    HB   THR  34           HB       THR  34  -0.418   3.682 -10.669
  181    HG1  THR  34           HG1      THR  34  -1.645   1.890 -11.918
  182   HG21  THR  34          HG21      THR  34  -0.327   5.143 -12.627
  183   HG22  THR  34          HG22      THR  34   0.509   3.891 -13.541
  184   HG23  THR  34          HG23      THR  34   1.298   4.646 -12.156
  185    H    LYS  35           HN       LYS  35   1.344   0.815  -9.389
  186    HA   LYS  35           HA       LYS  35   2.861   0.921  -7.732
  187    HB2  LYS  35           HB2      LYS  35   4.489   0.999  -9.679
  188    HB3  LYS  35           HB1      LYS  35   4.534   2.738  -9.467
  189    HG2  LYS  35           HG2      LYS  35   5.153   0.935  -7.169
  190    HG3  LYS  35           HG1      LYS  35   6.368   1.254  -8.404
  191    HD2  LYS  35           HD2      LYS  35   4.940   3.375  -6.796
  192    HD3  LYS  35           HD1      LYS  35   6.554   2.753  -6.445
  193    HE2  LYS  35           HE2      LYS  35   5.722   4.149  -8.991
  194    HE3  LYS  35           HE1      LYS  35   6.632   4.882  -7.671
  195    HZ1  LYS  35           HZ1      LYS  35   8.384   3.210  -8.060
  196    HZ2  LYS  35           HZ2      LYS  35   8.132   4.222  -9.393
  197    HZ3  LYS  35           HZ3      LYS  35   7.526   2.638  -9.408
  198    H    THR  36           HN       THR  36   1.547   1.926  -6.351
  199    HA   THR  36           HA       THR  36   2.202   4.711  -5.723
  200    HB   THR  36           HB       THR  36  -0.618   3.813  -5.342
  201    HG1  THR  36           HG1      THR  36  -0.273   3.413  -7.573
  202   HG21  THR  36          HG21      THR  36   0.109   5.914  -4.364
  203   HG22  THR  36          HG22      THR  36  -1.062   6.213  -5.648
  204   HG23  THR  36          HG23      THR  36   0.655   6.480  -5.942
  205    H    THR  37           HN       THR  37   1.933   5.141  -3.425
  206    HA   THR  37           HA       THR  37   1.497   2.747  -1.810
  207    HB   THR  37           HB       THR  37   3.565   3.475  -0.443
  208    HG1  THR  37           HG1      THR  37   5.109   4.594  -1.583
  209   HG21  THR  37          HG21      THR  37   3.855   2.181  -3.153
  210   HG22  THR  37          HG22      THR  37   3.403   1.369  -1.654
  211   HG23  THR  37          HG23      THR  37   5.016   2.061  -1.831
  212    H    THR  38           HN       THR  38   0.544   3.067   0.096
  213    HA   THR  38           HA       THR  38   0.475   5.702   1.324
  214    HB   THR  38           HB       THR  38  -1.397   5.670  -0.334
  215    HG1  THR  38           HG1      THR  38  -1.503   6.382   2.213
  216   HG21  THR  38          HG21      THR  38  -2.491   3.458   1.402
  217   HG22  THR  38          HG22      THR  38  -1.925   3.290  -0.260
  218   HG23  THR  38          HG23      THR  38  -3.352   4.266   0.092
  219    H    TRP  39           HN       TRP  39  -0.129   5.577   3.587
  220    HA   TRP  39           HA       TRP  39   0.087   2.874   4.709
  221    HB2  TRP  39           HB2      TRP  39  -0.192   5.494   6.185
  222    HB3  TRP  39           HB1      TRP  39   0.277   3.946   6.866
  223    HD1  TRP  39           HD1      TRP  39   1.630   7.014   5.251
  224    HE1  TRP  39           HE1      TRP  39   4.219   6.852   5.162
  225    HE3  TRP  39           HE3      TRP  39   2.166   2.079   6.439
  226    HZ2  TRP  39           HZ2      TRP  39   6.206   4.850   5.540
  227    HZ3  TRP  39           HZ3      TRP  39   4.420   1.115   6.562
  228    HH2  TRP  39           HH2      TRP  39   6.392   2.468   6.121
  229    H    GLU  40           HN       GLU  40  -2.196   5.158   3.853
  230    HA   GLU  40           HA       GLU  40  -4.082   4.349   5.923
  231    HB2  GLU  40           HB2      GLU  40  -5.261   6.521   5.042
  232    HB3  GLU  40           HB1      GLU  40  -3.882   6.626   6.130
  233    HG2  GLU  40           HG2      GLU  40  -3.530   6.759   3.172
  234    HG3  GLU  40           HG1      GLU  40  -3.956   8.186   4.109
  235    H    ASP  41           HN       ASP  41  -5.894   3.399   5.474
  236    HA   ASP  41           HA       ASP  41  -6.057   1.727   3.287
  237    HB2  ASP  41           HB2      ASP  41  -8.430   2.591   4.939
  238    HB3  ASP  41           HB1      ASP  41  -8.195   1.049   4.127
  239    HA   PRO  42           HA       PRO  42  -7.749   4.358   0.098
  240    HB2  PRO  42           HB2      PRO  42  -8.345   2.412  -1.693
  241    HB3  PRO  42           HB1      PRO  42  -6.690   2.966  -1.404
  242    HG2  PRO  42           HG2      PRO  42  -8.102   0.567  -0.282
  243    HG3  PRO  42           HG1      PRO  42  -6.475   0.676  -0.979
  244    HD2  PRO  42           HD2      PRO  42  -6.874   0.677   1.684
  245    HD3  PRO  42           HD1      PRO  42  -5.586   1.648   0.939
  246    H    ARG  43           HN       ARG  43  -9.385   2.000   1.898
  247    HA   ARG  43           HA       ARG  43 -11.947   2.232   0.627
  248    HB2  ARG  43           HB2      ARG  43 -11.394   0.206   1.827
  249    HB3  ARG  43           HB1      ARG  43 -11.090   1.115   3.300
  250    HG2  ARG  43           HG2      ARG  43 -13.214  -0.049   3.375
  251    HG3  ARG  43           HG1      ARG  43 -13.437   1.691   3.461
  252    HD2  ARG  43           HD2      ARG  43 -15.082   0.590   1.981
  253    HD3  ARG  43           HD1      ARG  43 -14.088   1.777   1.142
  254    HE   ARG  43           HE       ARG  43 -13.417  -1.082   0.986
  255   HH11  ARG  43          HH11      ARG  43 -14.371   1.914  -0.538
  256   HH12  ARG  43          HH12      ARG  43 -14.131   1.332  -2.159
  257   HH21  ARG  43          HH21      ARG  43 -13.126  -1.883  -1.158
  258   HH22  ARG  43          HH22      ARG  43 -13.451  -0.834  -2.510
  259    H    LEU  44           HN       LEU  44 -10.177   3.903   3.053
  260    HA   LEU  44           HA       LEU  44 -12.334   5.386   4.136
  261    HB2  LEU  44           HB2      LEU  44  -9.405   6.084   4.078
  262    HB3  LEU  44           HB1      LEU  44 -10.611   6.877   5.069
  263    HG   LEU  44           HG       LEU  44  -9.756   3.994   5.319
  264   HD11  LEU  44          HD11      LEU  44  -8.035   5.538   6.061
  265   HD12  LEU  44          HD12      LEU  44  -8.771   4.721   7.439
  266   HD13  LEU  44          HD13      LEU  44  -9.209   6.388   7.064
  267   HD21  LEU  44          HD21      LEU  44 -12.095   4.292   5.917
  268   HD22  LEU  44          HD22      LEU  44 -11.663   5.630   6.983
  269   HD23  LEU  44          HD23      LEU  44 -11.116   3.995   7.352
  270    H    LYS  45           HN       LYS  45 -10.923   5.410   1.216
  271    HA   LYS  45           HA       LYS  45 -11.456   8.223   0.639
  272    HB2  LYS  45           HB2      LYS  45 -10.130   6.023  -0.940
  273    HB3  LYS  45           HB1      LYS  45 -10.564   7.561  -1.667
  274    HG2  LYS  45           HG2      LYS  45  -8.739   7.254   0.706
  275    HG3  LYS  45           HG1      LYS  45  -8.198   7.422  -0.965
  276    HD2  LYS  45           HD2      LYS  45  -9.422   9.589  -1.072
  277    HD3  LYS  45           HD1      LYS  45  -9.775   9.424   0.649
  278    HE2  LYS  45           HE2      LYS  45  -7.013   9.513  -0.556
  279    HE3  LYS  45           HE1      LYS  45  -7.835  10.882   0.187
  280    HZ1  LYS  45           HZ1      LYS  45  -7.902   9.669   2.275
  281    HZ2  LYS  45           HZ2      LYS  45  -6.307   9.839   1.729
  282    HZ3  LYS  45           HZ3      LYS  45  -7.102   8.356   1.563
  283    H    GLN 112           H        GLN 112   8.159   6.443   8.405
  284    HA   GLN 112           HA       GLN 112   7.171   7.806   6.668
  285    HB2  GLN 112           HB2      GLN 112  10.185   8.028   6.824
  286    HB3  GLN 112           HB1      GLN 112   9.085   9.309   6.335
  287    HG2  GLN 112           HG2      GLN 112   9.091   8.001   9.043
  288    HG3  GLN 112           HG1      GLN 112   9.894   9.522   8.657
  289   HE21  GLN 112          HE21      GLN 112   7.801  10.425   6.867
  290   HE22  GLN 112          HE22      GLN 112   6.472  10.890   7.874
  291    H    ILE 113           HN       ILE 113   6.659   7.938   4.587
  292    HA   ILE 113           HA       ILE 113   6.653   7.629   2.335
  293    HB   ILE 113           HB       ILE 113   9.587   6.948   2.638
  294   HG12  ILE 113          HG12      ILE 113   8.231   9.530   1.817
  295   HG13  ILE 113          HG11      ILE 113   9.049   9.240   3.349
  296   HG21  ILE 113          HG21      ILE 113   8.668   6.015   0.587
  297   HG22  ILE 113          HG22      ILE 113   9.729   7.375   0.220
  298   HG23  ILE 113          HG23      ILE 113   7.979   7.582   0.163
  299   HD11  ILE 113          HD11      ILE 113  10.347   9.227   0.636
  300   HD12  ILE 113          HD12      ILE 113  11.159   8.956   2.177
  301   HD13  ILE 113          HD13      ILE 113  10.437  10.525   1.827
  302    HA   PRO 114           HA       PRO 114   5.892   3.181   2.740
  303    HB2  PRO 114           HB2      PRO 114   3.957   3.626   0.597
  304    HB3  PRO 114           HB1      PRO 114   3.685   3.056   2.245
  305    HG2  PRO 114           HG2      PRO 114   2.885   5.495   1.374
  306    HG3  PRO 114           HG1      PRO 114   3.330   5.162   3.058
  307    HD2  PRO 114           HD2      PRO 114   4.904   6.516   0.908
  308    HD3  PRO 114           HD1      PRO 114   4.800   6.881   2.644
  309    HA   PRO 115           HA       PRO 115   8.398   2.244  -0.858
  310    HB2  PRO 115           HB2      PRO 115   9.082  -0.239  -0.131
  311    HB3  PRO 115           HB1      PRO 115   9.730   1.173   0.700
  312    HG2  PRO 115           HG2      PRO 115   7.533  -0.662   1.540
  313    HG3  PRO 115           HG1      PRO 115   8.835   0.047   2.512
  314    HD2  PRO 115           HD2      PRO 115   6.259   1.027   2.399
  315    HD3  PRO 115           HD1      PRO 115   7.679   1.988   2.848
  316    HA   PRO 116           HA       PRO 116   5.466   0.298  -3.645
  317    HB2  PRO 116           HB2      PRO 116   7.585  -0.591  -5.294
  318    HB3  PRO 116           HB1      PRO 116   6.644   0.896  -5.487
  319    HG2  PRO 116           HG2      PRO 116   9.219   0.452  -4.045
  320    HG3  PRO 116           HG1      PRO 116   8.740   1.793  -5.121
  321    HD2  PRO 116           HD2      PRO 116   8.579   2.219  -2.623
  322    HD3  PRO 116           HD1      PRO 116   7.154   2.561  -3.572
  323    H    TYR 117           HN       TYR 117   5.687  -1.288  -4.934
  324    HA   TYR 117           HA       TYR 117   5.431  -3.755  -3.476
  325    HB2  TYR 117           HB2      TYR 117   4.434  -4.720  -5.416
  326    HB3  TYR 117           HB1      TYR 117   3.847  -3.071  -5.287
  327    HD1  TYR 117           HD1      TYR 117   4.789  -1.315  -6.869
  328    HD2  TYR 117           HD2      TYR 117   5.543  -5.484  -7.328
  329    HE1  TYR 117           HE1      TYR 117   5.416  -0.944  -9.215
  330    HE2  TYR 117           HE2      TYR 117   6.181  -5.121  -9.670
  331    HH   TYR 117           HH       TYR 117   6.869  -2.127 -10.957
  332    H    VAL 118           HN       VAL 118   7.035  -5.149  -3.076
  333    HA   VAL 118           HA       VAL 118   9.475  -5.109  -4.599
  334    HB   VAL 118           HB       VAL 118   9.450  -5.514  -2.145
  335   HG11  VAL 118          HG11      VAL 118   8.799  -7.715  -1.285
  336   HG12  VAL 118          HG12      VAL 118   8.188  -8.150  -2.882
  337   HG13  VAL 118          HG13      VAL 118   7.432  -6.840  -1.975
  338   HG21  VAL 118          HG21      VAL 118  10.607  -7.750  -3.803
  339   HG22  VAL 118          HG22      VAL 118  11.057  -7.382  -2.139
  340   HG23  VAL 118          HG23      VAL 118  11.378  -6.211  -3.416
  341    H    GLU 119           HN       GLU 119   6.484  -6.602  -4.835
  342    HA   GLU 119           HA       GLU 119   7.386  -8.275  -7.021
  343    HB2  GLU 119           HB2      GLU 119   6.116 -10.237  -6.141
  344    HB3  GLU 119           HB1      GLU 119   7.530  -9.825  -5.181
  345    HG2  GLU 119           HG2      GLU 119   6.132  -8.739  -3.529
  346    HG3  GLU 119           HG1      GLU 119   4.696  -9.063  -4.498
  347    HA   PRO 120           HA       PRO 120   3.629  -6.586  -8.706
  348    HB2  PRO 120           HB2      PRO 120   3.315  -8.455 -10.702
  349    HB3  PRO 120           HB1      PRO 120   4.367  -7.042 -10.810
  350    HG2  PRO 120           HG2      PRO 120   5.056  -9.875 -10.150
  351    HG3  PRO 120           HG1      PRO 120   5.938  -8.712 -11.159
  352    HD2  PRO 120           HD2      PRO 120   6.703  -9.270  -8.645
  353    HD3  PRO 120           HD1      PRO 120   6.862  -7.637  -9.327
  Start of MODEL   13
    1    H    PHE  12           H        PHE  12 -11.890  -5.568   0.844
    2    HA   PHE  12           HA       PHE  12 -13.544  -5.796  -1.597
    3    HB2  PHE  12           HB2      PHE  12 -15.078  -4.248  -0.600
    4    HB3  PHE  12           HB1      PHE  12 -14.832  -5.558   0.543
    5    HD1  PHE  12           HD2      PHE  12 -13.190  -5.148   2.473
    6    HD2  PHE  12           HD1      PHE  12 -14.772  -2.040   0.032
    7    HE1  PHE  12           HE2      PHE  12 -12.657  -3.504   4.222
    8    HE2  PHE  12           HE1      PHE  12 -14.242  -0.393   1.778
    9    HZ   PHE  12           HZ       PHE  12 -13.184  -1.126   3.876
   10    H    LEU  13           HN       LEU  13 -10.657  -4.893  -0.733
   11    HA   LEU  13           HA       LEU  13 -10.635  -2.120  -1.515
   12    HB2  LEU  13           HB2      LEU  13  -8.567  -4.145  -0.764
   13    HB3  LEU  13           HB1      LEU  13  -8.064  -2.718  -1.646
   14    HG   LEU  13           HG       LEU  13  -9.016  -1.305   0.150
   15   HD11  LEU  13          HD11      LEU  13  -9.608  -2.311   2.292
   16   HD12  LEU  13          HD12      LEU  13  -9.408  -3.921   1.600
   17   HD13  LEU  13          HD13      LEU  13 -10.690  -2.862   1.013
   18   HD21  LEU  13          HD21      LEU  13  -6.655  -1.854   0.134
   19   HD22  LEU  13          HD22      LEU  13  -6.974  -3.336   1.034
   20   HD23  LEU  13          HD23      LEU  13  -7.258  -1.766   1.789
   21    HA   PRO  14           HA       PRO  14 -10.221  -2.326  -5.924
   22    HB2  PRO  14           HB2      PRO  14  -7.852  -0.644  -5.252
   23    HB3  PRO  14           HB1      PRO  14  -8.991  -0.481  -6.596
   24    HG2  PRO  14           HG2      PRO  14  -9.354   0.973  -4.592
   25    HG3  PRO  14           HG1      PRO  14 -10.755   0.062  -5.121
   26    HD2  PRO  14           HD2      PRO  14  -8.901  -0.505  -2.807
   27    HD3  PRO  14           HD1      PRO  14 -10.679  -0.585  -2.855
   28    H    LYS  15           HN       LYS  15  -9.070  -2.968  -7.474
   29    HA   LYS  15           HA       LYS  15  -7.609  -5.372  -6.921
   30    HB2  LYS  15           HB2      LYS  15  -8.136  -3.983  -9.556
   31    HB3  LYS  15           HB1      LYS  15  -7.366  -5.555  -9.404
   32    HG2  LYS  15           HG2      LYS  15  -9.600  -5.999  -9.943
   33    HG3  LYS  15           HG1      LYS  15  -9.475  -6.308  -8.208
   34    HD2  LYS  15           HD2      LYS  15 -10.493  -4.225  -7.684
   35    HD3  LYS  15           HD1      LYS  15 -10.394  -3.692  -9.359
   36    HE2  LYS  15           HE2      LYS  15 -11.941  -5.578  -9.951
   37    HE3  LYS  15           HE1      LYS  15 -12.139  -5.869  -8.223
   38    HZ1  LYS  15           HZ1      LYS  15 -12.945  -3.572  -7.999
   39    HZ2  LYS  15           HZ2      LYS  15 -13.924  -4.496  -9.028
   40    HZ3  LYS  15           HZ3      LYS  15 -12.831  -3.375  -9.680
   41    H    GLY  16           HN       GLY  16  -5.515  -5.806  -7.058
   42    HA2  GLY  16           HA2      GLY  16  -3.242  -5.502  -7.354
   43    HA3  GLY  16           HA1      GLY  16  -3.568  -4.022  -8.237
   44    H    TRP  17           HN       TRP  17  -5.242  -3.682  -5.441
   45    HA   TRP  17           HA       TRP  17  -3.079  -2.180  -4.202
   46    HB2  TRP  17           HB2      TRP  17  -6.050  -2.307  -3.664
   47    HB3  TRP  17           HB1      TRP  17  -4.935  -1.507  -2.564
   48    HD1  TRP  17           HD1      TRP  17  -6.066  -1.249  -6.271
   49    HE1  TRP  17           HE1      TRP  17  -5.845   1.215  -6.980
   50    HE3  TRP  17           HE3      TRP  17  -3.939   0.642  -2.018
   51    HZ2  TRP  17           HZ2      TRP  17  -4.889   3.639  -5.887
   52    HZ3  TRP  17           HZ3      TRP  17  -3.402   3.040  -1.933
   53    HH2  TRP  17           HH2      TRP  17  -3.867   4.507  -3.829
   54    H    GLU  18           HN       GLU  18  -1.752  -3.337  -3.076
   55    HA   GLU  18           HA       GLU  18  -2.693  -5.712  -1.665
   56    HB2  GLU  18           HB2      GLU  18  -0.019  -4.756  -2.597
   57    HB3  GLU  18           HB1      GLU  18  -0.130  -6.000  -1.366
   58    HG2  GLU  18           HG2      GLU  18  -0.983  -6.093  -4.222
   59    HG3  GLU  18           HG1      GLU  18   0.077  -7.174  -3.324
   60    H    VAL  19           HN       VAL  19  -2.297  -6.104   0.436
   61    HA   VAL  19           HA       VAL  19  -1.594  -3.768   2.094
   62    HB   VAL  19           HB       VAL  19  -3.411  -5.997   2.996
   63   HG11  VAL  19          HG11      VAL  19  -2.378  -4.688   4.753
   64   HG12  VAL  19          HG12      VAL  19  -4.114  -4.379   4.681
   65   HG13  VAL  19          HG13      VAL  19  -2.980  -3.202   4.020
   66   HG21  VAL  19          HG21      VAL  19  -4.241  -3.374   1.772
   67   HG22  VAL  19          HG22      VAL  19  -5.320  -4.540   2.532
   68   HG23  VAL  19          HG23      VAL  19  -4.457  -4.968   1.054
   69    H    ARG  20           HN       ARG  20   0.597  -4.347   2.328
   70    HA   ARG  20           HA       ARG  20   1.074  -6.956   3.601
   71    HB2  ARG  20           HB2      ARG  20   2.371  -6.364   1.489
   72    HB3  ARG  20           HB1      ARG  20   3.182  -5.127   2.449
   73    HG2  ARG  20           HG2      ARG  20   3.589  -7.188   4.070
   74    HG3  ARG  20           HG1      ARG  20   3.435  -8.076   2.556
   75    HD2  ARG  20           HD2      ARG  20   5.288  -5.738   2.928
   76    HD3  ARG  20           HD1      ARG  20   5.772  -7.403   3.222
   77    HE   ARG  20           HE       ARG  20   4.901  -6.401   0.585
   78   HH11  ARG  20          HH11      ARG  20   6.871  -8.480   2.598
   79   HH12  ARG  20          HH12      ARG  20   7.815  -9.091   1.267
   80   HH21  ARG  20          HH21      ARG  20   6.167  -7.201  -1.184
   81   HH22  ARG  20          HH22      ARG  20   7.413  -8.369  -0.854
   82    H    HIS  21           HN       HIS  21   1.800  -7.067   5.646
   83    HA   HIS  21           HA       HIS  21   2.158  -4.570   7.134
   84    HB2  HIS  21           HB2      HIS  21   0.987  -6.989   7.779
   85    HB3  HIS  21           HB1      HIS  21   2.566  -7.123   8.539
   86    HD1  HIS  21           HD1      HIS  21   1.573  -7.179  10.832
   87    HD2  HIS  21           HD2      HIS  21   0.715  -3.589   8.795
   88    HE1  HIS  21           HE1      HIS  21   0.533  -5.647  12.533
   89    HE2  HIS  21           HE2      HIS  21   0.044  -3.509  11.301
   90    H    ALA  22           HN       ALA  22   4.158  -3.741   6.947
   91    HA   ALA  22           HA       ALA  22   6.456  -5.188   6.194
   92    HB1  ALA  22           HB1      ALA  22   6.198  -2.786   5.812
   93    HB2  ALA  22           HB2      ALA  22   7.676  -3.131   6.714
   94    HB3  ALA  22           HB3      ALA  22   6.259  -2.498   7.552
   95    HA   PRO  23           HA       PRO  23   8.139  -6.981   9.846
   96    HB2  PRO  23           HB2      PRO  23  10.670  -5.871  10.055
   97    HB3  PRO  23           HB1      PRO  23  10.238  -7.243   9.029
   98    HG2  PRO  23           HG2      PRO  23  10.519  -4.355   8.315
   99    HG3  PRO  23           HG1      PRO  23  11.019  -5.789   7.400
  100    HD2  PRO  23           HD2      PRO  23   8.809  -4.433   6.749
  101    HD3  PRO  23           HD1      PRO  23   8.861  -6.205   6.640
  102    H    ASN  24           HN       ASN  24   7.993  -3.539   9.695
  103    HA   ASN  24           HA       ASN  24   8.638  -3.125  12.478
  104    HB2  ASN  24           HB2      ASN  24   8.145  -0.793  12.101
  105    HB3  ASN  24           HB1      ASN  24   9.115  -1.374  10.755
  106   HD21  ASN  24          HD21      ASN  24   7.414   0.934  10.834
  107   HD22  ASN  24          HD22      ASN  24   6.212   0.711   9.614
  108    H    GLY  25           HN       GLY  25   6.077  -4.233  10.699
  109    HA2  GLY  25           HA2      GLY  25   4.066  -5.049  11.490
  110    HA3  GLY  25           HA1      GLY  25   4.322  -4.176  12.977
  111    H    ARG  26           HN       ARG  26   4.438  -2.829   9.744
  112    HA   ARG  26           HA       ARG  26   1.861  -1.498  10.241
  113    HB2  ARG  26           HB2      ARG  26   4.383  -0.319   9.065
  114    HB3  ARG  26           HB1      ARG  26   2.801   0.424   8.867
  115    HG2  ARG  26           HG2      ARG  26   4.149  -0.133  11.499
  116    HG3  ARG  26           HG1      ARG  26   4.066   1.437  10.694
  117    HD2  ARG  26           HD2      ARG  26   1.663   1.454  10.878
  118    HD3  ARG  26           HD1      ARG  26   1.665  -0.181  11.537
  119    HE   ARG  26           HE       ARG  26   3.134   1.031  13.356
  120   HH11  ARG  26          HH11      ARG  26   0.224   2.158  11.763
  121   HH12  ARG  26          HH12      ARG  26  -0.324   3.084  13.128
  122   HH21  ARG  26          HH21      ARG  26   2.431   2.250  15.158
  123   HH22  ARG  26          HH22      ARG  26   0.928   3.131  15.072
  124    HA   PRO  27           HA       PRO  27   1.065  -3.225   6.211
  125    HB2  PRO  27           HB2      PRO  27  -1.536  -2.556   6.033
  126    HB3  PRO  27           HB1      PRO  27  -0.993  -3.827   7.125
  127    HG2  PRO  27           HG2      PRO  27  -1.808  -1.035   7.728
  128    HG3  PRO  27           HG1      PRO  27  -2.010  -2.500   8.702
  129    HD2  PRO  27           HD2      PRO  27  -0.013  -0.614   9.028
  130    HD3  PRO  27           HD1      PRO  27  -0.023  -2.157   9.760
  131    H    PHE  28           HN       PHE  28   2.103  -2.075   4.747
  132    HA   PHE  28           HA       PHE  28   1.109   0.560   3.994
  133    HB2  PHE  28           HB2      PHE  28   3.174   0.723   2.616
  134    HB3  PHE  28           HB1      PHE  28   3.505   0.489   4.320
  135    HD1  PHE  28           HD2      PHE  28   3.474  -2.322   4.782
  136    HD2  PHE  28           HD1      PHE  28   4.810  -0.238   1.313
  137    HE1  PHE  28           HE2      PHE  28   4.972  -4.185   4.239
  138    HE2  PHE  28           HE1      PHE  28   6.302  -2.112   0.770
  139    HZ   PHE  28           HZ       PHE  28   6.388  -4.085   2.232
  140    H    PHE  29           HN       PHE  29  -0.108   0.830   2.298
  141    HA   PHE  29           HA       PHE  29  -0.897  -1.551   0.830
  142    HB2  PHE  29           HB2      PHE  29  -2.105   1.229   0.777
  143    HB3  PHE  29           HB1      PHE  29  -2.787  -0.229   0.058
  144    HD1  PHE  29           HD2      PHE  29  -1.675   1.076   3.381
  145    HD2  PHE  29           HD1      PHE  29  -4.357  -1.402   1.203
  146    HE1  PHE  29           HE2      PHE  29  -2.893   0.574   5.458
  147    HE2  PHE  29           HE1      PHE  29  -5.579  -1.906   3.273
  148    HZ   PHE  29           HZ       PHE  29  -4.845  -0.929   5.402
  149    H    ILE  30           HN       ILE  30  -0.069  -1.991  -1.044
  150    HA   ILE  30           HA       ILE  30   1.292   0.153  -2.515
  151    HB   ILE  30           HB       ILE  30   1.620  -2.800  -3.028
  152   HG12  ILE  30          HG12      ILE  30   3.398  -1.082  -1.328
  153   HG13  ILE  30          HG11      ILE  30   2.205  -2.177  -0.650
  154   HG21  ILE  30          HG21      ILE  30   3.732  -2.064  -4.046
  155   HG22  ILE  30          HG22      ILE  30   3.332  -0.391  -3.651
  156   HG23  ILE  30          HG23      ILE  30   2.338  -1.287  -4.799
  157   HD11  ILE  30          HD11      ILE  30   4.562  -2.942  -2.359
  158   HD12  ILE  30          HD12      ILE  30   3.360  -4.055  -1.705
  159   HD13  ILE  30          HD13      ILE  30   4.417  -3.161  -0.614
  160    H    ASP  31           HN       ASP  31   0.674   0.710  -4.452
  161    HA   ASP  31           HA       ASP  31  -1.536  -0.683  -5.748
  162    HB2  ASP  31           HB2      ASP  31  -1.863   1.619  -5.965
  163    HB3  ASP  31           HB1      ASP  31  -0.149   1.939  -6.213
  164    H    HIS  32           HN       HIS  32  -1.152  -2.268  -7.031
  165    HA   HIS  32           HA       HIS  32   1.531  -2.615  -8.163
  166    HB2  HIS  32           HB2      HIS  32  -0.684  -4.565  -7.506
  167    HB3  HIS  32           HB1      HIS  32   0.736  -5.026  -8.421
  168    HD1  HIS  32           HD1      HIS  32   2.136  -6.408  -6.849
  169    HD2  HIS  32           HD2      HIS  32   0.601  -3.009  -4.998
  170    HE1  HIS  32           HE1      HIS  32   3.020  -6.421  -4.471
  171    HE2  HIS  32           HE2      HIS  32   1.925  -4.485  -3.356
  172    H    ASN  33           HN       ASN  33  -1.256  -1.306  -9.123
  173    HA   ASN  33           HA       ASN  33  -1.550  -2.634 -11.694
  174    HB2  ASN  33           HB2      ASN  33  -2.799  -0.017 -10.820
  175    HB3  ASN  33           HB1      ASN  33  -3.309  -1.046 -12.152
  176   HD21  ASN  33          HD21      ASN  33  -3.279  -0.570  -8.730
  177   HD22  ASN  33          HD22      ASN  33  -4.488  -1.776  -8.354
  178    H    THR  34           HN       THR  34  -0.065   0.167 -10.308
  179    HA   THR  34           HA       THR  34   1.325   0.656 -12.835
  180    HB   THR  34           HB       THR  34   0.066   2.824 -11.130
  181    HG1  THR  34           HG1      THR  34  -0.899   1.348 -13.152
  182   HG21  THR  34          HG21      THR  34   1.624   3.023 -13.709
  183   HG22  THR  34          HG22      THR  34   2.185   3.539 -12.118
  184   HG23  THR  34          HG23      THR  34   0.822   4.358 -12.882
  185    H    LYS  35           HN       LYS  35   1.189   2.259  -9.676
  186    HA   LYS  35           HA       LYS  35   3.024   1.066  -8.187
  187    HB2  LYS  35           HB2      LYS  35   5.181   2.131  -8.457
  188    HB3  LYS  35           HB1      LYS  35   4.742   1.261  -9.915
  189    HG2  LYS  35           HG2      LYS  35   4.316   3.257 -11.095
  190    HG3  LYS  35           HG1      LYS  35   4.355   4.223  -9.611
  191    HD2  LYS  35           HD2      LYS  35   6.454   4.551 -10.656
  192    HD3  LYS  35           HD1      LYS  35   6.706   3.433  -9.303
  193    HE2  LYS  35           HE2      LYS  35   6.673   1.544 -10.829
  194    HE3  LYS  35           HE1      LYS  35   6.341   2.615 -12.187
  195    HZ1  LYS  35           HZ1      LYS  35   8.822   2.514 -10.559
  196    HZ2  LYS  35           HZ2      LYS  35   8.503   3.700 -11.728
  197    HZ3  LYS  35           HZ3      LYS  35   8.643   2.070 -12.187
  198    H    THR  36           HN       THR  36   2.148   1.851  -6.508
  199    HA   THR  36           HA       THR  36   2.474   4.642  -5.796
  200    HB   THR  36           HB       THR  36  -0.278   3.575  -5.376
  201    HG1  THR  36           HG1      THR  36  -0.043   3.426  -7.641
  202   HG21  THR  36          HG21      THR  36  -0.850   5.959  -5.394
  203   HG22  THR  36          HG22      THR  36   0.831   6.353  -5.756
  204   HG23  THR  36          HG23      THR  36   0.412   5.602  -4.216
  205    H    THR  37           HN       THR  37   2.290   4.974  -3.520
  206    HA   THR  37           HA       THR  37   1.830   2.593  -1.911
  207    HB   THR  37           HB       THR  37   3.937   3.409  -0.539
  208    HG1  THR  37           HG1      THR  37   5.504   4.300  -1.795
  209   HG21  THR  37          HG21      THR  37   3.608   1.166  -1.435
  210   HG22  THR  37          HG22      THR  37   5.262   1.709  -1.711
  211   HG23  THR  37          HG23      THR  37   4.098   1.719  -3.037
  212    H    THR  38           HN       THR  38   0.790   2.975  -0.066
  213    HA   THR  38           HA       THR  38   0.856   5.603   1.174
  214    HB   THR  38           HB       THR  38  -0.948   5.835  -0.465
  215    HG1  THR  38           HG1      THR  38  -2.722   6.097   1.212
  216   HG21  THR  38          HG21      THR  38  -2.209   3.466   0.921
  217   HG22  THR  38          HG22      THR  38  -1.556   3.483  -0.718
  218   HG23  THR  38          HG23      THR  38  -2.970   4.457  -0.324
  219    H    TRP  39           HN       TRP  39   0.149   5.558   3.374
  220    HA   TRP  39           HA       TRP  39   0.123   2.874   4.534
  221    HB2  TRP  39           HB2      TRP  39   0.084   5.524   5.985
  222    HB3  TRP  39           HB1      TRP  39   0.407   3.943   6.679
  223    HD1  TRP  39           HD1      TRP  39   2.031   6.798   4.873
  224    HE1  TRP  39           HE1      TRP  39   4.584   6.392   4.759
  225    HE3  TRP  39           HE3      TRP  39   2.143   1.959   6.500
  226    HZ2  TRP  39           HZ2      TRP  39   6.392   4.277   5.310
  227    HZ3  TRP  39           HZ3      TRP  39   4.311   0.814   6.685
  228    HH2  TRP  39           HH2      TRP  39   6.390   1.949   6.103
  229    H    GLU  40           HN       GLU  40  -2.067   5.152   3.472
  230    HA   GLU  40           HA       GLU  40  -3.973   4.585   5.605
  231    HB2  GLU  40           HB2      GLU  40  -5.216   6.549   4.785
  232    HB3  GLU  40           HB1      GLU  40  -3.560   6.922   5.257
  233    HG2  GLU  40           HG2      GLU  40  -4.027   8.165   3.324
  234    HG3  GLU  40           HG1      GLU  40  -2.940   6.868   2.845
  235    H    ASP  41           HN       ASP  41  -6.270   4.352   4.930
  236    HA   ASP  41           HA       ASP  41  -6.236   2.149   3.028
  237    HB2  ASP  41           HB2      ASP  41  -8.314   2.962   5.072
  238    HB3  ASP  41           HB1      ASP  41  -8.431   1.558   4.019
  239    HA   PRO  42           HA       PRO  42  -8.309   4.569  -0.116
  240    HB2  PRO  42           HB2      PRO  42  -9.015   2.375  -1.628
  241    HB3  PRO  42           HB1      PRO  42  -7.447   3.186  -1.720
  242    HG2  PRO  42           HG2      PRO  42  -8.221   0.714  -0.223
  243    HG3  PRO  42           HG1      PRO  42  -6.746   1.049  -1.150
  244    HD2  PRO  42           HD2      PRO  42  -6.768   1.169   1.529
  245    HD3  PRO  42           HD1      PRO  42  -5.811   2.314   0.563
  246    H    ARG  43           HN       ARG  43  -9.606   2.323   2.055
  247    HA   ARG  43           HA       ARG  43 -12.215   1.906   1.099
  248    HB2  ARG  43           HB2      ARG  43 -11.686   2.182   4.036
  249    HB3  ARG  43           HB1      ARG  43 -12.719   1.037   3.196
  250    HG2  ARG  43           HG2      ARG  43 -10.797  -0.205   2.436
  251    HG3  ARG  43           HG1      ARG  43  -9.710   0.990   3.152
  252    HD2  ARG  43           HD2      ARG  43 -10.925   0.456   5.357
  253    HD3  ARG  43           HD1      ARG  43 -11.510  -0.982   4.519
  254    HE   ARG  43           HE       ARG  43  -8.626  -0.455   4.598
  255   HH11  ARG  43          HH11      ARG  43 -11.347  -2.378   5.696
  256   HH12  ARG  43          HH12      ARG  43 -10.344  -3.661   6.292
  257   HH21  ARG  43          HH21      ARG  43  -7.328  -2.118   5.388
  258   HH22  ARG  43          HH22      ARG  43  -8.055  -3.530   6.103
  259    H    LEU  44           HN       LEU  44 -10.717   4.632   2.607
  260    HA   LEU  44           HA       LEU  44 -13.177   5.859   3.435
  261    HB2  LEU  44           HB2      LEU  44 -10.427   7.073   3.244
  262    HB3  LEU  44           HB1      LEU  44 -11.798   7.747   4.103
  263    HG   LEU  44           HG       LEU  44 -10.374   5.183   4.823
  264   HD11  LEU  44          HD11      LEU  44  -9.011   7.145   5.271
  265   HD12  LEU  44          HD12      LEU  44  -9.594   6.434   6.776
  266   HD13  LEU  44          HD13      LEU  44 -10.351   7.895   6.141
  267   HD21  LEU  44          HD21      LEU  44 -12.744   5.114   5.399
  268   HD22  LEU  44          HD22      LEU  44 -12.595   6.658   6.236
  269   HD23  LEU  44          HD23      LEU  44 -11.744   5.239   6.846
  270    H    LYS  45           HN       LYS  45 -11.724   5.453   0.574
  271    HA   LYS  45           HA       LYS  45 -12.701   7.993  -0.543
  272    HB2  LYS  45           HB2      LYS  45 -10.342   6.313  -1.421
  273    HB3  LYS  45           HB1      LYS  45 -10.921   7.747  -2.259
  274    HG2  LYS  45           HG2      LYS  45 -10.358   9.146  -0.409
  275    HG3  LYS  45           HG1      LYS  45  -9.984   7.749   0.601
  276    HD2  LYS  45           HD2      LYS  45  -8.094   7.197  -0.816
  277    HD3  LYS  45           HD1      LYS  45  -8.506   8.516  -1.915
  278    HE2  LYS  45           HE2      LYS  45  -6.674   9.139  -0.424
  279    HE3  LYS  45           HE1      LYS  45  -8.098  10.137  -0.148
  280    HZ1  LYS  45           HZ1      LYS  45  -8.634   8.715   1.764
  281    HZ2  LYS  45           HZ2      LYS  45  -7.144   9.493   1.935
  282    HZ3  LYS  45           HZ3      LYS  45  -7.190   7.849   1.525
  283    H    GLN 112           H        GLN 112   7.928   9.896   6.059
  284    HA   GLN 112           HA       GLN 112   8.295   7.634   6.601
  285    HB2  GLN 112           HB2      GLN 112   6.356   6.152   7.138
  286    HB3  GLN 112           HB1      GLN 112   6.752   7.301   8.403
  287    HG2  GLN 112           HG2      GLN 112   4.665   8.064   6.440
  288    HG3  GLN 112           HG1      GLN 112   4.268   6.836   7.638
  289   HE21  GLN 112          HE21      GLN 112   2.755   8.172   8.599
  290   HE22  GLN 112          HE22      GLN 112   3.210   9.523   9.586
  291    H    ILE 113           HN       ILE 113   8.791   7.016   4.625
  292    HA   ILE 113           HA       ILE 113   6.829   7.327   2.475
  293    HB   ILE 113           HB       ILE 113   9.770   6.660   2.335
  294   HG12  ILE 113          HG12      ILE 113   8.262   9.190   1.630
  295   HG13  ILE 113          HG11      ILE 113   9.292   8.973   3.040
  296   HG21  ILE 113          HG21      ILE 113   9.533   6.999  -0.089
  297   HG22  ILE 113          HG22      ILE 113   7.792   7.191   0.115
  298   HG23  ILE 113          HG23      ILE 113   8.557   5.645   0.483
  299   HD11  ILE 113          HD11      ILE 113  10.431  10.215   1.297
  300   HD12  ILE 113          HD12      ILE 113  10.185   8.878   0.171
  301   HD13  ILE 113          HD13      ILE 113  11.220   8.664   1.582
  302    HA   PRO 114           HA       PRO 114   6.122   2.877   2.877
  303    HB2  PRO 114           HB2      PRO 114   4.306   3.092   0.638
  304    HB3  PRO 114           HB1      PRO 114   3.943   2.741   2.327
  305    HG2  PRO 114           HG2      PRO 114   3.259   5.065   1.031
  306    HG3  PRO 114           HG1      PRO 114   3.427   4.900   2.786
  307    HD2  PRO 114           HD2      PRO 114   5.269   6.137   0.813
  308    HD3  PRO 114           HD1      PRO 114   4.981   6.536   2.519
  309    HA   PRO 115           HA       PRO 115   8.921   1.665  -0.517
  310    HB2  PRO 115           HB2      PRO 115   8.411  -0.968   0.744
  311    HB3  PRO 115           HB1      PRO 115   9.941  -0.185   0.364
  312    HG2  PRO 115           HG2      PRO 115   9.098  -0.373   2.880
  313    HG3  PRO 115           HG1      PRO 115   9.935   1.080   2.301
  314    HD2  PRO 115           HD2      PRO 115   7.016   0.636   2.774
  315    HD3  PRO 115           HD1      PRO 115   8.017   2.063   3.117
  316    HA   PRO 116           HA       PRO 116   5.723   0.218  -3.401
  317    HB2  PRO 116           HB2      PRO 116   7.794  -0.544  -5.156
  318    HB3  PRO 116           HB1      PRO 116   6.862   0.960  -5.209
  319    HG2  PRO 116           HG2      PRO 116   9.466   0.387  -3.864
  320    HG3  PRO 116           HG1      PRO 116   8.976   1.815  -4.816
  321    HD2  PRO 116           HD2      PRO 116   8.863   2.035  -2.290
  322    HD3  PRO 116           HD1      PRO 116   7.423   2.459  -3.179
  323    H    TYR 117           HN       TYR 117   5.903  -1.274  -4.798
  324    HA   TYR 117           HA       TYR 117   5.770  -3.871  -3.532
  325    HB2  TYR 117           HB2      TYR 117   4.660  -4.681  -5.465
  326    HB3  TYR 117           HB1      TYR 117   4.083  -3.041  -5.222
  327    HD1  TYR 117           HD1      TYR 117   4.954  -1.210  -6.733
  328    HD2  TYR 117           HD2      TYR 117   5.716  -5.333  -7.454
  329    HE1  TYR 117           HE1      TYR 117   5.516  -0.694  -9.072
  330    HE2  TYR 117           HE2      TYR 117   6.279  -4.833  -9.789
  331    HH   TYR 117           HH       TYR 117   6.790  -1.651 -10.916
  332    H    VAL 118           HN       VAL 118   7.286  -5.413  -3.522
  333    HA   VAL 118           HA       VAL 118   9.519  -5.155  -5.424
  334    HB   VAL 118           HB       VAL 118  10.074  -5.015  -2.974
  335   HG11  VAL 118          HG11      VAL 118   8.450  -6.583  -2.101
  336   HG12  VAL 118          HG12      VAL 118  10.081  -7.087  -1.659
  337   HG13  VAL 118          HG13      VAL 118   9.229  -7.906  -2.968
  338   HG21  VAL 118          HG21      VAL 118  11.990  -6.546  -3.084
  339   HG22  VAL 118          HG22      VAL 118  11.774  -5.643  -4.583
  340   HG23  VAL 118          HG23      VAL 118  11.270  -7.330  -4.488
  341    H    GLU 119           HN       GLU 119   6.728  -6.743  -4.830
  342    HA   GLU 119           HA       GLU 119   7.447  -9.388  -5.691
  343    HB2  GLU 119           HB2      GLU 119   4.689  -8.155  -5.623
  344    HB3  GLU 119           HB1      GLU 119   5.090  -9.863  -5.607
  345    HG2  GLU 119           HG2      GLU 119   4.594  -9.548  -3.410
  346    HG3  GLU 119           HG1      GLU 119   6.323  -9.213  -3.375
  347    HA   PRO 120           HA       PRO 120   6.982  -8.073  -9.976
  348    HB2  PRO 120           HB2      PRO 120   8.930  -9.648 -10.964
  349    HB3  PRO 120           HB1      PRO 120   9.286  -8.157 -10.087
  350    HG2  PRO 120           HG2      PRO 120   9.693 -10.939  -9.258
  351    HG3  PRO 120           HG1      PRO 120  10.400  -9.457  -8.596
  352    HD2  PRO 120           HD2      PRO 120   8.125 -10.993  -7.624
  353    HD3  PRO 120           HD1      PRO 120   8.966  -9.635  -6.847
  Start of MODEL   14
    1    H    PHE  12           H        PHE  12 -11.730  -6.017   1.607
    2    HA   PHE  12           HA       PHE  12 -12.229  -6.349  -0.695
    3    HB2  PHE  12           HB2      PHE  12 -13.825  -4.896  -1.858
    4    HB3  PHE  12           HB1      PHE  12 -14.625  -5.826  -0.600
    5    HD1  PHE  12           HD1      PHE  12 -15.190  -4.673   1.576
    6    HD2  PHE  12           HD2      PHE  12 -13.932  -2.561  -1.897
    7    HE1  PHE  12           HE1      PHE  12 -16.135  -2.599   2.498
    8    HE2  PHE  12           HE2      PHE  12 -14.872  -0.483  -0.979
    9    HZ   PHE  12           HZ       PHE  12 -15.977  -0.500   1.222
   10    H    LEU  13           HN       LEU  13 -10.423  -5.667  -1.537
   11    HA   LEU  13           HA       LEU  13  -9.725  -2.808  -1.293
   12    HB2  LEU  13           HB2      LEU  13  -8.018  -5.262  -1.153
   13    HB3  LEU  13           HB1      LEU  13  -7.342  -3.804  -1.849
   14    HG   LEU  13           HG       LEU  13  -6.683  -3.951   0.457
   15   HD11  LEU  13          HD11      LEU  13  -7.132  -1.724  -0.400
   16   HD12  LEU  13          HD12      LEU  13  -7.542  -1.831   1.311
   17   HD13  LEU  13          HD13      LEU  13  -8.819  -1.857   0.095
   18   HD21  LEU  13          HD21      LEU  13  -9.618  -4.076   1.122
   19   HD22  LEU  13          HD22      LEU  13  -8.301  -3.936   2.284
   20   HD23  LEU  13          HD23      LEU  13  -8.451  -5.388   1.295
   21    HA   PRO  14           HA       PRO  14  -9.902  -2.481  -5.756
   22    HB2  PRO  14           HB2      PRO  14  -7.572  -0.779  -5.002
   23    HB3  PRO  14           HB1      PRO  14  -8.780  -0.512  -6.265
   24    HG2  PRO  14           HG2      PRO  14  -9.113   0.671  -4.094
   25    HG3  PRO  14           HG1      PRO  14 -10.491  -0.257  -4.644
   26    HD2  PRO  14           HD2      PRO  14  -8.454  -0.978  -2.535
   27    HD3  PRO  14           HD1      PRO  14 -10.227  -1.144  -2.470
   28    H    LYS  15           HN       LYS  15  -8.826  -2.885  -7.434
   29    HA   LYS  15           HA       LYS  15  -7.370  -5.322  -7.300
   30    HB2  LYS  15           HB2      LYS  15  -8.864  -4.913  -9.142
   31    HB3  LYS  15           HB1      LYS  15  -7.966  -3.478  -9.613
   32    HG2  LYS  15           HG2      LYS  15  -6.148  -4.755 -10.410
   33    HG3  LYS  15           HG1      LYS  15  -6.756  -6.227  -9.647
   34    HD2  LYS  15           HD2      LYS  15  -7.146  -6.161 -12.095
   35    HD3  LYS  15           HD1      LYS  15  -8.634  -6.297 -11.156
   36    HE2  LYS  15           HE2      LYS  15  -8.873  -3.803 -11.365
   37    HE3  LYS  15           HE1      LYS  15  -7.522  -3.837 -12.500
   38    HZ1  LYS  15           HZ1      LYS  15 -10.040  -5.374 -12.848
   39    HZ2  LYS  15           HZ2      LYS  15  -8.771  -5.228 -13.965
   40    HZ3  LYS  15           HZ3      LYS  15  -9.719  -3.876 -13.582
   41    H    GLY  16           HN       GLY  16  -5.273  -5.679  -7.090
   42    HA2  GLY  16           HA2      GLY  16  -2.989  -5.425  -7.431
   43    HA3  GLY  16           HA1      GLY  16  -3.278  -3.879  -8.208
   44    H    TRP  17           HN       TRP  17  -5.000  -3.751  -5.418
   45    HA   TRP  17           HA       TRP  17  -2.869  -2.290  -4.079
   46    HB2  TRP  17           HB2      TRP  17  -5.833  -2.505  -3.596
   47    HB3  TRP  17           HB1      TRP  17  -4.751  -1.738  -2.435
   48    HD1  TRP  17           HD1      TRP  17  -5.850  -1.329  -6.136
   49    HE1  TRP  17           HE1      TRP  17  -5.695   1.171  -6.721
   50    HE3  TRP  17           HE3      TRP  17  -3.775   0.401  -1.791
   51    HZ2  TRP  17           HZ2      TRP  17  -4.778   3.556  -5.518
   52    HZ3  TRP  17           HZ3      TRP  17  -3.284   2.804  -1.595
   53    HH2  TRP  17           HH2      TRP  17  -3.773   4.348  -3.420
   54    H    GLU  18           HN       GLU  18  -1.638  -3.204  -2.650
   55    HA   GLU  18           HA       GLU  18  -2.548  -5.695  -1.377
   56    HB2  GLU  18           HB2      GLU  18   0.059  -4.804  -2.471
   57    HB3  GLU  18           HB1      GLU  18   0.091  -5.833  -1.051
   58    HG2  GLU  18           HG2      GLU  18  -1.220  -6.467  -3.680
   59    HG3  GLU  18           HG1      GLU  18   0.279  -7.145  -3.052
   60    H    VAL  19           HN       VAL  19  -2.062  -6.087   0.724
   61    HA   VAL  19           HA       VAL  19  -1.342  -3.742   2.364
   62    HB   VAL  19           HB       VAL  19  -2.996  -6.079   3.327
   63   HG11  VAL  19          HG11      VAL  19  -3.588  -4.571   5.154
   64   HG12  VAL  19          HG12      VAL  19  -2.573  -3.314   4.446
   65   HG13  VAL  19          HG13      VAL  19  -1.840  -4.800   5.051
   66   HG21  VAL  19          HG21      VAL  19  -4.004  -3.429   2.308
   67   HG22  VAL  19          HG22      VAL  19  -4.981  -4.668   3.095
   68   HG23  VAL  19          HG23      VAL  19  -4.230  -4.995   1.531
   69    H    ARG  20           HN       ARG  20   0.738  -4.030   2.953
   70    HA   ARG  20           HA       ARG  20   1.436  -6.686   4.004
   71    HB2  ARG  20           HB2      ARG  20   2.571  -5.838   1.788
   72    HB3  ARG  20           HB1      ARG  20   3.546  -4.883   2.901
   73    HG2  ARG  20           HG2      ARG  20   4.795  -6.807   2.654
   74    HG3  ARG  20           HG1      ARG  20   3.908  -7.116   4.138
   75    HD2  ARG  20           HD2      ARG  20   3.863  -9.076   2.688
   76    HD3  ARG  20           HD1      ARG  20   2.247  -8.402   2.894
   77    HE   ARG  20           HE       ARG  20   3.900  -7.947   0.488
   78   HH11  ARG  20          HH11      ARG  20   0.785  -8.541   1.997
   79   HH12  ARG  20          HH12      ARG  20  -0.072  -8.566   0.484
   80   HH21  ARG  20          HH21      ARG  20   2.761  -7.987  -1.489
   81   HH22  ARG  20          HH22      ARG  20   1.038  -8.279  -1.467
   82    H    HIS  21           HN       HIS  21   2.656  -6.746   5.849
   83    HA   HIS  21           HA       HIS  21   2.659  -4.230   7.389
   84    HB2  HIS  21           HB2      HIS  21   1.687  -6.746   8.030
   85    HB3  HIS  21           HB1      HIS  21   3.257  -6.727   8.814
   86    HD1  HIS  21           HD1      HIS  21   2.039  -6.961  11.028
   87    HD2  HIS  21           HD2      HIS  21   1.208  -3.306   9.079
   88    HE1  HIS  21           HE1      HIS  21   0.909  -5.502  12.732
   89    HE2  HIS  21           HE2      HIS  21   0.465  -3.321  11.565
   90    H    ALA  22           HN       ALA  22   4.605  -3.267   7.257
   91    HA   ALA  22           HA       ALA  22   6.998  -4.550   6.499
   92    HB1  ALA  22           HB1      ALA  22   6.631  -1.928   7.953
   93    HB2  ALA  22           HB2      ALA  22   6.602  -2.148   6.203
   94    HB3  ALA  22           HB3      ALA  22   8.088  -2.450   7.107
   95    HA   PRO  23           HA       PRO  23   8.652  -6.447  10.080
   96    HB2  PRO  23           HB2      PRO  23  11.090  -4.760   9.947
   97    HB3  PRO  23           HB1      PRO  23  10.932  -6.519   9.918
   98    HG2  PRO  23           HG2      PRO  23  11.513  -5.167   7.698
   99    HG3  PRO  23           HG1      PRO  23  10.427  -6.569   7.657
  100    HD2  PRO  23           HD2      PRO  23   9.767  -3.654   7.558
  101    HD3  PRO  23           HD1      PRO  23   9.033  -5.008   6.674
  102    H    ASN  24           HN       ASN  24   8.469  -2.992  10.080
  103    HA   ASN  24           HA       ASN  24   9.066  -2.717  12.892
  104    HB2  ASN  24           HB2      ASN  24   8.557  -0.357  12.604
  105    HB3  ASN  24           HB1      ASN  24   9.620  -0.889  11.310
  106   HD21  ASN  24          HD21      ASN  24   7.952   1.425  11.349
  107   HD22  ASN  24          HD22      ASN  24   6.842   1.270  10.029
  108    H    GLY  25           HN       GLY  25   6.533  -3.736  11.027
  109    HA2  GLY  25           HA2      GLY  25   4.554  -4.644  11.829
  110    HA3  GLY  25           HA1      GLY  25   4.774  -3.750  13.311
  111    H    ARG  26           HN       ARG  26   5.015  -2.180  10.239
  112    HA   ARG  26           HA       ARG  26   2.351  -0.974  10.646
  113    HB2  ARG  26           HB2      ARG  26   4.821   0.163   9.317
  114    HB3  ARG  26           HB1      ARG  26   3.239   0.922   9.257
  115    HG2  ARG  26           HG2      ARG  26   4.700   0.349  11.821
  116    HG3  ARG  26           HG1      ARG  26   4.842   1.865  10.933
  117    HD2  ARG  26           HD2      ARG  26   3.132   2.520  12.234
  118    HD3  ARG  26           HD1      ARG  26   2.148   1.609  11.090
  119    HE   ARG  26           HE       ARG  26   3.065  -0.103  13.146
  120   HH11  ARG  26          HH11      ARG  26   0.810   2.531  12.590
  121   HH12  ARG  26          HH12      ARG  26  -0.247   2.061  13.891
  122   HH21  ARG  26          HH21      ARG  26   1.651  -0.739  14.830
  123   HH22  ARG  26          HH22      ARG  26   0.205   0.188  15.131
  124    HA   PRO  27           HA       PRO  27   1.629  -2.850   6.626
  125    HB2  PRO  27           HB2      PRO  27  -1.010  -2.407   6.468
  126    HB3  PRO  27           HB1      PRO  27  -0.351  -3.605   7.583
  127    HG2  PRO  27           HG2      PRO  27  -1.342  -0.847   8.134
  128    HG3  PRO  27           HG1      PRO  27  -1.504  -2.317   9.112
  129    HD2  PRO  27           HD2      PRO  27   0.392  -0.371   9.508
  130    HD3  PRO  27           HD1      PRO  27   0.489  -1.945  10.167
  131    H    PHE  28           HN       PHE  28   2.338  -1.832   4.963
  132    HA   PHE  28           HA       PHE  28   1.297   0.805   4.242
  133    HB2  PHE  28           HB2      PHE  28   3.303   0.959   2.769
  134    HB3  PHE  28           HB1      PHE  28   3.705   0.795   4.467
  135    HD1  PHE  28           HD1      PHE  28   3.772  -1.981   5.051
  136    HD2  PHE  28           HD2      PHE  28   4.878  -0.038   1.425
  137    HE1  PHE  28           HE1      PHE  28   5.299  -3.830   4.527
  138    HE2  PHE  28           HE2      PHE  28   6.387  -1.897   0.895
  139    HZ   PHE  28           HZ       PHE  28   6.605  -3.793   2.443
  140    H    PHE  29           HN       PHE  29  -0.037   0.960   2.601
  141    HA   PHE  29           HA       PHE  29  -0.766  -1.479   1.194
  142    HB2  PHE  29           HB2      PHE  29  -2.106   1.242   1.211
  143    HB3  PHE  29           HB1      PHE  29  -2.754  -0.230   0.490
  144    HD1  PHE  29           HD2      PHE  29  -1.531   1.036   3.789
  145    HD2  PHE  29           HD1      PHE  29  -4.244  -1.478   1.689
  146    HE1  PHE  29           HE2      PHE  29  -2.612   0.438   5.915
  147    HE2  PHE  29           HE1      PHE  29  -5.334  -2.078   3.810
  148    HZ   PHE  29           HZ       PHE  29  -4.510  -1.133   5.926
  149    H    ILE  30           HN       ILE  30  -0.081  -1.893  -0.774
  150    HA   ILE  30           HA       ILE  30   1.243   0.286  -2.234
  151    HB   ILE  30           HB       ILE  30   1.618  -2.649  -2.800
  152   HG12  ILE  30          HG12      ILE  30   3.395  -0.942  -1.090
  153   HG13  ILE  30          HG11      ILE  30   2.215  -2.048  -0.408
  154   HG21  ILE  30          HG21      ILE  30   3.716  -1.844  -3.803
  155   HG22  ILE  30          HG22      ILE  30   3.276  -0.189  -3.379
  156   HG23  ILE  30          HG23      ILE  30   2.302  -1.091  -4.541
  157   HD11  ILE  30          HD11      ILE  30   4.561  -2.784  -2.148
  158   HD12  ILE  30          HD12      ILE  30   3.367  -3.912  -1.505
  159   HD13  ILE  30          HD13      ILE  30   4.429  -3.031  -0.406
  160    H    ASP  31           HN       ASP  31   0.613   0.871  -4.151
  161    HA   ASP  31           HA       ASP  31  -1.496  -0.584  -5.554
  162    HB2  ASP  31           HB2      ASP  31  -1.962   1.671  -5.818
  163    HB3  ASP  31           HB1      ASP  31  -0.260   2.125  -5.845
  164    H    HIS  32           HN       HIS  32  -0.924  -2.200  -6.733
  165    HA   HIS  32           HA       HIS  32   1.823  -2.439  -7.683
  166    HB2  HIS  32           HB2      HIS  32  -0.427  -4.409  -7.313
  167    HB3  HIS  32           HB1      HIS  32   1.041  -4.838  -8.171
  168    HD1  HIS  32           HD1      HIS  32   2.305  -6.324  -6.540
  169    HD2  HIS  32           HD2      HIS  32   0.770  -2.905  -4.736
  170    HE1  HIS  32           HE1      HIS  32   3.141  -6.341  -4.150
  171    HE2  HIS  32           HE2      HIS  32   2.240  -4.258  -3.119
  172    H    ASN  33           HN       ASN  33  -0.958  -1.208  -8.871
  173    HA   ASN  33           HA       ASN  33  -0.823  -2.346 -11.529
  174    HB2  ASN  33           HB2      ASN  33  -2.294   0.166 -10.717
  175    HB3  ASN  33           HB1      ASN  33  -2.587  -0.837 -12.132
  176   HD21  ASN  33          HD21      ASN  33  -3.078  -0.417  -8.758
  177   HD22  ASN  33          HD22      ASN  33  -4.233  -1.705  -8.556
  178    H    THR  34           HN       THR  34   0.250   0.495  -9.807
  179    HA   THR  34           HA       THR  34   1.884   1.158 -12.151
  180    HB   THR  34           HB       THR  34   0.782   3.199 -10.206
  181    HG1  THR  34           HG1      THR  34  -0.878   2.264 -11.460
  182   HG21  THR  34          HG21      THR  34   2.865   3.864 -11.313
  183   HG22  THR  34          HG22      THR  34   1.499   4.805 -11.911
  184   HG23  THR  34          HG23      THR  34   2.152   3.485 -12.882
  185    H    LYS  35           HN       LYS  35   1.957   2.540  -8.853
  186    HA   LYS  35           HA       LYS  35   4.380   1.337  -8.028
  187    HB2  LYS  35           HB2      LYS  35   4.606   3.990  -9.460
  188    HB3  LYS  35           HB1      LYS  35   5.769   3.495  -8.247
  189    HG2  LYS  35           HG2      LYS  35   5.198   2.091 -10.845
  190    HG3  LYS  35           HG1      LYS  35   6.611   3.077 -10.470
  191    HD2  LYS  35           HD2      LYS  35   7.280   1.493  -8.747
  192    HD3  LYS  35           HD1      LYS  35   5.840   0.520  -9.066
  193    HE2  LYS  35           HE2      LYS  35   8.125   1.058 -10.958
  194    HE3  LYS  35           HE1      LYS  35   7.739  -0.473 -10.173
  195    HZ1  LYS  35           HZ1      LYS  35   6.946  -0.540 -12.408
  196    HZ2  LYS  35           HZ2      LYS  35   6.130   0.935 -12.237
  197    HZ3  LYS  35           HZ3      LYS  35   5.591  -0.431 -11.393
  198    H    THR  36           HN       THR  36   1.737   2.369  -7.025
  199    HA   THR  36           HA       THR  36   2.489   4.816  -5.601
  200    HB   THR  36           HB       THR  36  -0.221   3.590  -5.417
  201    HG1  THR  36           HG1      THR  36  -0.046   3.689  -7.612
  202   HG21  THR  36          HG21      THR  36  -0.919   5.942  -5.241
  203   HG22  THR  36          HG22      THR  36   0.765   6.438  -5.415
  204   HG23  THR  36          HG23      THR  36   0.261   5.509  -4.004
  205    H    THR  37           HN       THR  37   2.165   5.057  -3.369
  206    HA   THR  37           HA       THR  37   1.817   2.669  -1.766
  207    HB   THR  37           HB       THR  37   3.925   3.313  -0.430
  208    HG1  THR  37           HG1      THR  37   5.536   4.327  -1.672
  209   HG21  THR  37          HG21      THR  37   3.734   1.238  -1.684
  210   HG22  THR  37          HG22      THR  37   5.354   1.914  -1.856
  211   HG23  THR  37          HG23      THR  37   4.186   2.075  -3.169
  212    H    THR  38           HN       THR  38   0.817   3.085   0.108
  213    HA   THR  38           HA       THR  38   0.988   5.717   1.328
  214    HB   THR  38           HB       THR  38  -0.861   6.009  -0.239
  215    HG1  THR  38           HG1      THR  38  -2.588   6.237   1.538
  216   HG21  THR  38          HG21      THR  38  -2.127   3.648   1.157
  217   HG22  THR  38          HG22      THR  38  -1.538   3.682  -0.505
  218   HG23  THR  38          HG23      THR  38  -2.917   4.676  -0.039
  219    H    TRP  39           HN       TRP  39   0.333   5.695   3.566
  220    HA   TRP  39           HA       TRP  39   0.406   3.026   4.748
  221    HB2  TRP  39           HB2      TRP  39   0.251   5.693   6.163
  222    HB3  TRP  39           HB1      TRP  39   0.642   4.141   6.888
  223    HD1  TRP  39           HD1      TRP  39   2.135   7.047   5.060
  224    HE1  TRP  39           HE1      TRP  39   4.706   6.757   4.949
  225    HE3  TRP  39           HE3      TRP  39   2.473   2.223   6.695
  226    HZ2  TRP  39           HZ2      TRP  39   6.613   4.730   5.512
  227    HZ3  TRP  39           HZ3      TRP  39   4.693   1.179   6.887
  228    HH2  TRP  39           HH2      TRP  39   6.718   2.408   6.300
  229    H    GLU  40           HN       GLU  40  -1.895   5.155   3.667
  230    HA   GLU  40           HA       GLU  40  -3.791   4.397   5.760
  231    HB2  GLU  40           HB2      GLU  40  -5.041   6.438   5.124
  232    HB3  GLU  40           HB1      GLU  40  -3.420   6.754   5.726
  233    HG2  GLU  40           HG2      GLU  40  -3.696   8.219   3.968
  234    HG3  GLU  40           HG1      GLU  40  -2.712   6.922   3.302
  235    H    ASP  41           HN       ASP  41  -6.113   4.295   4.944
  236    HA   ASP  41           HA       ASP  41  -5.929   2.320   2.794
  237    HB2  ASP  41           HB2      ASP  41  -8.070   1.434   3.721
  238    HB3  ASP  41           HB1      ASP  41  -6.721   1.372   4.846
  239    HA   PRO  42           HA       PRO  42  -8.117   4.917  -0.034
  240    HB2  PRO  42           HB2      PRO  42  -8.754   2.929  -1.806
  241    HB3  PRO  42           HB1      PRO  42  -7.158   3.681  -1.717
  242    HG2  PRO  42           HG2      PRO  42  -8.108   1.114  -0.501
  243    HG3  PRO  42           HG1      PRO  42  -6.596   1.437  -1.373
  244    HD2  PRO  42           HD2      PRO  42  -6.646   1.338   1.295
  245    HD3  PRO  42           HD1      PRO  42  -5.640   2.531   0.448
  246    H    ARG  43           HN       ARG  43  -9.409   2.412   1.828
  247    HA   ARG  43           HA       ARG  43 -12.078   2.421   0.764
  248    HB2  ARG  43           HB2      ARG  43 -10.954   1.369   3.364
  249    HB3  ARG  43           HB1      ARG  43 -12.606   1.117   2.818
  250    HG2  ARG  43           HG2      ARG  43 -11.894  -0.196   0.991
  251    HG3  ARG  43           HG1      ARG  43 -10.208   0.246   1.242
  252    HD2  ARG  43           HD2      ARG  43 -10.733  -2.025   2.046
  253    HD3  ARG  43           HD1      ARG  43 -10.149  -0.958   3.321
  254    HE   ARG  43           HE       ARG  43 -13.006  -1.006   3.159
  255   HH11  ARG  43          HH11      ARG  43 -10.193  -2.668   4.420
  256   HH12  ARG  43          HH12      ARG  43 -11.079  -3.461   5.692
  257   HH21  ARG  43          HH21      ARG  43 -14.171  -2.040   4.822
  258   HH22  ARG  43          HH22      ARG  43 -13.345  -3.116   5.911
  259    H    LEU  44           HN       LEU  44 -10.390   3.838   3.494
  260    HA   LEU  44           HA       LEU  44 -12.706   5.214   4.447
  261    HB2  LEU  44           HB2      LEU  44  -9.868   4.997   5.243
  262    HB3  LEU  44           HB1      LEU  44 -10.724   6.421   5.769
  263    HG   LEU  44           HG       LEU  44 -10.572   4.178   7.226
  264   HD11  LEU  44          HD11      LEU  44 -12.529   4.985   8.459
  265   HD12  LEU  44          HD12      LEU  44 -12.968   6.010   7.093
  266   HD13  LEU  44          HD13      LEU  44 -11.473   6.314   7.978
  267   HD21  LEU  44          HD21      LEU  44 -11.770   2.790   5.614
  268   HD22  LEU  44          HD22      LEU  44 -13.153   3.883   5.684
  269   HD23  LEU  44          HD23      LEU  44 -12.690   2.955   7.110
  270    H    LYS  45           HN       LYS  45 -10.442   5.688   2.163
  271    HA   LYS  45           HA       LYS  45  -9.538   7.525   1.055
  272    HB2  LYS  45           HB2      LYS  45 -11.368   6.562  -0.257
  273    HB3  LYS  45           HB1      LYS  45 -12.497   7.684   0.491
  274    HG2  LYS  45           HG2      LYS  45 -11.443   9.554  -0.537
  275    HG3  LYS  45           HG1      LYS  45 -10.109   8.556  -1.114
  276    HD2  LYS  45           HD2      LYS  45 -12.979   8.169  -1.951
  277    HD3  LYS  45           HD1      LYS  45 -11.819   9.145  -2.852
  278    HE2  LYS  45           HE2      LYS  45 -10.352   7.112  -2.988
  279    HE3  LYS  45           HE1      LYS  45 -11.678   6.185  -2.287
  280    HZ1  LYS  45           HZ1      LYS  45 -11.867   7.744  -4.811
  281    HZ2  LYS  45           HZ2      LYS  45 -13.054   6.717  -4.165
  282    HZ3  LYS  45           HZ3      LYS  45 -11.594   6.070  -4.735
  283    H    GLN 112           H        GLN 112   6.648  10.768   4.874
  284    HA   GLN 112           HA       GLN 112   8.232   8.473   5.840
  285    HB2  GLN 112           HB2      GLN 112   5.352   9.168   6.393
  286    HB3  GLN 112           HB1      GLN 112   5.970   7.526   6.506
  287    HG2  GLN 112           HG2      GLN 112   7.039   9.860   8.076
  288    HG3  GLN 112           HG1      GLN 112   5.848   8.705   8.665
  289   HE21  GLN 112          HE21      GLN 112   9.187   9.204   7.842
  290   HE22  GLN 112          HE22      GLN 112   9.783   7.731   8.530
  291    H    ILE 113           HN       ILE 113   8.683   7.422   4.050
  292    HA   ILE 113           HA       ILE 113   6.676   7.388   1.897
  293    HB   ILE 113           HB       ILE 113   8.709   8.415   1.152
  294   HG12  ILE 113          HG12      ILE 113   9.380   6.867  -0.692
  295   HG13  ILE 113          HG11      ILE 113   8.433   5.603   0.084
  296   HG21  ILE 113          HG21      ILE 113  10.262   7.540   2.779
  297   HG22  ILE 113          HG22      ILE 113  10.866   7.252   1.148
  298   HG23  ILE 113          HG23      ILE 113  10.142   5.932   2.065
  299   HD11  ILE 113          HD11      ILE 113   6.414   6.949  -0.201
  300   HD12  ILE 113          HD12      ILE 113   7.209   6.623  -1.740
  301   HD13  ILE 113          HD13      ILE 113   7.370   8.207  -0.984
  302    HA   PRO 114           HA       PRO 114   6.338   2.986   2.900
  303    HB2  PRO 114           HB2      PRO 114   4.337   3.013   0.766
  304    HB3  PRO 114           HB1      PRO 114   4.150   2.587   2.468
  305    HG2  PRO 114           HG2      PRO 114   3.101   4.838   1.407
  306    HG3  PRO 114           HG1      PRO 114   3.648   4.734   3.090
  307    HD2  PRO 114           HD2      PRO 114   4.998   5.972   0.727
  308    HD3  PRO 114           HD1      PRO 114   4.928   6.524   2.415
  309    HA   PRO 115           HA       PRO 115   9.045   1.683  -0.505
  310    HB2  PRO 115           HB2      PRO 115   8.422  -0.934   0.762
  311    HB3  PRO 115           HB1      PRO 115   9.979  -0.240   0.328
  312    HG2  PRO 115           HG2      PRO 115   9.205  -0.339   2.866
  313    HG3  PRO 115           HG1      PRO 115  10.085   1.068   2.239
  314    HD2  PRO 115           HD2      PRO 115   7.177   0.764   2.841
  315    HD3  PRO 115           HD1      PRO 115   8.243   2.168   3.061
  316    HA   PRO 116           HA       PRO 116   5.892   0.449  -3.493
  317    HB2  PRO 116           HB2      PRO 116   7.971  -0.429  -5.198
  318    HB3  PRO 116           HB1      PRO 116   7.138   1.133  -5.255
  319    HG2  PRO 116           HG2      PRO 116   9.655   0.372  -3.845
  320    HG3  PRO 116           HG1      PRO 116   9.283   1.847  -4.776
  321    HD2  PRO 116           HD2      PRO 116   9.114   2.015  -2.244
  322    HD3  PRO 116           HD1      PRO 116   7.733   2.557  -3.165
  323    H    TYR 117           HN       TYR 117   6.020  -1.020  -4.932
  324    HA   TYR 117           HA       TYR 117   5.743  -3.640  -3.678
  325    HB2  TYR 117           HB2      TYR 117   4.162  -4.170  -5.251
  326    HB3  TYR 117           HB1      TYR 117   4.024  -2.422  -5.249
  327    HD1  TYR 117           HD2      TYR 117   4.890  -1.112  -7.174
  328    HD2  TYR 117           HD1      TYR 117   4.919  -5.366  -7.161
  329    HE1  TYR 117           HE2      TYR 117   5.188  -1.118  -9.618
  330    HE2  TYR 117           HE1      TYR 117   5.210  -5.383  -9.595
  331    HH   TYR 117           HH       TYR 117   4.756  -3.916 -11.507
  332    H    VAL 118           HN       VAL 118   6.941  -5.399  -4.051
  333    HA   VAL 118           HA       VAL 118   8.943  -5.263  -6.215
  334    HB   VAL 118           HB       VAL 118  10.362  -6.770  -4.845
  335   HG11  VAL 118          HG11      VAL 118  11.089  -5.085  -3.210
  336   HG12  VAL 118          HG12      VAL 118   9.600  -4.180  -3.495
  337   HG13  VAL 118          HG13      VAL 118  10.777  -4.379  -4.795
  338   HG21  VAL 118          HG21      VAL 118   8.607  -7.796  -3.486
  339   HG22  VAL 118          HG22      VAL 118   8.327  -6.256  -2.670
  340   HG23  VAL 118          HG23      VAL 118   9.867  -7.094  -2.471
  341    H    GLU 119           HN       GLU 119   6.183  -6.694  -5.093
  342    HA   GLU 119           HA       GLU 119   6.691  -9.265  -6.417
  343    HB2  GLU 119           HB2      GLU 119   4.092  -8.786  -5.081
  344    HB3  GLU 119           HB1      GLU 119   5.119 -10.209  -5.061
  345    HG2  GLU 119           HG2      GLU 119   5.277  -9.560  -2.885
  346    HG3  GLU 119           HG1      GLU 119   6.653  -8.692  -3.567
  347    HA   PRO 120           HA       PRO 120   4.357  -7.385  -9.788
  348    HB2  PRO 120           HB2      PRO 120   5.167  -9.723 -11.319
  349    HB3  PRO 120           HB1      PRO 120   5.635  -8.037 -11.544
  350    HG2  PRO 120           HG2      PRO 120   7.362  -9.951 -10.689
  351    HG3  PRO 120           HG1      PRO 120   7.504  -8.244 -10.232
  352    HD2  PRO 120           HD2      PRO 120   6.363 -10.535  -8.672
  353    HD3  PRO 120           HD1      PRO 120   7.407  -9.206  -8.121
  Start of MODEL   15
    1    H    PHE  12           H        PHE  12 -11.569  -6.653  -1.946
    2    HA   PHE  12           HA       PHE  12 -13.697  -5.807  -2.533
    3    HB2  PHE  12           HB2      PHE  12 -15.034  -4.580  -0.783
    4    HB3  PHE  12           HB1      PHE  12 -15.016  -6.329  -0.624
    5    HD1  PHE  12           HD1      PHE  12 -13.709  -7.392   1.175
    6    HD2  PHE  12           HD2      PHE  12 -14.121  -3.166   0.897
    7    HE1  PHE  12           HE1      PHE  12 -12.995  -7.175   3.517
    8    HE2  PHE  12           HE2      PHE  12 -13.401  -2.940   3.241
    9    HZ   PHE  12           HZ       PHE  12 -12.839  -4.945   4.553
   10    H    LEU  13           HN       LEU  13 -10.819  -4.943  -1.382
   11    HA   LEU  13           HA       LEU  13 -11.199  -2.104  -1.991
   12    HB2  LEU  13           HB2      LEU  13  -8.842  -1.838  -1.289
   13    HB3  LEU  13           HB1      LEU  13  -9.856  -2.498  -0.028
   14    HG   LEU  13           HG       LEU  13  -8.895  -4.797  -0.897
   15   HD11  LEU  13          HD11      LEU  13  -6.595  -4.615  -1.642
   16   HD12  LEU  13          HD12      LEU  13  -6.731  -2.858  -1.676
   17   HD13  LEU  13          HD13      LEU  13  -7.685  -3.838  -2.790
   18   HD21  LEU  13          HD21      LEU  13  -7.310  -2.861   0.780
   19   HD22  LEU  13          HD22      LEU  13  -7.118  -4.613   0.765
   20   HD23  LEU  13          HD23      LEU  13  -8.619  -3.897   1.351
   21    HA   PRO  14           HA       PRO  14  -9.949  -2.165  -6.154
   22    HB2  PRO  14           HB2      PRO  14  -7.544  -0.621  -5.341
   23    HB3  PRO  14           HB1      PRO  14  -8.613  -0.383  -6.732
   24    HG2  PRO  14           HG2      PRO  14  -8.943   1.078  -4.714
   25    HG3  PRO  14           HG1      PRO  14 -10.382   0.312  -5.348
   26    HD2  PRO  14           HD2      PRO  14  -8.751  -0.433  -2.931
   27    HD3  PRO  14           HD1      PRO  14 -10.523  -0.376  -3.103
   28    H    LYS  15           HN       LYS  15  -8.707  -2.852  -7.615
   29    HA   LYS  15           HA       LYS  15  -7.370  -5.312  -6.844
   30    HB2  LYS  15           HB2      LYS  15  -8.097  -4.182  -9.546
   31    HB3  LYS  15           HB1      LYS  15  -7.278  -5.724  -9.328
   32    HG2  LYS  15           HG2      LYS  15  -9.175  -6.548  -8.026
   33    HG3  LYS  15           HG1      LYS  15  -9.995  -5.004  -8.255
   34    HD2  LYS  15           HD2      LYS  15  -9.920  -5.375 -10.702
   35    HD3  LYS  15           HD1      LYS  15  -9.197  -6.959 -10.410
   36    HE2  LYS  15           HE2      LYS  15 -11.907  -6.055  -9.436
   37    HE3  LYS  15           HE1      LYS  15 -11.613  -7.106 -10.820
   38    HZ1  LYS  15           HZ1      LYS  15 -10.558  -8.699  -9.278
   39    HZ2  LYS  15           HZ2      LYS  15 -12.198  -8.430  -8.936
   40    HZ3  LYS  15           HZ3      LYS  15 -11.005  -7.705  -7.974
   41    H    GLY  16           HN       GLY  16  -5.281  -5.719  -6.840
   42    HA2  GLY  16           HA2      GLY  16  -3.010  -5.473  -7.362
   43    HA3  GLY  16           HA1      GLY  16  -3.386  -4.002  -8.249
   44    H    TRP  17           HN       TRP  17  -5.014  -3.726  -5.440
   45    HA   TRP  17           HA       TRP  17  -2.900  -2.137  -4.235
   46    HB2  TRP  17           HB2      TRP  17  -5.860  -2.333  -3.839
   47    HB3  TRP  17           HB1      TRP  17  -4.860  -1.633  -2.572
   48    HD1  TRP  17           HD1      TRP  17  -5.688  -1.073  -6.313
   49    HE1  TRP  17           HE1      TRP  17  -5.408   1.430  -6.820
   50    HE3  TRP  17           HE3      TRP  17  -3.839   0.462  -1.798
   51    HZ2  TRP  17           HZ2      TRP  17  -4.492   3.752  -5.484
   52    HZ3  TRP  17           HZ3      TRP  17  -3.275   2.838  -1.498
   53    HH2  TRP  17           HH2      TRP  17  -3.596   4.448  -3.305
   54    H    GLU  18           HN       GLU  18  -1.623  -2.958  -2.820
   55    HA   GLU  18           HA       GLU  18  -2.430  -5.390  -1.390
   56    HB2  GLU  18           HB2      GLU  18   0.093  -4.383  -2.500
   57    HB3  GLU  18           HB1      GLU  18   0.232  -5.172  -0.951
   58    HG2  GLU  18           HG2      GLU  18  -1.048  -6.381  -3.386
   59    HG3  GLU  18           HG1      GLU  18   0.601  -6.670  -2.845
   60    H    VAL  19           HN       VAL  19  -2.021  -5.601   0.739
   61    HA   VAL  19           HA       VAL  19  -1.421  -3.148   2.255
   62    HB   VAL  19           HB       VAL  19  -3.339  -5.244   3.269
   63   HG11  VAL  19          HG11      VAL  19  -2.843  -2.390   4.080
   64   HG12  VAL  19          HG12      VAL  19  -2.307  -3.832   4.943
   65   HG13  VAL  19          HG13      VAL  19  -4.030  -3.476   4.801
   66   HG21  VAL  19          HG21      VAL  19  -5.196  -3.785   2.648
   67   HG22  VAL  19          HG22      VAL  19  -4.315  -4.348   1.228
   68   HG23  VAL  19          HG23      VAL  19  -4.073  -2.705   1.822
   69    H    ARG  20           HN       ARG  20   0.711  -3.780   2.581
   70    HA   ARG  20           HA       ARG  20   1.113  -6.382   3.875
   71    HB2  ARG  20           HB2      ARG  20   2.435  -5.774   1.791
   72    HB3  ARG  20           HB1      ARG  20   3.252  -4.560   2.774
   73    HG2  ARG  20           HG2      ARG  20   3.865  -6.445   4.351
   74    HG3  ARG  20           HG1      ARG  20   3.317  -7.547   3.088
   75    HD2  ARG  20           HD2      ARG  20   5.435  -5.442   2.740
   76    HD3  ARG  20           HD1      ARG  20   5.763  -7.138   3.073
   77    HE   ARG  20           HE       ARG  20   4.123  -6.797   0.750
   78   HH11  ARG  20          HH11      ARG  20   7.418  -6.603   1.914
   79   HH12  ARG  20          HH12      ARG  20   8.129  -7.006   0.382
   80   HH21  ARG  20          HH21      ARG  20   5.046  -7.311  -1.290
   81   HH22  ARG  20          HH22      ARG  20   6.770  -7.415  -1.441
   82    H    HIS  21           HN       HIS  21   2.181  -6.544   5.831
   83    HA   HIS  21           HA       HIS  21   2.219  -4.074   7.429
   84    HB2  HIS  21           HB2      HIS  21   1.186  -6.591   7.960
   85    HB3  HIS  21           HB1      HIS  21   2.727  -6.620   8.797
   86    HD1  HIS  21           HD1      HIS  21   1.473  -6.846  10.989
   87    HD2  HIS  21           HD2      HIS  21   0.742  -3.182   9.066
   88    HE1  HIS  21           HE1      HIS  21   0.203  -5.448  12.635
   89    HE2  HIS  21           HE2      HIS  21  -0.469  -3.391  11.353
   90    H    ALA  22           HN       ALA  22   4.172  -3.138   7.371
   91    HA   ALA  22           HA       ALA  22   6.591  -4.420   6.697
   92    HB1  ALA  22           HB1      ALA  22   6.201  -2.017   6.405
   93    HB2  ALA  22           HB2      ALA  22   7.651  -2.319   7.362
   94    HB3  ALA  22           HB3      ALA  22   6.160  -1.810   8.156
   95    HA   PRO  23           HA       PRO  23   8.153  -6.266  10.369
   96    HB2  PRO  23           HB2      PRO  23  10.559  -4.533  10.339
   97    HB3  PRO  23           HB1      PRO  23  10.436  -6.295  10.293
   98    HG2  PRO  23           HG2      PRO  23  11.091  -4.900   8.113
   99    HG3  PRO  23           HG1      PRO  23  10.060  -6.340   8.010
  100    HD2  PRO  23           HD2      PRO  23   9.302  -3.450   7.884
  101    HD3  PRO  23           HD1      PRO  23   8.656  -4.826   6.967
  102    H    ASN  24           HN       ASN  24   7.905  -2.819  10.311
  103    HA   ASN  24           HA       ASN  24   8.345  -2.482  13.144
  104    HB2  ASN  24           HB2      ASN  24   7.854  -0.154  12.799
  105    HB3  ASN  24           HB1      ASN  24   8.886  -0.681  11.476
  106   HD21  ASN  24          HD21      ASN  24   7.195   1.601  11.546
  107   HD22  ASN  24          HD22      ASN  24   6.024   1.415  10.283
  108    H    GLY  25           HN       GLY  25   5.937  -3.594  11.161
  109    HA2  GLY  25           HA2      GLY  25   3.944  -4.549  11.856
  110    HA3  GLY  25           HA1      GLY  25   4.081  -3.673  13.361
  111    H    ARG  26           HN       ARG  26   4.249  -2.243  10.154
  112    HA   ARG  26           HA       ARG  26   1.583  -1.059  10.604
  113    HB2  ARG  26           HB2      ARG  26   4.074   0.188   9.438
  114    HB3  ARG  26           HB1      ARG  26   2.476   0.848   9.135
  115    HG2  ARG  26           HG2      ARG  26   3.725   0.525  11.856
  116    HG3  ARG  26           HG1      ARG  26   3.656   2.023  10.929
  117    HD2  ARG  26           HD2      ARG  26   1.844   2.263  12.336
  118    HD3  ARG  26           HD1      ARG  26   1.089   1.566  10.904
  119    HE   ARG  26           HE       ARG  26   1.905  -0.446  12.748
  120   HH11  ARG  26          HH11      ARG  26  -0.639   1.883  12.084
  121   HH12  ARG  26          HH12      ARG  26  -1.823   1.027  13.037
  122   HH21  ARG  26          HH21      ARG  26   0.367  -1.532  14.019
  123   HH22  ARG  26          HH22      ARG  26  -1.244  -0.888  14.153
  124    HA   PRO  27           HA       PRO  27   0.775  -2.659   6.456
  125    HB2  PRO  27           HB2      PRO  27  -1.709  -1.684   6.159
  126    HB3  PRO  27           HB1      PRO  27  -1.407  -2.999   7.293
  127    HG2  PRO  27           HG2      PRO  27  -1.623  -0.049   7.841
  128    HG3  PRO  27           HG1      PRO  27  -2.416  -1.394   8.691
  129    HD2  PRO  27           HD2      PRO  27  -0.155  -0.308   9.643
  130    HD3  PRO  27           HD1      PRO  27  -0.498  -1.983   9.812
  131    H    PHE  28           HN       PHE  28   1.894  -1.625   4.966
  132    HA   PHE  28           HA       PHE  28   1.081   1.069   4.165
  133    HB2  PHE  28           HB2      PHE  28   3.201   1.130   2.868
  134    HB3  PHE  28           HB1      PHE  28   3.463   0.929   4.589
  135    HD1  PHE  28           HD2      PHE  28   3.490  -1.756   5.236
  136    HD2  PHE  28           HD1      PHE  28   4.683  -0.024   1.529
  137    HE1  PHE  28           HE2      PHE  28   4.941  -3.686   4.798
  138    HE2  PHE  28           HE1      PHE  28   6.122  -1.960   1.093
  139    HZ   PHE  28           HZ       PHE  28   6.259  -3.793   2.725
  140    H    PHE  29           HN       PHE  29  -0.089   1.302   2.426
  141    HA   PHE  29           HA       PHE  29  -0.864  -1.102   0.989
  142    HB2  PHE  29           HB2      PHE  29  -2.000   1.699   0.781
  143    HB3  PHE  29           HB1      PHE  29  -2.677   0.233   0.079
  144    HD1  PHE  29           HD1      PHE  29  -1.699   1.589   3.430
  145    HD2  PHE  29           HD2      PHE  29  -4.388  -0.785   1.145
  146    HE1  PHE  29           HE1      PHE  29  -3.095   1.248   5.430
  147    HE2  PHE  29           HE2      PHE  29  -5.779  -1.136   3.137
  148    HZ   PHE  29           HZ       PHE  29  -5.139  -0.120   5.279
  149    H    ILE  30           HN       ILE  30  -0.112  -1.571  -0.915
  150    HA   ILE  30           HA       ILE  30   1.347   0.506  -2.393
  151    HB   ILE  30           HB       ILE  30   1.563  -2.464  -2.866
  152   HG12  ILE  30          HG12      ILE  30   3.442  -0.772  -1.267
  153   HG13  ILE  30          HG11      ILE  30   2.209  -1.771  -0.514
  154   HG21  ILE  30          HG21      ILE  30   3.335  -0.116  -3.566
  155   HG22  ILE  30          HG22      ILE  30   2.295  -1.005  -4.680
  156   HG23  ILE  30          HG23      ILE  30   3.678  -1.806  -3.935
  157   HD11  ILE  30          HD11      ILE  30   4.498  -2.727  -2.218
  158   HD12  ILE  30          HD12      ILE  30   3.241  -3.753  -1.526
  159   HD13  ILE  30          HD13      ILE  30   4.354  -2.885  -0.468
  160    H    ASP  31           HN       ASP  31   0.636   1.132  -4.266
  161    HA   ASP  31           HA       ASP  31  -1.533  -0.336  -5.574
  162    HB2  ASP  31           HB2      ASP  31  -1.855   2.033  -5.651
  163    HB3  ASP  31           HB1      ASP  31  -0.206   2.304  -6.212
  164    H    HIS  32           HN       HIS  32  -1.039  -1.930  -6.873
  165    HA   HIS  32           HA       HIS  32   1.705  -2.144  -7.852
  166    HB2  HIS  32           HB2      HIS  32  -0.539  -4.150  -7.590
  167    HB3  HIS  32           HB1      HIS  32   1.000  -4.531  -8.343
  168    HD1  HIS  32           HD1      HIS  32   1.952  -6.144  -6.625
  169    HD2  HIS  32           HD2      HIS  32   0.657  -2.580  -4.924
  170    HE1  HIS  32           HE1      HIS  32   2.658  -6.201  -4.184
  171    HE2  HIS  32           HE2      HIS  32   1.651  -4.166  -3.172
  172    H    ASN  33           HN       ASN  33  -0.978  -0.778  -8.958
  173    HA   ASN  33           HA       ASN  33  -0.922  -1.845 -11.668
  174    HB2  ASN  33           HB2      ASN  33  -2.554   0.470 -10.599
  175    HB3  ASN  33           HB1      ASN  33  -2.802  -0.386 -12.116
  176   HD21  ASN  33          HD21      ASN  33  -3.304  -0.371  -8.714
  177   HD22  ASN  33          HD22      ASN  33  -4.308  -1.793  -8.647
  178    H    THR  34           HN       THR  34  -0.755   1.415 -10.244
  179    HA   THR  34           HA       THR  34   0.846   2.300 -12.542
  180    HB   THR  34           HB       THR  34  -0.491   3.970 -10.397
  181    HG1  THR  34           HG1      THR  34  -1.421   3.320 -13.024
  182   HG21  THR  34          HG21      THR  34   0.541   4.695 -13.143
  183   HG22  THR  34          HG22      THR  34   1.301   5.121 -11.610
  184   HG23  THR  34          HG23      THR  34  -0.278   5.788 -12.028
  185    H    LYS  35           HN       LYS  35   0.910   1.642  -9.208
  186    HA   LYS  35           HA       LYS  35   2.612   1.275  -7.792
  187    HB2  LYS  35           HB2      LYS  35   4.226   0.781  -9.453
  188    HB3  LYS  35           HB1      LYS  35   4.385   2.476  -9.894
  189    HG2  LYS  35           HG2      LYS  35   5.482   3.008  -7.879
  190    HG3  LYS  35           HG1      LYS  35   5.044   1.462  -7.147
  191    HD2  LYS  35           HD2      LYS  35   7.358   1.419  -7.800
  192    HD3  LYS  35           HD1      LYS  35   6.405   0.324  -8.804
  193    HE2  LYS  35           HE2      LYS  35   6.347   1.990 -10.588
  194    HE3  LYS  35           HE1      LYS  35   7.258   3.111  -9.582
  195    HZ1  LYS  35           HZ1      LYS  35   8.736   2.080 -11.113
  196    HZ2  LYS  35           HZ2      LYS  35   8.210   0.528 -10.688
  197    HZ3  LYS  35           HZ3      LYS  35   9.083   1.460  -9.574
  198    H    THR  36           HN       THR  36   1.880   2.385  -6.280
  199    HA   THR  36           HA       THR  36   3.232   4.836  -5.586
  200    HB   THR  36           HB       THR  36   0.883   5.705  -4.715
  201    HG1  THR  36           HG1      THR  36   0.259   4.019  -6.911
  202   HG21  THR  36          HG21      THR  36   2.376   6.967  -6.160
  203   HG22  THR  36          HG22      THR  36   0.710   7.118  -6.718
  204   HG23  THR  36          HG23      THR  36   1.829   6.047  -7.561
  205    H    THR  37           HN       THR  37   3.282   5.137  -3.272
  206    HA   THR  37           HA       THR  37   2.075   2.896  -1.796
  207    HB   THR  37           HB       THR  37   4.129   3.157  -0.239
  208    HG1  THR  37           HG1      THR  37   5.941   3.999  -1.178
  209   HG21  THR  37          HG21      THR  37   3.656   1.161  -1.556
  210   HG22  THR  37          HG22      THR  37   5.384   1.522  -1.578
  211   HG23  THR  37          HG23      THR  37   4.383   1.911  -2.977
  212    H    THR  38           HN       THR  38   0.964   3.367  -0.031
  213    HA   THR  38           HA       THR  38   1.284   5.939   1.302
  214    HB   THR  38           HB       THR  38  -0.320   6.499  -0.411
  215    HG1  THR  38           HG1      THR  38  -2.312   6.563   1.160
  216   HG21  THR  38          HG21      THR  38  -1.913   4.112   0.530
  217   HG22  THR  38          HG22      THR  38  -1.061   4.253  -1.008
  218   HG23  THR  38          HG23      THR  38  -2.443   5.294  -0.667
  219    H    TRP  39           HN       TRP  39   0.317   5.955   3.434
  220    HA   TRP  39           HA       TRP  39   0.152   3.254   4.538
  221    HB2  TRP  39           HB2      TRP  39   0.081   5.885   6.017
  222    HB3  TRP  39           HB1      TRP  39   0.351   4.289   6.708
  223    HD1  TRP  39           HD1      TRP  39   2.068   7.088   4.853
  224    HE1  TRP  39           HE1      TRP  39   4.626   6.643   4.858
  225    HE3  TRP  39           HE3      TRP  39   2.064   2.342   6.735
  226    HZ2  TRP  39           HZ2      TRP  39   6.382   4.542   5.583
  227    HZ3  TRP  39           HZ3      TRP  39   4.205   1.184   7.062
  228    HH2  TRP  39           HH2      TRP  39   6.317   2.258   6.500
  229    H    GLU  40           HN       GLU  40  -1.971   5.394   3.262
  230    HA   GLU  40           HA       GLU  40  -3.992   4.856   5.297
  231    HB2  GLU  40           HB2      GLU  40  -5.160   6.861   4.436
  232    HB3  GLU  40           HB1      GLU  40  -3.542   7.179   5.065
  233    HG2  GLU  40           HG2      GLU  40  -3.863   8.503   3.151
  234    HG3  GLU  40           HG1      GLU  40  -2.698   7.246   2.756
  235    H    ASP  41           HN       ASP  41  -6.265   4.661   4.434
  236    HA   ASP  41           HA       ASP  41  -5.971   2.249   2.804
  237    HB2  ASP  41           HB2      ASP  41  -7.027   2.427   5.215
  238    HB3  ASP  41           HB1      ASP  41  -8.435   2.939   4.339
  239    HA   PRO  42           HA       PRO  42  -8.298   4.170  -0.518
  240    HB2  PRO  42           HB2      PRO  42  -8.471   2.038  -2.142
  241    HB3  PRO  42           HB1      PRO  42  -6.952   2.918  -1.911
  242    HG2  PRO  42           HG2      PRO  42  -7.884   0.377  -0.620
  243    HG3  PRO  42           HG1      PRO  42  -6.307   0.746  -1.341
  244    HD2  PRO  42           HD2      PRO  42  -6.755   0.854   1.336
  245    HD3  PRO  42           HD1      PRO  42  -5.598   1.927   0.520
  246    H    ARG  43           HN       ARG  43  -9.368   1.568   1.484
  247    HA   ARG  43           HA       ARG  43 -11.952   1.198   0.266
  248    HB2  ARG  43           HB2      ARG  43 -11.032   0.618   3.089
  249    HB3  ARG  43           HB1      ARG  43 -12.521   0.034   2.357
  250    HG2  ARG  43           HG2      ARG  43 -11.285  -1.272   0.785
  251    HG3  ARG  43           HG1      ARG  43  -9.762  -0.610   1.364
  252    HD2  ARG  43           HD2      ARG  43 -11.683  -2.233   3.028
  253    HD3  ARG  43           HD1      ARG  43 -10.217  -2.859   2.270
  254    HE   ARG  43           HE       ARG  43  -9.149  -0.922   3.675
  255   HH11  ARG  43          HH11      ARG  43 -11.721  -3.090   4.671
  256   HH12  ARG  43          HH12      ARG  43 -11.306  -3.020   6.355
  257   HH21  ARG  43          HH21      ARG  43  -8.588  -0.826   5.850
  258   HH22  ARG  43          HH22      ARG  43  -9.501  -1.725   7.036
  259    H    LEU  44           HN       LEU  44 -10.484   3.437   2.247
  260    HA   LEU  44           HA       LEU  44 -12.806   4.470   3.542
  261    HB2  LEU  44           HB2      LEU  44  -9.957   5.386   3.331
  262    HB3  LEU  44           HB1      LEU  44 -11.171   6.407   4.068
  263    HG   LEU  44           HG       LEU  44 -11.465   4.901   5.888
  264   HD11  LEU  44          HD11      LEU  44 -11.497   2.799   4.686
  265   HD12  LEU  44          HD12      LEU  44 -10.401   2.731   6.066
  266   HD13  LEU  44          HD13      LEU  44  -9.755   2.913   4.435
  267   HD21  LEU  44          HD21      LEU  44  -9.231   4.737   6.829
  268   HD22  LEU  44          HD22      LEU  44  -9.484   6.289   6.030
  269   HD23  LEU  44          HD23      LEU  44  -8.539   5.029   5.235
  270    H    LYS  45           HN       LYS  45 -11.678   4.619   0.509
  271    HA   LYS  45           HA       LYS  45 -12.858   7.255  -0.066
  272    HB2  LYS  45           HB2      LYS  45 -10.710   5.690  -1.481
  273    HB3  LYS  45           HB1      LYS  45 -11.589   6.978  -2.289
  274    HG2  LYS  45           HG2      LYS  45  -9.537   7.869  -1.491
  275    HG3  LYS  45           HG1      LYS  45 -10.834   8.528  -0.495
  276    HD2  LYS  45           HD2      LYS  45 -10.327   6.899   1.251
  277    HD3  LYS  45           HD1      LYS  45  -9.046   6.215   0.249
  278    HE2  LYS  45           HE2      LYS  45  -8.136   7.724   1.927
  279    HE3  LYS  45           HE1      LYS  45  -7.863   8.344   0.301
  280    HZ1  LYS  45           HZ1      LYS  45  -9.791   9.803   0.609
  281    HZ2  LYS  45           HZ2      LYS  45  -8.574  10.104   1.743
  282    HZ3  LYS  45           HZ3      LYS  45  -9.961   9.243   2.200
  283    H    GLN 112           H        GLN 112   5.869   8.250   6.614
  284    HA   GLN 112           HA       GLN 112   8.152   9.503   5.214
  285    HB2  GLN 112           HB2      GLN 112   8.769   8.564   7.385
  286    HB3  GLN 112           HB1      GLN 112   7.981   7.047   6.974
  287    HG2  GLN 112           HG2      GLN 112   9.597   6.580   5.286
  288    HG3  GLN 112           HG1      GLN 112  10.303   8.187   5.445
  289   HE21  GLN 112          HE21      GLN 112   9.295   6.339   8.221
  290   HE22  GLN 112          HE22      GLN 112  10.886   5.988   8.806
  291    H    ILE 113           HN       ILE 113   8.830   8.537   3.348
  292    HA   ILE 113           HA       ILE 113   6.922   7.443   1.664
  293    HB   ILE 113           HB       ILE 113   8.878   6.805   0.199
  294   HG12  ILE 113          HG12      ILE 113  10.430   8.111   2.450
  295   HG13  ILE 113          HG11      ILE 113  10.514   6.412   2.005
  296   HG21  ILE 113          HG21      ILE 113   9.463   9.150  -0.257
  297   HG22  ILE 113          HG22      ILE 113   8.725   9.617   1.275
  298   HG23  ILE 113          HG23      ILE 113   7.731   8.931  -0.009
  299   HD11  ILE 113          HD11      ILE 113  12.427   7.654   1.170
  300   HD12  ILE 113          HD12      ILE 113  11.350   8.724   0.271
  301   HD13  ILE 113          HD13      ILE 113  11.455   7.015  -0.156
  302    HA   PRO 114           HA       PRO 114   7.052   3.190   3.121
  303    HB2  PRO 114           HB2      PRO 114   4.828   2.458   1.612
  304    HB3  PRO 114           HB1      PRO 114   4.819   3.006   3.286
  305    HG2  PRO 114           HG2      PRO 114   3.855   4.364   0.944
  306    HG3  PRO 114           HG1      PRO 114   3.738   4.861   2.635
  307    HD2  PRO 114           HD2      PRO 114   5.506   5.841   0.565
  308    HD3  PRO 114           HD1      PRO 114   5.243   6.465   2.203
  309    HA   PRO 115           HA       PRO 115   9.315   1.151  -0.211
  310    HB2  PRO 115           HB2      PRO 115   8.118  -1.179   1.228
  311    HB3  PRO 115           HB1      PRO 115   9.770  -0.937   0.673
  312    HG2  PRO 115           HG2      PRO 115   9.193  -0.639   3.228
  313    HG3  PRO 115           HG1      PRO 115  10.287   0.507   2.427
  314    HD2  PRO 115           HD2      PRO 115   7.436   0.852   3.231
  315    HD3  PRO 115           HD1      PRO 115   8.769   2.027   3.228
  316    HA   PRO 116           HA       PRO 116   6.070   0.247  -3.271
  317    HB2  PRO 116           HB2      PRO 116   8.094  -0.904  -4.865
  318    HB3  PRO 116           HB1      PRO 116   7.447   0.738  -5.002
  319    HG2  PRO 116           HG2      PRO 116   9.806  -0.253  -3.463
  320    HG3  PRO 116           HG1      PRO 116   9.649   1.210  -4.473
  321    HD2  PRO 116           HD2      PRO 116   9.402   1.523  -1.967
  322    HD3  PRO 116           HD1      PRO 116   8.124   2.167  -2.966
  323    H    TYR 117           HN       TYR 117   6.086  -1.287  -4.636
  324    HA   TYR 117           HA       TYR 117   5.450  -3.825  -3.361
  325    HB2  TYR 117           HB2      TYR 117   4.162  -4.361  -5.240
  326    HB3  TYR 117           HB1      TYR 117   4.005  -2.618  -5.111
  327    HD1  TYR 117           HD2      TYR 117   5.084  -1.147  -6.790
  328    HD2  TYR 117           HD1      TYR 117   5.258  -5.388  -7.087
  329    HE1  TYR 117           HE2      TYR 117   5.758  -0.958  -9.147
  330    HE2  TYR 117           HE1      TYR 117   5.924  -5.207  -9.440
  331    HH   TYR 117           HH       TYR 117   5.671  -3.507 -11.304
  332    H    VAL 118           HN       VAL 118   6.321  -5.816  -3.744
  333    HA   VAL 118           HA       VAL 118   8.825  -5.882  -5.304
  334    HB   VAL 118           HB       VAL 118   7.855  -7.844  -3.206
  335   HG11  VAL 118          HG11      VAL 118   9.329  -8.867  -4.855
  336   HG12  VAL 118          HG12      VAL 118  10.133  -8.734  -3.290
  337   HG13  VAL 118          HG13      VAL 118  10.527  -7.601  -4.583
  338   HG21  VAL 118          HG21      VAL 118   8.364  -5.684  -2.203
  339   HG22  VAL 118          HG22      VAL 118   9.944  -5.680  -2.985
  340   HG23  VAL 118          HG23      VAL 118   9.573  -6.886  -1.752
  341    H    GLU 119           HN       GLU 119   5.771  -7.443  -4.680
  342    HA   GLU 119           HA       GLU 119   6.057  -9.206  -6.994
  343    HB2  GLU 119           HB2      GLU 119   3.491  -9.447  -5.787
  344    HB3  GLU 119           HB1      GLU 119   4.804 -10.609  -5.779
  345    HG2  GLU 119           HG2      GLU 119   4.180 -10.260  -3.531
  346    HG3  GLU 119           HG1      GLU 119   5.717  -9.435  -3.762
  347    HA   PRO 120           HA       PRO 120   3.882  -6.189  -9.453
  348    HB2  PRO 120           HB2      PRO 120   3.347  -8.452 -11.267
  349    HB3  PRO 120           HB1      PRO 120   4.220  -6.948 -11.575
  350    HG2  PRO 120           HG2      PRO 120   5.502  -9.291 -11.364
  351    HG3  PRO 120           HG1      PRO 120   6.214  -7.783 -10.761
  352    HD2  PRO 120           HD2      PRO 120   4.858  -9.981  -9.241
  353    HD3  PRO 120           HD1      PRO 120   6.317  -9.055  -8.823
  Start of MODEL   16
    1    H    PHE  12           H        PHE  12 -11.775  -8.062   0.484
    2    HA   PHE  12           HA       PHE  12 -13.001  -6.129  -0.191
    3    HB2  PHE  12           HB2      PHE  12 -12.794  -6.800   2.220
    4    HB3  PHE  12           HB1      PHE  12 -11.500  -5.621   2.388
    5    HD1  PHE  12           HD1      PHE  12 -15.015  -5.774   1.130
    6    HD2  PHE  12           HD2      PHE  12 -12.060  -3.580   3.266
    7    HE1  PHE  12           HE1      PHE  12 -16.682  -4.040   1.645
    8    HE2  PHE  12           HE2      PHE  12 -13.723  -1.839   3.780
    9    HZ   PHE  12           HZ       PHE  12 -16.037  -2.070   2.973
   10    H    LEU  13           HN       LEU  13  -9.862  -5.886  -0.854
   11    HA   LEU  13           HA       LEU  13  -9.864  -2.947  -0.983
   12    HB2  LEU  13           HB2      LEU  13  -7.646  -4.952  -0.731
   13    HB3  LEU  13           HB1      LEU  13  -7.330  -3.368  -1.408
   14    HG   LEU  13           HG       LEU  13  -6.711  -3.302   0.891
   15   HD11  LEU  13          HD11      LEU  13  -7.825  -1.307   0.067
   16   HD12  LEU  13          HD12      LEU  13  -8.180  -1.564   1.775
   17   HD13  LEU  13          HD13      LEU  13  -9.388  -1.963   0.555
   18   HD21  LEU  13          HD21      LEU  13  -7.941  -5.229   1.704
   19   HD22  LEU  13          HD22      LEU  13  -9.463  -4.358   1.527
   20   HD23  LEU  13          HD23      LEU  13  -8.271  -3.820   2.711
   21    HA   PRO  14           HA       PRO  14 -10.008  -2.873  -5.434
   22    HB2  PRO  14           HB2      PRO  14  -7.748  -1.009  -4.894
   23    HB3  PRO  14           HB1      PRO  14  -9.023  -0.883  -6.112
   24    HG2  PRO  14           HG2      PRO  14  -9.309   0.418  -3.997
   25    HG3  PRO  14           HG1      PRO  14 -10.661  -0.600  -4.437
   26    HD2  PRO  14           HD2      PRO  14  -8.520  -1.099  -2.371
   27    HD3  PRO  14           HD1      PRO  14 -10.278  -1.352  -2.227
   28    H    LYS  15           HN       LYS  15  -8.983  -3.304  -7.145
   29    HA   LYS  15           HA       LYS  15  -7.320  -5.624  -6.918
   30    HB2  LYS  15           HB2      LYS  15  -8.993  -5.422  -8.687
   31    HB3  LYS  15           HB1      LYS  15  -8.129  -4.051  -9.369
   32    HG2  LYS  15           HG2      LYS  15  -6.278  -5.440  -9.983
   33    HG3  LYS  15           HG1      LYS  15  -6.977  -6.822  -9.134
   34    HD2  LYS  15           HD2      LYS  15  -8.233  -5.424 -11.494
   35    HD3  LYS  15           HD1      LYS  15  -7.302  -6.922 -11.584
   36    HE2  LYS  15           HE2      LYS  15  -8.910  -8.037 -10.152
   37    HE3  LYS  15           HE1      LYS  15  -9.814  -6.534  -9.960
   38    HZ1  LYS  15           HZ1      LYS  15  -9.389  -7.937 -12.545
   39    HZ2  LYS  15           HZ2      LYS  15 -10.354  -6.562 -12.282
   40    HZ3  LYS  15           HZ3      LYS  15 -10.794  -8.051 -11.601
   41    H    GLY  16           HN       GLY  16  -5.188  -5.788  -6.879
   42    HA2  GLY  16           HA2      GLY  16  -2.968  -5.298  -7.396
   43    HA3  GLY  16           HA1      GLY  16  -3.479  -3.809  -8.173
   44    H    TRP  17           HN       TRP  17  -5.083  -3.669  -5.377
   45    HA   TRP  17           HA       TRP  17  -2.979  -2.134  -4.074
   46    HB2  TRP  17           HB2      TRP  17  -5.923  -2.464  -3.525
   47    HB3  TRP  17           HB1      TRP  17  -4.844  -1.645  -2.403
   48    HD1  TRP  17           HD1      TRP  17  -6.012  -1.309  -6.096
   49    HE1  TRP  17           HE1      TRP  17  -6.049   1.193  -6.665
   50    HE3  TRP  17           HE3      TRP  17  -4.004   0.552  -1.760
   51    HZ2  TRP  17           HZ2      TRP  17  -5.284   3.633  -5.474
   52    HZ3  TRP  17           HZ3      TRP  17  -3.679   2.984  -1.572
   53    HH2  TRP  17           HH2      TRP  17  -4.304   4.491  -3.393
   54    H    GLU  18           HN       GLU  18  -1.682  -3.069  -2.749
   55    HA   GLU  18           HA       GLU  18  -2.494  -5.606  -1.530
   56    HB2  GLU  18           HB2      GLU  18   0.036  -4.563  -2.621
   57    HB3  GLU  18           HB1      GLU  18   0.158  -5.636  -1.253
   58    HG2  GLU  18           HG2      GLU  18  -1.152  -6.218  -3.886
   59    HG3  GLU  18           HG1      GLU  18   0.350  -6.894  -3.265
   60    H    VAL  19           HN       VAL  19  -2.065  -6.044   0.517
   61    HA   VAL  19           HA       VAL  19  -1.510  -3.752   2.291
   62    HB   VAL  19           HB       VAL  19  -3.277  -6.074   3.048
   63   HG11  VAL  19          HG11      VAL  19  -4.069  -4.570   4.785
   64   HG12  VAL  19          HG12      VAL  19  -2.992  -3.308   4.190
   65   HG13  VAL  19          HG13      VAL  19  -2.321  -4.787   4.874
   66   HG21  VAL  19          HG21      VAL  19  -4.157  -3.435   1.898
   67   HG22  VAL  19          HG22      VAL  19  -5.223  -4.663   2.587
   68   HG23  VAL  19          HG23      VAL  19  -4.304  -5.011   1.121
   69    H    ARG  20           HN       ARG  20   0.633  -4.210   2.720
   70    HA   ARG  20           HA       ARG  20   1.175  -6.879   3.842
   71    HB2  ARG  20           HB2      ARG  20   2.432  -5.862   1.704
   72    HB3  ARG  20           HB1      ARG  20   3.423  -5.141   2.974
   73    HG2  ARG  20           HG2      ARG  20   3.487  -7.577   3.912
   74    HG3  ARG  20           HG1      ARG  20   3.055  -8.011   2.258
   75    HD2  ARG  20           HD2      ARG  20   5.514  -6.619   3.257
   76    HD3  ARG  20           HD1      ARG  20   5.391  -8.107   2.322
   77    HE   ARG  20           HE       ARG  20   4.668  -5.501   1.169
   78   HH11  ARG  20          HH11      ARG  20   6.248  -8.604   0.910
   79   HH12  ARG  20          HH12      ARG  20   7.018  -8.209  -0.608
   80   HH21  ARG  20          HH21      ARG  20   5.739  -4.955  -0.755
   81   HH22  ARG  20          HH22      ARG  20   6.736  -6.138  -1.548
   82    H    HIS  21           HN       HIS  21   1.772  -7.002   5.928
   83    HA   HIS  21           HA       HIS  21   2.161  -4.505   7.402
   84    HB2  HIS  21           HB2      HIS  21   0.863  -6.841   8.042
   85    HB3  HIS  21           HB1      HIS  21   2.416  -7.068   8.829
   86    HD1  HIS  21           HD1      HIS  21   1.551  -7.008  11.125
   87    HD2  HIS  21           HD2      HIS  21   0.584  -3.491   9.018
   88    HE1  HIS  21           HE1      HIS  21   0.522  -5.458  12.808
   89    HE2  HIS  21           HE2      HIS  21  -0.319  -3.513  11.452
   90    H    ALA  22           HN       ALA  22   4.185  -3.742   7.365
   91    HA   ALA  22           HA       ALA  22   6.477  -5.247   6.709
   92    HB1  ALA  22           HB1      ALA  22   6.267  -2.563   8.081
   93    HB2  ALA  22           HB2      ALA  22   6.307  -2.835   6.337
   94    HB3  ALA  22           HB3      ALA  22   7.718  -3.222   7.323
   95    HA   PRO  23           HA       PRO  23   7.912  -6.982  10.555
   96    HB2  PRO  23           HB2      PRO  23  10.461  -5.486  10.336
   97    HB3  PRO  23           HB1      PRO  23  10.180  -7.228  10.454
   98    HG2  PRO  23           HG2      PRO  23  10.915  -6.106   8.146
   99    HG3  PRO  23           HG1      PRO  23   9.751  -7.445   8.188
  100    HD2  PRO  23           HD2      PRO  23   9.264  -4.516   7.818
  101    HD3  PRO  23           HD1      PRO  23   8.484  -5.897   7.020
  102    H    ASN  24           HN       ASN  24   7.999  -3.548  10.150
  103    HA   ASN  24           HA       ASN  24   8.399  -2.978  12.950
  104    HB2  ASN  24           HB2      ASN  24   7.841  -0.624  12.312
  105    HB3  ASN  24           HB1      ASN  24   9.194  -1.293  11.413
  106   HD21  ASN  24          HD21      ASN  24   8.916   0.259   9.799
  107   HD22  ASN  24          HD22      ASN  24   7.630   0.160   8.647
  108    H    GLY  25           HN       GLY  25   5.962  -4.112  11.031
  109    HA2  GLY  25           HA2      GLY  25   3.862  -4.796  11.679
  110    HA3  GLY  25           HA1      GLY  25   4.053  -3.892  13.156
  111    H    ARG  26           HN       ARG  26   4.489  -2.571   9.969
  112    HA   ARG  26           HA       ARG  26   1.968  -1.066  10.242
  113    HB2  ARG  26           HB2      ARG  26   4.626  -0.385   9.046
  114    HB3  ARG  26           HB1      ARG  26   3.184   0.326   8.345
  115    HG2  ARG  26           HG2      ARG  26   4.184   1.845   9.915
  116    HG3  ARG  26           HG1      ARG  26   2.623   1.306  10.520
  117    HD2  ARG  26           HD2      ARG  26   3.657  -0.162  12.089
  118    HD3  ARG  26           HD1      ARG  26   5.244   0.083  11.355
  119    HE   ARG  26           HE       ARG  26   4.026   2.506  12.331
  120   HH11  ARG  26          HH11      ARG  26   5.932  -0.284  13.268
  121   HH12  ARG  26          HH12      ARG  26   6.804   0.571  14.507
  122   HH21  ARG  26          HH21      ARG  26   5.124   3.610  13.970
  123   HH22  ARG  26          HH22      ARG  26   6.321   2.785  14.931
  124    HA   PRO  27           HA       PRO  27   0.976  -3.262   6.445
  125    HB2  PRO  27           HB2      PRO  27  -1.640  -2.574   6.332
  126    HB3  PRO  27           HB1      PRO  27  -1.052  -3.840   7.408
  127    HG2  PRO  27           HG2      PRO  27  -1.924  -1.085   8.033
  128    HG3  PRO  27           HG1      PRO  27  -1.943  -2.531   9.056
  129    HD2  PRO  27           HD2      PRO  27  -0.041  -0.489   9.102
  130    HD3  PRO  27           HD1      PRO  27   0.053  -1.955   9.980
  131    H    PHE  28           HN       PHE  28   2.071  -2.100   4.993
  132    HA   PHE  28           HA       PHE  28   1.114   0.541   4.229
  133    HB2  PHE  28           HB2      PHE  28   3.215   0.697   2.920
  134    HB3  PHE  28           HB1      PHE  28   3.497   0.416   4.624
  135    HD1  PHE  28           HD2      PHE  28   3.652  -2.293   5.167
  136    HD2  PHE  28           HD1      PHE  28   4.636  -0.381   1.482
  137    HE1  PHE  28           HE2      PHE  28   5.148  -4.149   4.600
  138    HE2  PHE  28           HE1      PHE  28   6.120  -2.253   0.918
  139    HZ   PHE  28           HZ       PHE  28   6.382  -4.135   2.475
  140    H    PHE  29           HN       PHE  29  -0.107   0.843   2.528
  141    HA   PHE  29           HA       PHE  29  -0.840  -1.499   0.976
  142    HB2  PHE  29           HB2      PHE  29  -2.099   1.259   0.994
  143    HB3  PHE  29           HB1      PHE  29  -2.739  -0.184   0.209
  144    HD1  PHE  29           HD2      PHE  29  -1.754   1.071   3.584
  145    HD2  PHE  29           HD1      PHE  29  -4.280  -1.473   1.295
  146    HE1  PHE  29           HE2      PHE  29  -3.008   0.487   5.618
  147    HE2  PHE  29           HE1      PHE  29  -5.540  -2.053   3.324
  148    HZ   PHE  29           HZ       PHE  29  -4.901  -1.077   5.485
  149    H    ILE  30           HN       ILE  30   0.081  -1.870  -0.863
  150    HA   ILE  30           HA       ILE  30   1.326   0.357  -2.313
  151    HB   ILE  30           HB       ILE  30   1.692  -2.579  -2.912
  152   HG12  ILE  30          HG12      ILE  30   3.543  -0.864  -1.321
  153   HG13  ILE  30          HG11      ILE  30   2.355  -1.896  -0.545
  154   HG21  ILE  30          HG21      ILE  30   3.335  -0.124  -3.554
  155   HG22  ILE  30          HG22      ILE  30   2.300  -1.002  -4.681
  156   HG23  ILE  30          HG23      ILE  30   3.734  -1.780  -4.011
  157   HD11  ILE  30          HD11      ILE  30   4.601  -2.789  -2.340
  158   HD12  ILE  30          HD12      ILE  30   3.395  -3.846  -1.606
  159   HD13  ILE  30          HD13      ILE  30   4.530  -2.961  -0.587
  160    H    ASP  31           HN       ASP  31   0.561   0.994  -4.174
  161    HA   ASP  31           HA       ASP  31  -1.627  -0.492  -5.422
  162    HB2  ASP  31           HB2      ASP  31  -2.012   1.877  -5.378
  163    HB3  ASP  31           HB1      ASP  31  -0.414   2.208  -6.047
  164    H    HIS  32           HN       HIS  32  -1.087  -2.086  -6.669
  165    HA   HIS  32           HA       HIS  32   1.574  -2.187  -7.842
  166    HB2  HIS  32           HB2      HIS  32  -0.621  -4.240  -7.483
  167    HB3  HIS  32           HB1      HIS  32   0.872  -4.588  -8.338
  168    HD1  HIS  32           HD1      HIS  32   1.863  -6.267  -6.640
  169    HD2  HIS  32           HD2      HIS  32   0.807  -2.635  -4.907
  170    HE1  HIS  32           HE1      HIS  32   2.794  -6.281  -4.270
  171    HE2  HIS  32           HE2      HIS  32   1.899  -4.214  -3.221
  172    H    ASN  33           HN       ASN  33  -1.167  -0.821  -8.760
  173    HA   ASN  33           HA       ASN  33  -1.196  -1.724 -11.530
  174    HB2  ASN  33           HB2      ASN  33  -2.770   0.533 -10.269
  175    HB3  ASN  33           HB1      ASN  33  -3.040  -0.174 -11.854
  176   HD21  ASN  33          HD21      ASN  33  -3.498  -0.481  -8.461
  177   HD22  ASN  33          HD22      ASN  33  -4.564  -1.862  -8.523
  178    H    THR  34           HN       THR  34  -1.093   1.501 -10.034
  179    HA   THR  34           HA       THR  34   0.385   2.481 -12.376
  180    HB   THR  34           HB       THR  34  -0.887   4.165 -10.215
  181    HG1  THR  34           HG1      THR  34  -2.512   2.802 -11.062
  182   HG21  THR  34          HG21      THR  34   0.623   5.300 -11.775
  183   HG22  THR  34          HG22      THR  34  -1.046   5.819 -12.010
  184   HG23  THR  34          HG23      THR  34  -0.311   4.677 -13.134
  185    H    LYS  35           HN       LYS  35   0.823   1.494  -9.251
  186    HA   LYS  35           HA       LYS  35   2.634   1.335  -7.927
  187    HB2  LYS  35           HB2      LYS  35   4.069   3.154  -9.844
  188    HB3  LYS  35           HB1      LYS  35   4.798   2.227  -8.538
  189    HG2  LYS  35           HG2      LYS  35   3.752   0.187  -9.749
  190    HG3  LYS  35           HG1      LYS  35   3.689   1.284 -11.135
  191    HD2  LYS  35           HD2      LYS  35   6.098   1.764 -10.773
  192    HD3  LYS  35           HD1      LYS  35   6.088   0.512  -9.523
  193    HE2  LYS  35           HE2      LYS  35   5.605  -1.187 -11.107
  194    HE3  LYS  35           HE1      LYS  35   5.208  -0.007 -12.354
  195    HZ1  LYS  35           HZ1      LYS  35   7.345  -0.880 -12.830
  196    HZ2  LYS  35           HZ2      LYS  35   7.891  -0.613 -11.249
  197    HZ3  LYS  35           HZ3      LYS  35   7.574   0.705 -12.265
  198    H    THR  36           HN       THR  36   1.914   2.178  -6.223
  199    HA   THR  36           HA       THR  36   2.460   4.942  -5.534
  200    HB   THR  36           HB       THR  36  -0.329   4.058  -4.959
  201    HG1  THR  36           HG1      THR  36  -0.066   3.830  -7.274
  202   HG21  THR  36          HG21      THR  36   0.938   6.740  -5.495
  203   HG22  THR  36          HG22      THR  36   0.534   6.071  -3.914
  204   HG23  THR  36          HG23      THR  36  -0.749   6.478  -5.054
  205    H    THR  37           HN       THR  37   2.428   5.250  -3.241
  206    HA   THR  37           HA       THR  37   1.960   2.824  -1.676
  207    HB   THR  37           HB       THR  37   4.000   3.512  -0.276
  208    HG1  THR  37           HG1      THR  37   5.536   4.732  -1.315
  209   HG21  THR  37          HG21      THR  37   5.509   2.244  -1.738
  210   HG22  THR  37          HG22      THR  37   4.361   2.424  -3.067
  211   HG23  THR  37          HG23      THR  37   3.916   1.496  -1.635
  212    H    THR  38           HN       THR  38   0.835   3.114   0.135
  213    HA   THR  38           HA       THR  38   0.693   5.720   1.421
  214    HB   THR  38           HB       THR  38  -1.005   5.749  -0.436
  215    HG1  THR  38           HG1      THR  38  -1.317   6.513   2.063
  216   HG21  THR  38          HG21      THR  38  -2.304   3.564   1.188
  217   HG22  THR  38          HG22      THR  38  -1.640   3.411  -0.439
  218   HG23  THR  38          HG23      THR  38  -3.058   4.423  -0.156
  219    H    TRP  39           HN       TRP  39  -0.151   5.567   3.601
  220    HA   TRP  39           HA       TRP  39  -0.149   2.811   4.648
  221    HB2  TRP  39           HB2      TRP  39  -0.288   5.339   6.282
  222    HB3  TRP  39           HB1      TRP  39   0.178   3.731   6.815
  223    HD1  TRP  39           HD1      TRP  39   1.512   6.817   5.042
  224    HE1  TRP  39           HE1      TRP  39   4.097   6.681   5.009
  225    HE3  TRP  39           HE3      TRP  39   2.080   2.034   6.749
  226    HZ2  TRP  39           HZ2      TRP  39   6.105   4.747   5.640
  227    HZ3  TRP  39           HZ3      TRP  39   4.342   1.118   7.009
  228    HH2  TRP  39           HH2      TRP  39   6.309   2.444   6.464
  229    H    GLU  40           HN       GLU  40  -2.108   5.502   4.004
  230    HA   GLU  40           HA       GLU  40  -4.175   4.782   5.888
  231    HB2  GLU  40           HB2      GLU  40  -5.302   6.823   4.673
  232    HB3  GLU  40           HB1      GLU  40  -4.012   7.070   5.841
  233    HG2  GLU  40           HG2      GLU  40  -3.438   6.831   2.925
  234    HG3  GLU  40           HG1      GLU  40  -3.924   8.365   3.635
  235    H    ASP  41           HN       ASP  41  -5.879   3.690   5.464
  236    HA   ASP  41           HA       ASP  41  -6.078   1.984   3.309
  237    HB2  ASP  41           HB2      ASP  41  -8.296   2.893   5.147
  238    HB3  ASP  41           HB1      ASP  41  -8.341   1.462   4.133
  239    HA   PRO  42           HA       PRO  42  -7.811   4.565   0.097
  240    HB2  PRO  42           HB2      PRO  42  -8.455   2.516  -1.600
  241    HB3  PRO  42           HB1      PRO  42  -6.827   3.187  -1.447
  242    HG2  PRO  42           HG2      PRO  42  -7.991   0.727  -0.196
  243    HG3  PRO  42           HG1      PRO  42  -6.398   0.957  -0.942
  244    HD2  PRO  42           HD2      PRO  42  -6.724   0.975   1.732
  245    HD3  PRO  42           HD1      PRO  42  -5.534   2.022   0.929
  246    H    ARG  43           HN       ARG  43  -9.361   2.258   2.024
  247    HA   ARG  43           HA       ARG  43 -11.944   2.322   0.821
  248    HB2  ARG  43           HB2      ARG  43 -10.938   1.418   3.508
  249    HB3  ARG  43           HB1      ARG  43 -12.648   1.384   3.095
  250    HG2  ARG  43           HG2      ARG  43 -10.433  -0.086   1.681
  251    HG3  ARG  43           HG1      ARG  43 -11.667  -0.789   2.730
  252    HD2  ARG  43           HD2      ARG  43 -12.086   0.558   0.063
  253    HD3  ARG  43           HD1      ARG  43 -12.300  -1.153   0.436
  254    HE   ARG  43           HE       ARG  43 -14.076  -0.211   2.076
  255   HH11  ARG  43          HH11      ARG  43 -13.320   1.137  -1.074
  256   HH12  ARG  43          HH12      ARG  43 -14.938   1.706  -1.352
  257   HH21  ARG  43          HH21      ARG  43 -16.199   0.510   1.702
  258   HH22  ARG  43          HH22      ARG  43 -16.589   1.319   0.215
  259    H    LEU  44           HN       LEU  44 -10.213   4.588   2.577
  260    HA   LEU  44           HA       LEU  44 -12.448   5.802   3.885
  261    HB2  LEU  44           HB2      LEU  44  -9.676   6.875   3.390
  262    HB3  LEU  44           HB1      LEU  44 -10.876   7.630   4.422
  263    HG   LEU  44           HG       LEU  44  -9.600   4.932   4.888
  264   HD11  LEU  44          HD11      LEU  44  -8.058   6.772   5.284
  265   HD12  LEU  44          HD12      LEU  44  -8.545   6.025   6.807
  266   HD13  LEU  44          HD13      LEU  44  -9.251   7.565   6.313
  267   HD21  LEU  44          HD21      LEU  44 -10.753   4.995   7.042
  268   HD22  LEU  44          HD22      LEU  44 -11.893   4.994   5.696
  269   HD23  LEU  44          HD23      LEU  44 -11.557   6.492   6.566
  270    H    LYS  45           HN       LYS  45 -11.437   5.657   0.810
  271    HA   LYS  45           HA       LYS  45 -12.552   8.265   0.077
  272    HB2  LYS  45           HB2      LYS  45 -10.327   7.880  -0.822
  273    HB3  LYS  45           HB1      LYS  45 -10.849   6.359  -1.538
  274    HG2  LYS  45           HG2      LYS  45 -10.705   8.168  -3.182
  275    HG3  LYS  45           HG1      LYS  45 -12.340   7.522  -3.030
  276    HD2  LYS  45           HD2      LYS  45 -12.553   9.487  -1.259
  277    HD3  LYS  45           HD1      LYS  45 -11.260  10.179  -2.239
  278    HE2  LYS  45           HE2      LYS  45 -13.451  10.924  -3.014
  279    HE3  LYS  45           HE1      LYS  45 -12.633   9.952  -4.236
  280    HZ1  LYS  45           HZ1      LYS  45 -13.980   8.074  -3.668
  281    HZ2  LYS  45           HZ2      LYS  45 -15.005   9.394  -3.960
  282    HZ3  LYS  45           HZ3      LYS  45 -14.687   8.899  -2.370
  283    H    GLN 112           H        GLN 112   7.514   5.653   8.110
  284    HA   GLN 112           HA       GLN 112   6.285   8.019   6.836
  285    HB2  GLN 112           HB2      GLN 112   7.807   8.523   8.787
  286    HB3  GLN 112           HB1      GLN 112   9.100   7.728   7.903
  287    HG2  GLN 112           HG2      GLN 112   7.798   9.730   6.283
  288    HG3  GLN 112           HG1      GLN 112   8.396  10.408   7.793
  289   HE21  GLN 112          HE21      GLN 112   9.980  11.604   6.768
  290   HE22  GLN 112          HE22      GLN 112  11.388  10.875   6.060
  291    H    ILE 113           HN       ILE 113   6.268   7.759   4.736
  292    HA   ILE 113           HA       ILE 113   6.809   7.202   2.615
  293    HB   ILE 113           HB       ILE 113   9.563   6.632   3.722
  294   HG12  ILE 113          HG12      ILE 113   8.450   9.026   2.239
  295   HG13  ILE 113          HG11      ILE 113   8.813   8.972   3.962
  296   HG21  ILE 113          HG21      ILE 113   9.200   5.428   1.634
  297   HG22  ILE 113          HG22      ILE 113  10.322   6.767   1.394
  298   HG23  ILE 113          HG23      ILE 113   8.648   6.914   0.861
  299   HD11  ILE 113          HD11      ILE 113  10.560  10.124   2.751
  300   HD12  ILE 113          HD12      ILE 113  10.800   8.719   1.713
  301   HD13  ILE 113          HD13      ILE 113  11.182   8.621   3.432
  302    HA   PRO 114           HA       PRO 114   5.949   2.790   3.241
  303    HB2  PRO 114           HB2      PRO 114   4.203   3.037   0.950
  304    HB3  PRO 114           HB1      PRO 114   3.784   2.694   2.629
  305    HG2  PRO 114           HG2      PRO 114   3.148   5.023   1.344
  306    HG3  PRO 114           HG1      PRO 114   3.344   4.881   3.098
  307    HD2  PRO 114           HD2      PRO 114   5.238   5.961   1.058
  308    HD3  PRO 114           HD1      PRO 114   4.911   6.518   2.713
  309    HA   PRO 115           HA       PRO 115   8.904   1.618  -0.018
  310    HB2  PRO 115           HB2      PRO 115   8.273  -1.032   1.154
  311    HB3  PRO 115           HB1      PRO 115   9.835  -0.281   0.852
  312    HG2  PRO 115           HG2      PRO 115   8.888  -0.487   3.325
  313    HG3  PRO 115           HG1      PRO 115   9.767   0.965   2.812
  314    HD2  PRO 115           HD2      PRO 115   6.825   0.548   3.153
  315    HD3  PRO 115           HD1      PRO 115   7.827   1.961   3.553
  316    HA   PRO 116           HA       PRO 116   5.897   0.275  -3.156
  317    HB2  PRO 116           HB2      PRO 116   8.088  -0.385  -4.806
  318    HB3  PRO 116           HB1      PRO 116   7.149   1.116  -4.848
  319    HG2  PRO 116           HG2      PRO 116   9.658   0.489  -3.356
  320    HG3  PRO 116           HG1      PRO 116   9.232   1.956  -4.278
  321    HD2  PRO 116           HD2      PRO 116   8.942   2.072  -1.757
  322    HD3  PRO 116           HD1      PRO 116   7.561   2.526  -2.728
  323    H    TYR 117           HN       TYR 117   6.187  -1.148  -4.591
  324    HA   TYR 117           HA       TYR 117   6.469  -3.863  -3.449
  325    HB2  TYR 117           HB2      TYR 117   4.722  -4.593  -4.748
  326    HB3  TYR 117           HB1      TYR 117   4.278  -2.901  -4.590
  327    HD1  TYR 117           HD2      TYR 117   4.545  -1.368  -6.526
  328    HD2  TYR 117           HD1      TYR 117   5.382  -5.528  -6.824
  329    HE1  TYR 117           HE2      TYR 117   4.491  -1.203  -8.978
  330    HE2  TYR 117           HE1      TYR 117   5.336  -5.380  -9.265
  331    HH   TYR 117           HH       TYR 117   4.406  -3.943 -11.010
  332    H    VAL 118           HN       VAL 118   7.855  -5.327  -4.246
  333    HA   VAL 118           HA       VAL 118   9.225  -4.694  -6.785
  334    HB   VAL 118           HB       VAL 118  10.712  -4.647  -4.767
  335   HG11  VAL 118          HG11      VAL 118  11.331  -6.769  -3.706
  336   HG12  VAL 118          HG12      VAL 118  10.063  -7.585  -4.619
  337   HG13  VAL 118          HG13      VAL 118   9.641  -6.355  -3.429
  338   HG21  VAL 118          HG21      VAL 118  11.653  -5.092  -6.952
  339   HG22  VAL 118          HG22      VAL 118  11.289  -6.809  -6.783
  340   HG23  VAL 118          HG23      VAL 118  12.482  -6.053  -5.726
  341    H    GLU 119           HN       GLU 119   7.152  -6.701  -5.104
  342    HA   GLU 119           HA       GLU 119   7.681  -9.130  -6.570
  343    HB2  GLU 119           HB2      GLU 119   5.380  -9.711  -5.356
  344    HB3  GLU 119           HB1      GLU 119   6.919  -9.767  -4.529
  345    HG2  GLU 119           HG2      GLU 119   5.203  -7.311  -4.473
  346    HG3  GLU 119           HG1      GLU 119   4.967  -8.630  -3.323
  347    HA   PRO 120           HA       PRO 120   5.035  -7.762  -9.924
  348    HB2  PRO 120           HB2      PRO 120   5.770 -10.302 -11.164
  349    HB3  PRO 120           HB1      PRO 120   6.155  -8.658 -11.681
  350    HG2  PRO 120           HG2      PRO 120   8.026 -10.359 -10.709
  351    HG3  PRO 120           HG1      PRO 120   8.118  -8.601 -10.501
  352    HD2  PRO 120           HD2      PRO 120   7.222 -10.694  -8.553
  353    HD3  PRO 120           HD1      PRO 120   8.231  -9.257  -8.281
  Start of MODEL   17
    1    H    PHE  12           H        PHE  12 -12.597  -6.174  -0.853
    2    HA   PHE  12           HA       PHE  12 -14.782  -4.676  -2.154
    3    HB2  PHE  12           HB2      PHE  12 -15.335  -5.601   0.097
    4    HB3  PHE  12           HB1      PHE  12 -13.950  -4.741   0.756
    5    HD1  PHE  12           HD1      PHE  12 -17.055  -4.089  -1.207
    6    HD2  PHE  12           HD2      PHE  12 -14.293  -2.676   1.709
    7    HE1  PHE  12           HE1      PHE  12 -18.473  -2.115  -0.825
    8    HE2  PHE  12           HE2      PHE  12 -15.707  -0.700   2.094
    9    HZ   PHE  12           HZ       PHE  12 -17.799  -0.418   0.827
   10    H    LEU  13           HN       LEU  13 -11.566  -4.847  -1.941
   11    HA   LEU  13           HA       LEU  13 -11.290  -1.920  -1.881
   12    HB2  LEU  13           HB2      LEU  13  -9.073  -2.135  -0.951
   13    HB3  LEU  13           HB1      LEU  13 -10.232  -2.941   0.084
   14    HG   LEU  13           HG       LEU  13  -9.370  -5.028  -1.428
   15   HD11  LEU  13          HD11      LEU  13  -6.941  -4.885  -1.579
   16   HD12  LEU  13          HD12      LEU  13  -7.005  -3.203  -1.052
   17   HD13  LEU  13          HD13      LEU  13  -7.719  -3.673  -2.594
   18   HD21  LEU  13          HD21      LEU  13  -8.110  -3.978   1.103
   19   HD22  LEU  13          HD22      LEU  13  -8.031  -5.639   0.517
   20   HD23  LEU  13          HD23      LEU  13  -9.578  -4.951   1.008
   21    HA   PRO  14           HA       PRO  14  -9.907  -1.722  -5.969
   22    HB2  PRO  14           HB2      PRO  14  -7.434  -0.476  -4.916
   23    HB3  PRO  14           HB1      PRO  14  -8.466   0.019  -6.264
   24    HG2  PRO  14           HG2      PRO  14  -8.665   1.206  -4.036
   25    HG3  PRO  14           HG1      PRO  14 -10.149   0.757  -4.838
   26    HD2  PRO  14           HD2      PRO  14  -8.812  -0.509  -2.471
   27    HD3  PRO  14           HD1      PRO  14 -10.547  -0.254  -2.771
   28    H    LYS  15           HN       LYS  15  -8.641  -2.321  -7.426
   29    HA   LYS  15           HA       LYS  15  -7.452  -4.922  -6.984
   30    HB2  LYS  15           HB2      LYS  15  -7.770  -3.245  -9.471
   31    HB3  LYS  15           HB1      LYS  15  -7.037  -4.842  -9.466
   32    HG2  LYS  15           HG2      LYS  15  -9.129  -5.799  -8.644
   33    HG3  LYS  15           HG1      LYS  15  -9.863  -4.192  -8.659
   34    HD2  LYS  15           HD2      LYS  15 -10.486  -5.384 -10.672
   35    HD3  LYS  15           HD1      LYS  15  -9.406  -4.046 -11.074
   36    HE2  LYS  15           HE2      LYS  15  -7.514  -5.695 -11.056
   37    HE3  LYS  15           HE1      LYS  15  -8.722  -6.972 -10.916
   38    HZ1  LYS  15           HZ1      LYS  15  -8.087  -6.668 -13.209
   39    HZ2  LYS  15           HZ2      LYS  15  -8.478  -5.023 -13.141
   40    HZ3  LYS  15           HZ3      LYS  15  -9.704  -6.189 -13.005
   41    H    GLY  16           HN       GLY  16  -5.328  -5.519  -7.244
   42    HA2  GLY  16           HA2      GLY  16  -3.040  -5.285  -7.282
   43    HA3  GLY  16           HA1      GLY  16  -3.258  -3.727  -8.065
   44    H    TRP  17           HN       TRP  17  -5.048  -3.692  -5.279
   45    HA   TRP  17           HA       TRP  17  -2.999  -2.171  -3.890
   46    HB2  TRP  17           HB2      TRP  17  -5.961  -2.452  -3.633
   47    HB3  TRP  17           HB1      TRP  17  -5.042  -1.906  -2.234
   48    HD1  TRP  17           HD1      TRP  17  -5.589  -0.898  -5.943
   49    HE1  TRP  17           HE1      TRP  17  -5.367   1.655  -6.103
   50    HE3  TRP  17           HE3      TRP  17  -4.273   0.113  -1.108
   51    HZ2  TRP  17           HZ2      TRP  17  -4.717   3.819  -4.412
   52    HZ3  TRP  17           HZ3      TRP  17  -3.870   2.449  -0.463
   53    HH2  TRP  17           HH2      TRP  17  -4.087   4.266  -2.080
   54    H    GLU  18           HN       GLU  18  -1.682  -3.154  -2.600
   55    HA   GLU  18           HA       GLU  18  -2.548  -5.643  -1.300
   56    HB2  GLU  18           HB2      GLU  18  -0.009  -4.730  -2.483
   57    HB3  GLU  18           HB1      GLU  18   0.125  -5.692  -1.028
   58    HG2  GLU  18           HG2      GLU  18  -1.369  -6.504  -3.504
   59    HG3  GLU  18           HG1      GLU  18   0.259  -7.005  -3.075
   60    H    VAL  19           HN       VAL  19  -2.012  -6.042   0.780
   61    HA   VAL  19           HA       VAL  19  -1.339  -3.678   2.410
   62    HB   VAL  19           HB       VAL  19  -3.010  -5.989   3.390
   63   HG11  VAL  19          HG11      VAL  19  -1.902  -4.677   5.111
   64   HG12  VAL  19          HG12      VAL  19  -3.647  -4.419   5.158
   65   HG13  VAL  19          HG13      VAL  19  -2.594  -3.196   4.444
   66   HG21  VAL  19          HG21      VAL  19  -4.004  -3.367   2.283
   67   HG22  VAL  19          HG22      VAL  19  -4.994  -4.591   3.082
   68   HG23  VAL  19          HG23      VAL  19  -4.212  -4.955   1.544
   69    H    ARG  20           HN       ARG  20   0.807  -4.044   2.726
   70    HA   ARG  20           HA       ARG  20   1.545  -6.688   3.785
   71    HB2  ARG  20           HB2      ARG  20   2.628  -5.848   1.612
   72    HB3  ARG  20           HB1      ARG  20   3.470  -4.682   2.634
   73    HG2  ARG  20           HG2      ARG  20   4.971  -6.445   2.442
   74    HG3  ARG  20           HG1      ARG  20   4.220  -6.704   4.007
   75    HD2  ARG  20           HD2      ARG  20   4.406  -8.789   2.716
   76    HD3  ARG  20           HD1      ARG  20   2.729  -8.362   3.064
   77    HE   ARG  20           HE       ARG  20   3.961  -7.737   0.461
   78   HH11  ARG  20          HH11      ARG  20   1.456  -9.283   2.351
   79   HH12  ARG  20          HH12      ARG  20   0.467  -9.651   0.976
   80   HH21  ARG  20          HH21      ARG  20   2.643  -8.196  -1.361
   81   HH22  ARG  20          HH22      ARG  20   1.108  -8.990  -1.117
   82    H    HIS  21           HN       HIS  21   2.827  -6.793   5.614
   83    HA   HIS  21           HA       HIS  21   2.810  -4.356   7.275
   84    HB2  HIS  21           HB2      HIS  21   2.227  -7.109   7.807
   85    HB3  HIS  21           HB1      HIS  21   3.655  -6.673   8.722
   86    HD1  HIS  21           HD1      HIS  21   1.718  -7.432  10.532
   87    HD2  HIS  21           HD2      HIS  21   1.435  -3.534   8.952
   88    HE1  HIS  21           HE1      HIS  21   0.224  -6.155  12.083
   89    HE2  HIS  21           HE2      HIS  21  -0.168  -3.961  10.935
   90    H    ALA  22           HN       ALA  22   4.707  -3.298   7.143
   91    HA   ALA  22           HA       ALA  22   7.148  -4.465   6.311
   92    HB1  ALA  22           HB1      ALA  22   8.160  -2.340   6.987
   93    HB2  ALA  22           HB2      ALA  22   6.679  -1.898   7.836
   94    HB3  ALA  22           HB3      ALA  22   6.672  -2.070   6.081
   95    HA   PRO  23           HA       PRO  23   8.764  -6.411   9.891
   96    HB2  PRO  23           HB2      PRO  23  11.256  -4.819   9.701
   97    HB3  PRO  23           HB1      PRO  23  11.030  -6.571   9.665
   98    HG2  PRO  23           HG2      PRO  23  11.617  -5.229   7.443
   99    HG3  PRO  23           HG1      PRO  23  10.473  -6.586   7.415
  100    HD2  PRO  23           HD2      PRO  23   9.925  -3.641   7.372
  101    HD3  PRO  23           HD1      PRO  23   9.138  -4.948   6.461
  102    H    ASN  24           HN       ASN  24   8.549  -2.985   9.871
  103    HA   ASN  24           HA       ASN  24   9.247  -2.647  12.649
  104    HB2  ASN  24           HB2      ASN  24   8.679  -0.330  12.373
  105    HB3  ASN  24           HB1      ASN  24   9.593  -0.825  10.956
  106   HD21  ASN  24          HD21      ASN  24   7.792   1.407  11.288
  107   HD22  ASN  24          HD22      ASN  24   6.543   1.212  10.101
  108    H    GLY  25           HN       GLY  25   6.638  -3.747  10.875
  109    HA2  GLY  25           HA2      GLY  25   4.831  -4.841  11.923
  110    HA3  GLY  25           HA1      GLY  25   5.047  -3.789  13.305
  111    H    ARG  26           HN       ARG  26   4.979  -2.438  10.110
  112    HA   ARG  26           HA       ARG  26   2.249  -1.453  10.633
  113    HB2  ARG  26           HB2      ARG  26   4.619   0.013   9.457
  114    HB3  ARG  26           HB1      ARG  26   2.967   0.606   9.340
  115    HG2  ARG  26           HG2      ARG  26   4.461   0.081  11.904
  116    HG3  ARG  26           HG1      ARG  26   4.175   1.665  11.176
  117    HD2  ARG  26           HD2      ARG  26   2.067  -0.255  12.173
  118    HD3  ARG  26           HD1      ARG  26   2.579   1.233  12.968
  119    HE   ARG  26           HE       ARG  26   1.801   2.187  10.614
  120   HH11  ARG  26          HH11      ARG  26   0.237  -0.156  12.718
  121   HH12  ARG  26          HH12      ARG  26  -1.373   0.279  12.213
  122   HH21  ARG  26          HH21      ARG  26  -0.303   2.737   9.940
  123   HH22  ARG  26          HH22      ARG  26  -1.679   1.915  10.614
  124    HA   PRO  27           HA       PRO  27   1.439  -2.965   6.493
  125    HB2  PRO  27           HB2      PRO  27  -1.140  -2.285   6.342
  126    HB3  PRO  27           HB1      PRO  27  -0.626  -3.551   7.463
  127    HG2  PRO  27           HG2      PRO  27  -1.144  -0.643   8.023
  128    HG3  PRO  27           HG1      PRO  27  -1.740  -2.065   8.908
  129    HD2  PRO  27           HD2      PRO  27   0.448  -0.728   9.719
  130    HD3  PRO  27           HD1      PRO  27   0.282  -2.418   9.951
  131    H    PHE  28           HN       PHE  28   2.264  -1.885   4.916
  132    HA   PHE  28           HA       PHE  28   1.282   0.790   4.255
  133    HB2  PHE  28           HB2      PHE  28   3.284   0.926   2.765
  134    HB3  PHE  28           HB1      PHE  28   3.691   0.760   4.462
  135    HD1  PHE  28           HD1      PHE  28   3.782  -1.982   5.079
  136    HD2  PHE  28           HD2      PHE  28   4.792  -0.123   1.381
  137    HE1  PHE  28           HE1      PHE  28   5.280  -3.852   4.548
  138    HE2  PHE  28           HE2      PHE  28   6.275  -2.006   0.847
  139    HZ   PHE  28           HZ       PHE  28   6.524  -3.871   2.428
  140    H    PHE  29           HN       PHE  29  -0.043   0.988   2.592
  141    HA   PHE  29           HA       PHE  29  -0.801  -1.460   1.216
  142    HB2  PHE  29           HB2      PHE  29  -2.112   1.274   1.180
  143    HB3  PHE  29           HB1      PHE  29  -2.751  -0.192   0.440
  144    HD1  PHE  29           HD2      PHE  29  -1.624   1.058   3.777
  145    HD2  PHE  29           HD1      PHE  29  -4.303  -1.405   1.575
  146    HE1  PHE  29           HE2      PHE  29  -2.812   0.497   5.857
  147    HE2  PHE  29           HE1      PHE  29  -5.497  -1.967   3.648
  148    HZ   PHE  29           HZ       PHE  29  -4.749  -1.020   5.790
  149    H    ILE  30           HN       ILE  30   0.103  -1.917  -0.612
  150    HA   ILE  30           HA       ILE  30   1.386   0.213  -2.128
  151    HB   ILE  30           HB       ILE  30   1.576  -2.734  -2.719
  152   HG12  ILE  30          HG12      ILE  30   3.462  -1.090  -1.065
  153   HG13  ILE  30          HG11      ILE  30   2.277  -2.180  -0.363
  154   HG21  ILE  30          HG21      ILE  30   3.341  -0.369  -3.368
  155   HG22  ILE  30          HG22      ILE  30   2.273  -1.208  -4.492
  156   HG23  ILE  30          HG23      ILE  30   3.671  -2.043  -3.813
  157   HD11  ILE  30          HD11      ILE  30   3.357  -4.057  -1.499
  158   HD12  ILE  30          HD12      ILE  30   4.472  -3.206  -0.429
  159   HD13  ILE  30          HD13      ILE  30   4.554  -2.951  -2.173
  160    H    ASP  31           HN       ASP  31   0.561   0.991  -3.836
  161    HA   ASP  31           HA       ASP  31  -1.607  -0.362  -5.244
  162    HB2  ASP  31           HB2      ASP  31  -2.104   1.915  -5.127
  163    HB3  ASP  31           HB1      ASP  31  -0.425   2.395  -5.353
  164    H    HIS  32           HN       HIS  32  -0.942  -1.931  -6.498
  165    HA   HIS  32           HA       HIS  32   1.733  -1.901  -7.607
  166    HB2  HIS  32           HB2      HIS  32  -0.453  -3.997  -7.619
  167    HB3  HIS  32           HB1      HIS  32   1.119  -4.233  -8.366
  168    HD1  HIS  32           HD1      HIS  32   2.163  -5.977  -6.816
  169    HD2  HIS  32           HD2      HIS  32   0.548  -2.746  -4.749
  170    HE1  HIS  32           HE1      HIS  32   2.774  -6.303  -4.367
  171    HE2  HIS  32           HE2      HIS  32   1.577  -4.480  -3.161
  172    H    ASN  33           HN       ASN  33  -1.031  -0.515  -8.566
  173    HA   ASN  33           HA       ASN  33  -0.885  -1.233 -11.389
  174    HB2  ASN  33           HB2      ASN  33  -2.618   0.906 -10.144
  175    HB3  ASN  33           HB1      ASN  33  -2.832   0.129 -11.707
  176   HD21  ASN  33          HD21      ASN  33  -3.263  -0.102  -8.299
  177   HD22  ASN  33          HD22      ASN  33  -4.277  -1.519  -8.312
  178    H    THR  34           HN       THR  34  -0.716   1.763  -9.456
  179    HA   THR  34           HA       THR  34   0.646   3.071 -11.707
  180    HB   THR  34           HB       THR  34  -0.260   4.570  -9.282
  181    HG1  THR  34           HG1      THR  34  -2.127   3.498  -9.634
  182   HG21  THR  34          HG21      THR  34  -0.308   5.179 -12.243
  183   HG22  THR  34          HG22      THR  34   0.899   5.749 -11.090
  184   HG23  THR  34          HG23      THR  34  -0.773   6.292 -10.955
  185    H    LYS  35           HN       LYS  35   1.452   1.407  -9.033
  186    HA   LYS  35           HA       LYS  35   3.379   1.118  -7.870
  187    HB2  LYS  35           HB2      LYS  35   4.388   3.222  -9.780
  188    HB3  LYS  35           HB1      LYS  35   5.404   2.524  -8.533
  189    HG2  LYS  35           HG2      LYS  35   5.881   1.380 -10.544
  190    HG3  LYS  35           HG1      LYS  35   4.944   0.278  -9.538
  191    HD2  LYS  35           HD2      LYS  35   2.939   0.785 -10.818
  192    HD3  LYS  35           HD1      LYS  35   3.836   1.952 -11.790
  193    HE2  LYS  35           HE2      LYS  35   4.358  -1.015 -11.649
  194    HE3  LYS  35           HE1      LYS  35   3.563  -0.166 -12.974
  195    HZ1  LYS  35           HZ1      LYS  35   5.869  -0.588 -13.494
  196    HZ2  LYS  35           HZ2      LYS  35   6.374   0.223 -12.093
  197    HZ3  LYS  35           HZ3      LYS  35   5.612   1.085 -13.339
  198    H    THR  36           HN       THR  36   1.289   2.880  -7.005
  199    HA   THR  36           HA       THR  36   2.661   5.084  -5.647
  200    HB   THR  36           HB       THR  36  -0.219   4.522  -5.172
  201    HG1  THR  36           HG1      THR  36  -0.212   4.313  -7.392
  202   HG21  THR  36          HG21      THR  36  -0.341   6.974  -5.214
  203   HG22  THR  36          HG22      THR  36   1.369   7.043  -5.643
  204   HG23  THR  36          HG23      THR  36   0.877   6.403  -4.074
  205    H    THR  37           HN       THR  37   2.614   5.296  -3.352
  206    HA   THR  37           HA       THR  37   1.843   2.876  -1.889
  207    HB   THR  37           HB       THR  37   3.885   3.297  -0.416
  208    HG1  THR  37           HG1      THR  37   5.598   4.380  -1.450
  209   HG21  THR  37          HG21      THR  37   5.340   1.986  -1.892
  210   HG22  THR  37          HG22      THR  37   4.279   2.349  -3.253
  211   HG23  THR  37          HG23      THR  37   3.683   1.377  -1.908
  212    H    THR  38           HN       THR  38   0.842   3.190   0.020
  213    HA   THR  38           HA       THR  38   0.894   5.792   1.319
  214    HB   THR  38           HB       THR  38  -0.890   6.054  -0.340
  215    HG1  THR  38           HG1      THR  38  -2.708   6.093   1.437
  216   HG21  THR  38          HG21      THR  38  -1.480   3.707  -0.652
  217   HG22  THR  38          HG22      THR  38  -2.906   4.666  -0.255
  218   HG23  THR  38          HG23      THR  38  -2.155   3.653   0.976
  219    H    TRP  39           HN       TRP  39   0.150   5.691   3.524
  220    HA   TRP  39           HA       TRP  39   0.176   2.969   4.607
  221    HB2  TRP  39           HB2      TRP  39   0.042   5.577   6.126
  222    HB3  TRP  39           HB1      TRP  39   0.396   3.988   6.789
  223    HD1  TRP  39           HD1      TRP  39   1.946   6.899   4.999
  224    HE1  TRP  39           HE1      TRP  39   4.514   6.557   4.898
  225    HE3  TRP  39           HE3      TRP  39   2.177   2.083   6.655
  226    HZ2  TRP  39           HZ2      TRP  39   6.373   4.487   5.453
  227    HZ3  TRP  39           HZ3      TRP  39   4.366   0.988   6.857
  228    HH2  TRP  39           HH2      TRP  39   6.418   2.160   6.277
  229    H    GLU  40           HN       GLU  40  -2.037   5.314   3.677
  230    HA   GLU  40           HA       GLU  40  -3.914   4.623   5.770
  231    HB2  GLU  40           HB2      GLU  40  -5.265   6.503   4.890
  232    HB3  GLU  40           HB1      GLU  40  -3.645   6.948   5.417
  233    HG2  GLU  40           HG2      GLU  40  -4.052   8.169   3.495
  234    HG3  GLU  40           HG1      GLU  40  -2.958   6.884   3.011
  235    H    ASP  41           HN       ASP  41  -6.212   4.307   5.120
  236    HA   ASP  41           HA       ASP  41  -6.019   1.864   3.557
  237    HB2  ASP  41           HB2      ASP  41  -8.243   2.853   5.351
  238    HB3  ASP  41           HB1      ASP  41  -8.154   1.259   4.623
  239    HA   PRO  42           HA       PRO  42  -8.231   3.596   0.074
  240    HB2  PRO  42           HB2      PRO  42  -8.877   1.198  -1.086
  241    HB3  PRO  42           HB1      PRO  42  -7.308   1.994  -1.270
  242    HG2  PRO  42           HG2      PRO  42  -8.107  -0.224   0.567
  243    HG3  PRO  42           HG1      PRO  42  -6.622  -0.031  -0.384
  244    HD2  PRO  42           HD2      PRO  42  -6.696   0.502   2.260
  245    HD3  PRO  42           HD1      PRO  42  -5.689   1.449   1.145
  246    H    ARG  43           HN       ARG  43  -9.433   1.641   2.573
  247    HA   ARG  43           HA       ARG  43 -12.092   1.204   1.783
  248    HB2  ARG  43           HB2      ARG  43 -11.073   1.766   4.575
  249    HB3  ARG  43           HB1      ARG  43 -12.588   0.977   4.160
  250    HG2  ARG  43           HG2      ARG  43  -9.880  -0.111   3.434
  251    HG3  ARG  43           HG1      ARG  43 -10.766  -0.557   4.894
  252    HD2  ARG  43           HD2      ARG  43 -11.899  -0.848   2.120
  253    HD3  ARG  43           HD1      ARG  43 -11.005  -2.131   2.937
  254    HE   ARG  43           HE       ARG  43 -13.588  -1.015   3.842
  255   HH11  ARG  43          HH11      ARG  43 -11.185  -3.567   3.807
  256   HH12  ARG  43          HH12      ARG  43 -12.197  -4.706   4.646
  257   HH21  ARG  43          HH21      ARG  43 -14.915  -2.498   4.945
  258   HH22  ARG  43          HH22      ARG  43 -14.329  -4.097   5.295
  259    H    LEU  44           HN       LEU  44 -10.411   4.037   2.790
  260    HA   LEU  44           HA       LEU  44 -12.756   5.580   3.381
  261    HB2  LEU  44           HB2      LEU  44  -9.901   6.440   2.945
  262    HB3  LEU  44           HB1      LEU  44 -11.183   7.482   3.528
  263    HG   LEU  44           HG       LEU  44 -10.152   5.039   4.974
  264   HD11  LEU  44          HD11      LEU  44  -8.484   6.812   4.903
  265   HD12  LEU  44          HD12      LEU  44  -9.149   6.636   6.527
  266   HD13  LEU  44          HD13      LEU  44  -9.674   7.970   5.499
  267   HD21  LEU  44          HD21      LEU  44 -11.478   5.890   6.849
  268   HD22  LEU  44          HD22      LEU  44 -12.491   5.505   5.458
  269   HD23  LEU  44          HD23      LEU  44 -12.095   7.186   5.823
  270    H    LYS  45           HN       LYS  45 -11.377   4.497   0.658
  271    HA   LYS  45           HA       LYS  45 -12.279   6.760  -0.993
  272    HB2  LYS  45           HB2      LYS  45 -10.107   4.718  -1.514
  273    HB3  LYS  45           HB1      LYS  45 -10.662   5.896  -2.696
  274    HG2  LYS  45           HG2      LYS  45  -9.783   7.694  -1.489
  275    HG3  LYS  45           HG1      LYS  45  -9.617   6.734  -0.017
  276    HD2  LYS  45           HD2      LYS  45  -7.809   5.484  -0.949
  277    HD3  LYS  45           HD1      LYS  45  -8.073   6.189  -2.545
  278    HE2  LYS  45           HE2      LYS  45  -6.146   7.164  -1.313
  279    HE3  LYS  45           HE1      LYS  45  -7.368   8.344  -1.783
  280    HZ1  LYS  45           HZ1      LYS  45  -6.704   8.791   0.441
  281    HZ2  LYS  45           HZ2      LYS  45  -6.936   7.185   0.925
  282    HZ3  LYS  45           HZ3      LYS  45  -8.271   8.155   0.512
  283    H    GLN 112           H        GLN 112   8.820   7.498   6.790
  284    HA   GLN 112           HA       GLN 112   6.895   9.235   5.384
  285    HB2  GLN 112           HB2      GLN 112   8.873  10.463   4.527
  286    HB3  GLN 112           HB1      GLN 112   8.632  10.666   6.252
  287    HG2  GLN 112           HG2      GLN 112  10.565   8.650   5.153
  288    HG3  GLN 112           HG1      GLN 112  11.013  10.336   5.403
  289   HE21  GLN 112          HE21      GLN 112  11.107  11.153   7.503
  290   HE22  GLN 112          HE22      GLN 112  11.210  10.114   8.884
  291    H    ILE 113           HN       ILE 113   6.424   8.541   3.443
  292    HA   ILE 113           HA       ILE 113   6.438   7.457   1.465
  293    HB   ILE 113           HB       ILE 113   9.432   7.429   1.841
  294   HG12  ILE 113          HG12      ILE 113   8.491   9.681   1.794
  295   HG13  ILE 113          HG11      ILE 113   9.371   9.361   0.302
  296   HG21  ILE 113          HG21      ILE 113   9.557   7.067  -0.578
  297   HG22  ILE 113          HG22      ILE 113   7.800   6.928  -0.648
  298   HG23  ILE 113          HG23      ILE 113   8.746   5.728   0.234
  299   HD11  ILE 113          HD11      ILE 113   7.254   8.927  -0.842
  300   HD12  ILE 113          HD12      ILE 113   7.305  10.545  -0.144
  301   HD13  ILE 113          HD13      ILE 113   6.383   9.269   0.652
  302    HA   PRO 114           HA       PRO 114   6.406   3.185   2.990
  303    HB2  PRO 114           HB2      PRO 114   4.322   2.913   0.956
  304    HB3  PRO 114           HB1      PRO 114   4.223   2.641   2.697
  305    HG2  PRO 114           HG2      PRO 114   3.005   4.723   1.477
  306    HG3  PRO 114           HG1      PRO 114   3.621   4.813   3.136
  307    HD2  PRO 114           HD2      PRO 114   4.829   5.856   0.609
  308    HD3  PRO 114           HD1      PRO 114   4.759   6.602   2.216
  309    HA   PRO 115           HA       PRO 115   8.993   1.705  -0.443
  310    HB2  PRO 115           HB2      PRO 115   8.379  -0.862   0.931
  311    HB3  PRO 115           HB1      PRO 115   9.933  -0.205   0.424
  312    HG2  PRO 115           HG2      PRO 115   9.246  -0.204   2.984
  313    HG3  PRO 115           HG1      PRO 115  10.102   1.181   2.279
  314    HD2  PRO 115           HD2      PRO 115   7.210   0.892   2.976
  315    HD3  PRO 115           HD1      PRO 115   8.281   2.301   3.132
  316    HA   PRO 116           HA       PRO 116   5.810   0.248  -3.327
  317    HB2  PRO 116           HB2      PRO 116   7.883  -0.715  -4.982
  318    HB3  PRO 116           HB1      PRO 116   7.036   0.833  -5.142
  319    HG2  PRO 116           HG2      PRO 116   9.567   0.191  -3.692
  320    HG3  PRO 116           HG1      PRO 116   9.182   1.590  -4.731
  321    HD2  PRO 116           HD2      PRO 116   9.011   1.956  -2.222
  322    HD3  PRO 116           HD1      PRO 116   7.619   2.402  -3.178
  323    H    TYR 117           HN       TYR 117   5.949  -1.334  -4.637
  324    HA   TYR 117           HA       TYR 117   5.631  -3.832  -3.224
  325    HB2  TYR 117           HB2      TYR 117   4.662  -4.740  -5.253
  326    HB3  TYR 117           HB1      TYR 117   4.007  -3.140  -4.946
  327    HD1  TYR 117           HD2      TYR 117   5.038  -1.178  -6.302
  328    HD2  TYR 117           HD1      TYR 117   5.547  -5.279  -7.315
  329    HE1  TYR 117           HE2      TYR 117   5.603  -0.538  -8.605
  330    HE2  TYR 117           HE1      TYR 117   6.107  -4.649  -9.620
  331    HH   TYR 117           HH       TYR 117   5.753  -2.817 -11.159
  332    H    VAL 118           HN       VAL 118   7.188  -5.293  -2.897
  333    HA   VAL 118           HA       VAL 118   9.598  -5.250  -4.523
  334    HB   VAL 118           HB       VAL 118   9.702  -5.380  -2.027
  335   HG11  VAL 118          HG11      VAL 118   7.791  -6.812  -1.625
  336   HG12  VAL 118          HG12      VAL 118   9.247  -7.519  -0.925
  337   HG13  VAL 118          HG13      VAL 118   8.597  -8.152  -2.438
  338   HG21  VAL 118          HG21      VAL 118  10.925  -7.702  -3.509
  339   HG22  VAL 118          HG22      VAL 118  11.437  -7.114  -1.927
  340   HG23  VAL 118          HG23      VAL 118  11.605  -6.082  -3.348
  341    H    GLU 119           HN       GLU 119   6.650  -6.710  -4.553
  342    HA   GLU 119           HA       GLU 119   7.406  -9.334  -5.491
  343    HB2  GLU 119           HB2      GLU 119   4.702  -7.984  -5.520
  344    HB3  GLU 119           HB1      GLU 119   5.021  -9.706  -5.667
  345    HG2  GLU 119           HG2      GLU 119   5.592  -9.915  -3.423
  346    HG3  GLU 119           HG1      GLU 119   5.843  -8.180  -3.229
  347    HA   PRO 120           HA       PRO 120   7.527  -7.808  -9.720
  348    HB2  PRO 120           HB2      PRO 120   8.434 -10.406 -10.539
  349    HB3  PRO 120           HB1      PRO 120   9.383  -8.929 -10.380
  350    HG2  PRO 120           HG2      PRO 120   9.673 -11.158  -8.782
  351    HG3  PRO 120           HG1      PRO 120  10.175  -9.520  -8.331
  352    HD2  PRO 120           HD2      PRO 120   7.719 -11.037  -7.552
  353    HD3  PRO 120           HD1      PRO 120   8.715  -9.928  -6.586
  Start of MODEL   18
    1    H    PHE  12           H        PHE  12 -11.417  -7.831   0.700
    2    HA   PHE  12           HA       PHE  12 -12.414  -6.765  -1.163
    3    HB2  PHE  12           HB2      PHE  12 -14.039  -5.358  -0.019
    4    HB3  PHE  12           HB1      PHE  12 -13.649  -6.754   0.975
    5    HD1  PHE  12           HD2      PHE  12 -12.411  -6.496   3.048
    6    HD2  PHE  12           HD1      PHE  12 -13.426  -3.127   0.656
    7    HE1  PHE  12           HE2      PHE  12 -11.912  -5.005   4.942
    8    HE2  PHE  12           HE1      PHE  12 -12.936  -1.633   2.545
    9    HZ   PHE  12           HZ       PHE  12 -12.177  -2.571   4.690
   10    H    LEU  13           HN       LEU  13  -9.647  -5.364  -0.339
   11    HA   LEU  13           HA       LEU  13 -10.126  -2.635  -1.076
   12    HB2  LEU  13           HB2      LEU  13  -7.617  -4.277  -0.749
   13    HB3  LEU  13           HB1      LEU  13  -7.573  -2.621  -1.316
   14    HG   LEU  13           HG       LEU  13  -7.066  -2.518   0.975
   15   HD11  LEU  13          HD11      LEU  13  -8.648  -0.816   0.281
   16   HD12  LEU  13          HD12      LEU  13  -8.925  -1.283   1.959
   17   HD13  LEU  13          HD13      LEU  13  -9.994  -1.880   0.690
   18   HD21  LEU  13          HD21      LEU  13  -8.414  -3.547   2.728
   19   HD22  LEU  13          HD22      LEU  13  -7.766  -4.751   1.615
   20   HD23  LEU  13          HD23      LEU  13  -9.458  -4.268   1.503
   21    HA   PRO  14           HA       PRO  14 -10.063  -2.654  -5.497
   22    HB2  PRO  14           HB2      PRO  14  -7.783  -0.792  -5.051
   23    HB3  PRO  14           HB1      PRO  14  -9.068  -0.703  -6.261
   24    HG2  PRO  14           HG2      PRO  14  -9.301   0.684  -4.199
   25    HG3  PRO  14           HG1      PRO  14 -10.685  -0.307  -4.595
   26    HD2  PRO  14           HD2      PRO  14  -8.563  -0.766  -2.503
   27    HD3  PRO  14           HD1      PRO  14 -10.324  -1.000  -2.366
   28    H    LYS  15           HN       LYS  15  -9.030  -3.175  -7.191
   29    HA   LYS  15           HA       LYS  15  -7.343  -5.455  -6.764
   30    HB2  LYS  15           HB2      LYS  15  -7.557  -5.923  -9.101
   31    HB3  LYS  15           HB1      LYS  15  -9.117  -5.385  -8.509
   32    HG2  LYS  15           HG2      LYS  15  -9.039  -4.224 -10.432
   33    HG3  LYS  15           HG1      LYS  15  -8.229  -3.052  -9.400
   34    HD2  LYS  15           HD2      LYS  15  -6.062  -3.893 -10.146
   35    HD3  LYS  15           HD1      LYS  15  -6.867  -5.096 -11.157
   36    HE2  LYS  15           HE2      LYS  15  -7.909  -3.295 -12.452
   37    HE3  LYS  15           HE1      LYS  15  -7.084  -2.100 -11.450
   38    HZ1  LYS  15           HZ1      LYS  15  -4.961  -3.085 -12.202
   39    HZ2  LYS  15           HZ2      LYS  15  -5.860  -2.393 -13.459
   40    HZ3  LYS  15           HZ3      LYS  15  -5.823  -4.080 -13.273
   41    H    GLY  16           HN       GLY  16  -5.251  -5.762  -7.180
   42    HA2  GLY  16           HA2      GLY  16  -3.031  -5.248  -7.538
   43    HA3  GLY  16           HA1      GLY  16  -3.521  -3.754  -8.318
   44    H    TRP  17           HN       TRP  17  -5.148  -3.497  -5.556
   45    HA   TRP  17           HA       TRP  17  -3.003  -2.057  -4.204
   46    HB2  TRP  17           HB2      TRP  17  -5.970  -2.267  -3.691
   47    HB3  TRP  17           HB1      TRP  17  -4.872  -1.465  -2.579
   48    HD1  TRP  17           HD1      TRP  17  -6.058  -1.133  -6.264
   49    HE1  TRP  17           HE1      TRP  17  -6.046   1.365  -6.851
   50    HE3  TRP  17           HE3      TRP  17  -3.980   0.707  -1.968
   51    HZ2  TRP  17           HZ2      TRP  17  -5.217   3.796  -5.681
   52    HZ3  TRP  17           HZ3      TRP  17  -3.598   3.133  -1.788
   53    HH2  TRP  17           HH2      TRP  17  -4.205   4.645  -3.609
   54    H    GLU  18           HN       GLU  18  -1.787  -3.074  -2.781
   55    HA   GLU  18           HA       GLU  18  -2.914  -5.443  -1.452
   56    HB2  GLU  18           HB2      GLU  18  -0.237  -4.894  -2.597
   57    HB3  GLU  18           HB1      GLU  18  -0.333  -5.936  -1.188
   58    HG2  GLU  18           HG2      GLU  18  -1.700  -6.340  -3.838
   59    HG3  GLU  18           HG1      GLU  18  -0.371  -7.275  -3.157
   60    H    VAL  19           HN       VAL  19  -2.515  -5.833   0.612
   61    HA   VAL  19           HA       VAL  19  -1.625  -3.534   2.227
   62    HB   VAL  19           HB       VAL  19  -3.345  -5.801   3.224
   63   HG11  VAL  19          HG11      VAL  19  -2.239  -4.464   4.920
   64   HG12  VAL  19          HG12      VAL  19  -3.984  -4.200   4.951
   65   HG13  VAL  19          HG13      VAL  19  -2.923  -2.994   4.224
   66   HG21  VAL  19          HG21      VAL  19  -4.304  -3.199   2.048
   67   HG22  VAL  19          HG22      VAL  19  -5.311  -4.384   2.878
   68   HG23  VAL  19          HG23      VAL  19  -4.530  -4.804   1.353
   69    H    ARG  20           HN       ARG  20   0.565  -4.054   2.383
   70    HA   ARG  20           HA       ARG  20   1.160  -6.631   3.669
   71    HB2  ARG  20           HB2      ARG  20   2.349  -6.109   1.486
   72    HB3  ARG  20           HB1      ARG  20   3.145  -4.782   2.339
   73    HG2  ARG  20           HG2      ARG  20   4.040  -6.422   3.969
   74    HG3  ARG  20           HG1      ARG  20   3.349  -7.714   2.990
   75    HD2  ARG  20           HD2      ARG  20   5.310  -5.697   1.964
   76    HD3  ARG  20           HD1      ARG  20   5.785  -7.256   2.620
   77    HE   ARG  20           HE       ARG  20   4.012  -7.030   0.270
   78   HH11  ARG  20          HH11      ARG  20   6.817  -8.351   1.892
   79   HH12  ARG  20          HH12      ARG  20   7.206  -9.449   0.604
   80   HH21  ARG  20          HH21      ARG  20   4.542  -8.460  -1.468
   81   HH22  ARG  20          HH22      ARG  20   5.938  -9.496  -1.306
   82    H    HIS  21           HN       HIS  21   2.518  -6.638   5.531
   83    HA   HIS  21           HA       HIS  21   2.306  -4.090   7.033
   84    HB2  HIS  21           HB2      HIS  21   1.045  -6.417   7.626
   85    HB3  HIS  21           HB1      HIS  21   2.554  -6.673   8.478
   86    HD1  HIS  21           HD1      HIS  21   1.445  -6.730  10.705
   87    HD2  HIS  21           HD2      HIS  21   0.828  -3.042   8.747
   88    HE1  HIS  21           HE1      HIS  21   0.387  -5.212  12.395
   89    HE2  HIS  21           HE2      HIS  21  -0.138  -3.096  11.153
   90    H    ALA  22           HN       ALA  22   4.230  -3.189   7.351
   91    HA   ALA  22           HA       ALA  22   6.698  -4.433   6.804
   92    HB1  ALA  22           HB1      ALA  22   6.131  -1.909   8.359
   93    HB2  ALA  22           HB2      ALA  22   6.318  -2.025   6.610
   94    HB3  ALA  22           HB3      ALA  22   7.686  -2.371   7.668
   95    HA   PRO  23           HA       PRO  23   7.999  -6.443  10.509
   96    HB2  PRO  23           HB2      PRO  23  10.405  -4.728  10.716
   97    HB3  PRO  23           HB1      PRO  23  10.280  -6.483  10.568
   98    HG2  PRO  23           HG2      PRO  23  11.079  -4.985   8.509
   99    HG3  PRO  23           HG1      PRO  23  10.048  -6.406   8.267
  100    HD2  PRO  23           HD2      PRO  23   9.313  -3.506   8.259
  101    HD3  PRO  23           HD1      PRO  23   8.734  -4.820   7.213
  102    H    ASN  24           HN       ASN  24   7.938  -2.959  10.600
  103    HA   ASN  24           HA       ASN  24   8.047  -2.802  13.479
  104    HB2  ASN  24           HB2      ASN  24   7.437  -0.388  13.103
  105    HB3  ASN  24           HB1      ASN  24   8.926  -0.895  12.316
  106   HD21  ASN  24          HD21      ASN  24   8.675   0.952  10.971
  107   HD22  ASN  24          HD22      ASN  24   7.596   0.904   9.616
  108    H    GLY  25           HN       GLY  25   5.850  -3.677  11.198
  109    HA2  GLY  25           HA2      GLY  25   3.687  -4.406  11.499
  110    HA3  GLY  25           HA1      GLY  25   3.695  -3.680  13.083
  111    H    ARG  26           HN       ARG  26   4.378  -2.198   9.969
  112    HA   ARG  26           HA       ARG  26   1.868  -0.662  10.189
  113    HB2  ARG  26           HB2      ARG  26   4.468   0.133   8.850
  114    HB3  ARG  26           HB1      ARG  26   2.991   1.081   8.817
  115    HG2  ARG  26           HG2      ARG  26   4.634   0.420  11.253
  116    HG3  ARG  26           HG1      ARG  26   4.555   1.978  10.429
  117    HD2  ARG  26           HD2      ARG  26   2.150   2.099  10.958
  118    HD3  ARG  26           HD1      ARG  26   2.289   0.577  11.840
  119    HE   ARG  26           HE       ARG  26   3.771   3.014  12.599
  120   HH11  ARG  26          HH11      ARG  26   1.799   0.248  13.431
  121   HH12  ARG  26          HH12      ARG  26   1.923   0.511  15.137
  122   HH21  ARG  26          HH21      ARG  26   3.960   3.350  14.839
  123   HH22  ARG  26          HH22      ARG  26   3.131   2.286  15.945
  124    HA   PRO  27           HA       PRO  27   1.165  -2.753   6.284
  125    HB2  PRO  27           HB2      PRO  27  -1.433  -2.156   6.000
  126    HB3  PRO  27           HB1      PRO  27  -0.898  -3.329   7.204
  127    HG2  PRO  27           HG2      PRO  27  -1.680  -0.470   7.562
  128    HG3  PRO  27           HG1      PRO  27  -2.034  -1.865   8.598
  129    HD2  PRO  27           HD2      PRO  27   0.002  -0.095   9.050
  130    HD3  PRO  27           HD1      PRO  27  -0.046  -1.674   9.708
  131    H    PHE  28           HN       PHE  28   2.227  -1.680   4.804
  132    HA   PHE  28           HA       PHE  28   1.324   0.917   3.871
  133    HB2  PHE  28           HB2      PHE  28   3.372   0.848   2.449
  134    HB3  PHE  28           HB1      PHE  28   3.722   0.713   4.161
  135    HD1  PHE  28           HD1      PHE  28   3.612  -2.007   4.882
  136    HD2  PHE  28           HD2      PHE  28   4.828  -0.358   1.135
  137    HE1  PHE  28           HE1      PHE  28   4.966  -4.000   4.439
  138    HE2  PHE  28           HE2      PHE  28   6.148  -2.371   0.692
  139    HZ   PHE  28           HZ       PHE  28   6.232  -4.191   2.342
  140    H    PHE  29           HN       PHE  29   0.015   1.105   2.216
  141    HA   PHE  29           HA       PHE  29  -0.847  -1.334   0.894
  142    HB2  PHE  29           HB2      PHE  29  -1.989   1.469   0.769
  143    HB3  PHE  29           HB1      PHE  29  -2.699   0.037   0.029
  144    HD1  PHE  29           HD2      PHE  29  -1.698   1.438   3.327
  145    HD2  PHE  29           HD1      PHE  29  -4.198  -1.256   1.189
  146    HE1  PHE  29           HE2      PHE  29  -2.947   0.965   5.392
  147    HE2  PHE  29           HE1      PHE  29  -5.451  -1.729   3.248
  148    HZ   PHE  29           HZ       PHE  29  -4.822  -0.626   5.350
  149    H    ILE  30           HN       ILE  30   0.095  -1.901  -0.860
  150    HA   ILE  30           HA       ILE  30   1.491   0.082  -2.470
  151    HB   ILE  30           HB       ILE  30   1.480  -2.910  -2.867
  152   HG12  ILE  30          HG12      ILE  30   3.461  -1.221  -1.369
  153   HG13  ILE  30          HG11      ILE  30   2.286  -2.272  -0.601
  154   HG21  ILE  30          HG21      ILE  30   3.562  -2.453  -4.086
  155   HG22  ILE  30          HG22      ILE  30   3.362  -0.729  -3.775
  156   HG23  ILE  30          HG23      ILE  30   2.199  -1.583  -4.789
  157   HD11  ILE  30          HD11      ILE  30   4.529  -3.140  -2.414
  158   HD12  ILE  30          HD12      ILE  30   3.331  -4.204  -1.679
  159   HD13  ILE  30          HD13      ILE  30   4.467  -3.320  -0.661
  160    H    ASP  31           HN       ASP  31   0.622   0.876  -4.192
  161    HA   ASP  31           HA       ASP  31  -1.583  -0.501  -5.509
  162    HB2  ASP  31           HB2      ASP  31  -1.991   1.819  -5.420
  163    HB3  ASP  31           HB1      ASP  31  -0.338   2.216  -5.875
  164    H    HIS  32           HN       HIS  32  -1.023  -2.101  -6.724
  165    HA   HIS  32           HA       HIS  32   1.633  -2.274  -7.854
  166    HB2  HIS  32           HB2      HIS  32  -0.701  -4.199  -7.742
  167    HB3  HIS  32           HB1      HIS  32   0.820  -4.591  -8.520
  168    HD1  HIS  32           HD1      HIS  32   2.045  -6.179  -6.960
  169    HD2  HIS  32           HD2      HIS  32   0.198  -3.068  -4.911
  170    HE1  HIS  32           HE1      HIS  32   2.610  -6.506  -4.500
  171    HE2  HIS  32           HE2      HIS  32   1.361  -4.709  -3.306
  172    H    ASN  33           HN       ASN  33  -1.105  -0.808  -8.814
  173    HA   ASN  33           HA       ASN  33  -1.009  -1.578 -11.619
  174    HB2  ASN  33           HB2      ASN  33  -2.707   0.575 -10.343
  175    HB3  ASN  33           HB1      ASN  33  -2.929  -0.147 -11.929
  176   HD21  ASN  33          HD21      ASN  33  -3.446  -0.441  -8.546
  177   HD22  ASN  33          HD22      ASN  33  -4.440  -1.869  -8.615
  178    H    THR  34           HN       THR  34  -1.091   1.614 -10.024
  179    HA   THR  34           HA       THR  34   0.391   2.718 -12.296
  180    HB   THR  34           HB       THR  34  -0.851   4.282 -10.033
  181    HG1  THR  34           HG1      THR  34  -2.068   2.947 -12.189
  182   HG21  THR  34          HG21      THR  34  -0.346   4.944 -12.940
  183   HG22  THR  34          HG22      THR  34   0.611   5.515 -11.573
  184   HG23  THR  34          HG23      THR  34  -1.068   6.024 -11.747
  185    H    LYS  35           HN       LYS  35   1.069   1.437  -9.372
  186    HA   LYS  35           HA       LYS  35   2.821   1.426  -7.969
  187    HB2  LYS  35           HB2      LYS  35   4.058   3.087 -10.149
  188    HB3  LYS  35           HB1      LYS  35   4.909   2.778  -8.644
  189    HG2  LYS  35           HG2      LYS  35   5.678   1.170 -10.182
  190    HG3  LYS  35           HG1      LYS  35   4.584   0.319  -9.094
  191    HD2  LYS  35           HD2      LYS  35   4.091  -0.438 -11.287
  192    HD3  LYS  35           HD1      LYS  35   2.781   0.650 -10.826
  193    HE2  LYS  35           HE2      LYS  35   3.834   2.455 -12.095
  194    HE3  LYS  35           HE1      LYS  35   5.154   1.377 -12.545
  195    HZ1  LYS  35           HZ1      LYS  35   3.658   1.430 -14.352
  196    HZ2  LYS  35           HZ2      LYS  35   2.309   1.191 -13.357
  197    HZ3  LYS  35           HZ3      LYS  35   3.418  -0.068 -13.591
  198    H    THR  36           HN       THR  36   1.507   2.374  -6.475
  199    HA   THR  36           HA       THR  36   2.310   5.083  -5.684
  200    HB   THR  36           HB       THR  36  -0.498   4.215  -5.152
  201    HG1  THR  36           HG1      THR  36  -0.319   3.948  -7.424
  202   HG21  THR  36          HG21      THR  36   0.361   6.237  -4.109
  203   HG22  THR  36          HG22      THR  36  -0.908   6.632  -5.268
  204   HG23  THR  36          HG23      THR  36   0.784   6.889  -5.691
  205    H    THR  37           HN       THR  37   2.222   5.379  -3.370
  206    HA   THR  37           HA       THR  37   1.841   2.935  -1.813
  207    HB   THR  37           HB       THR  37   4.062   3.541  -0.615
  208    HG1  THR  37           HG1      THR  37   4.160   5.512  -2.113
  209   HG21  THR  37          HG21      THR  37   5.319   2.112  -2.158
  210   HG22  THR  37          HG22      THR  37   4.074   2.337  -3.385
  211   HG23  THR  37          HG23      THR  37   3.693   1.486  -1.890
  212    H    THR  38           HN       THR  38   0.817   3.303   0.029
  213    HA   THR  38           HA       THR  38   1.108   5.828   1.441
  214    HB   THR  38           HB       THR  38  -0.707   6.309  -0.137
  215    HG1  THR  38           HG1      THR  38  -2.435   6.510   1.664
  216   HG21  THR  38          HG21      THR  38  -2.829   5.085  -0.025
  217   HG22  THR  38          HG22      THR  38  -2.116   3.954   1.127
  218   HG23  THR  38          HG23      THR  38  -1.504   4.034  -0.526
  219    H    TRP  39           HN       TRP  39   0.373   5.680   3.659
  220    HA   TRP  39           HA       TRP  39   0.413   2.927   4.626
  221    HB2  TRP  39           HB2      TRP  39   0.323   5.469   6.258
  222    HB3  TRP  39           HB1      TRP  39   0.725   3.857   6.832
  223    HD1  TRP  39           HD1      TRP  39   2.198   6.902   5.211
  224    HE1  TRP  39           HE1      TRP  39   4.762   6.595   4.997
  225    HE3  TRP  39           HE3      TRP  39   2.518   1.948   6.419
  226    HZ2  TRP  39           HZ2      TRP  39   6.651   4.502   5.312
  227    HZ3  TRP  39           HZ3      TRP  39   4.725   0.868   6.444
  228    HH2  TRP  39           HH2      TRP  39   6.748   2.119   5.897
  229    H    GLU  40           HN       GLU  40  -1.883   5.179   3.753
  230    HA   GLU  40           HA       GLU  40  -3.690   4.372   5.895
  231    HB2  GLU  40           HB2      GLU  40  -4.970   6.436   5.315
  232    HB3  GLU  40           HB1      GLU  40  -3.350   6.698   5.947
  233    HG2  GLU  40           HG2      GLU  40  -3.576   8.241   4.265
  234    HG3  GLU  40           HG1      GLU  40  -2.618   6.961   3.537
  235    H    ASP  41           HN       ASP  41  -6.008   4.333   5.304
  236    HA   ASP  41           HA       ASP  41  -6.104   2.164   3.383
  237    HB2  ASP  41           HB2      ASP  41  -8.022   3.156   5.483
  238    HB3  ASP  41           HB1      ASP  41  -8.478   1.918   4.321
  239    HA   PRO  42           HA       PRO  42  -8.038   4.553   0.139
  240    HB2  PRO  42           HB2      PRO  42  -8.745   2.390  -1.383
  241    HB3  PRO  42           HB1      PRO  42  -7.125   3.100  -1.380
  242    HG2  PRO  42           HG2      PRO  42  -8.153   0.702   0.087
  243    HG3  PRO  42           HG1      PRO  42  -6.609   0.921  -0.760
  244    HD2  PRO  42           HD2      PRO  42  -6.798   1.087   1.923
  245    HD3  PRO  42           HD1      PRO  42  -5.668   2.102   0.999
  246    H    ARG  43           HN       ARG  43  -9.451   2.376   2.318
  247    HA   ARG  43           HA       ARG  43 -12.056   2.077   1.271
  248    HB2  ARG  43           HB2      ARG  43 -11.691   2.293   4.220
  249    HB3  ARG  43           HB1      ARG  43 -12.634   1.139   3.292
  250    HG2  ARG  43           HG2      ARG  43 -10.619  -0.062   2.682
  251    HG3  ARG  43           HG1      ARG  43  -9.630   1.127   3.534
  252    HD2  ARG  43           HD2      ARG  43 -11.108   0.517   5.577
  253    HD3  ARG  43           HD1      ARG  43 -11.499  -0.931   4.650
  254    HE   ARG  43           HE       ARG  43  -8.669  -0.378   4.920
  255   HH11  ARG  43          HH11      ARG  43 -11.434  -2.008   6.325
  256   HH12  ARG  43          HH12      ARG  43 -10.468  -3.155   7.204
  257   HH21  ARG  43          HH21      ARG  43  -7.411  -1.830   6.092
  258   HH22  ARG  43          HH22      ARG  43  -8.172  -3.038   7.084
  259    H    LEU  44           HN       LEU  44 -10.439   4.783   2.470
  260    HA   LEU  44           HA       LEU  44 -12.698   6.117   3.612
  261    HB2  LEU  44           HB2      LEU  44  -9.997   7.229   2.880
  262    HB3  LEU  44           HB1      LEU  44 -11.185   8.003   3.912
  263    HG   LEU  44           HG       LEU  44  -9.799   5.400   4.562
  264   HD11  LEU  44          HD11      LEU  44  -9.272   8.178   5.602
  265   HD12  LEU  44          HD12      LEU  44  -8.213   7.249   4.543
  266   HD13  LEU  44          HD13      LEU  44  -8.521   6.695   6.188
  267   HD21  LEU  44          HD21      LEU  44 -10.702   5.783   6.810
  268   HD22  LEU  44          HD22      LEU  44 -11.979   5.601   5.608
  269   HD23  LEU  44          HD23      LEU  44 -11.561   7.203   6.214
  270    H    LYS  45           HN       LYS  45 -11.704   5.546   0.578
  271    HA   LYS  45           HA       LYS  45 -12.658   8.055  -0.556
  272    HB2  LYS  45           HB2      LYS  45 -10.594   7.115  -1.480
  273    HB3  LYS  45           HB1      LYS  45 -11.442   5.631  -1.896
  274    HG2  LYS  45           HG2      LYS  45 -11.144   7.033  -3.850
  275    HG3  LYS  45           HG1      LYS  45 -12.857   6.870  -3.455
  276    HD2  LYS  45           HD2      LYS  45 -12.593   9.070  -2.182
  277    HD3  LYS  45           HD1      LYS  45 -11.053   9.237  -3.027
  278    HE2  LYS  45           HE2      LYS  45 -12.751  10.431  -4.247
  279    HE3  LYS  45           HE1      LYS  45 -12.261   9.015  -5.179
  280    HZ1  LYS  45           HZ1      LYS  45 -14.710   9.250  -3.506
  281    HZ2  LYS  45           HZ2      LYS  45 -14.225   7.850  -4.328
  282    HZ3  LYS  45           HZ3      LYS  45 -14.649   9.236  -5.202
  283    H    GLN 112           H        GLN 112   8.698   8.302   8.154
  284    HA   GLN 112           HA       GLN 112   8.475   6.242   6.963
  285    HB2  GLN 112           HB2      GLN 112   5.944   7.825   7.379
  286    HB3  GLN 112           HB1      GLN 112   5.936   6.116   6.974
  287    HG2  GLN 112           HG2      GLN 112   7.228   5.650   9.011
  288    HG3  GLN 112           HG1      GLN 112   7.158   7.364   9.423
  289   HE21  GLN 112          HE21      GLN 112   6.107   4.993  10.823
  290   HE22  GLN 112          HE22      GLN 112   4.417   5.310  11.045
  291    H    ILE 113           HN       ILE 113   8.991   5.670   4.979
  292    HA   ILE 113           HA       ILE 113   7.418   6.769   2.739
  293    HB   ILE 113           HB       ILE 113  10.270   5.767   2.725
  294   HG12  ILE 113          HG12      ILE 113  10.036   8.040   3.596
  295   HG13  ILE 113          HG11      ILE 113  10.804   8.068   2.012
  296   HG21  ILE 113          HG21      ILE 113   8.574   6.705   0.415
  297   HG22  ILE 113          HG22      ILE 113   9.118   5.053   0.703
  298   HG23  ILE 113          HG23      ILE 113  10.292   6.318   0.340
  299   HD11  ILE 113          HD11      ILE 113   7.923   8.708   2.608
  300   HD12  ILE 113          HD12      ILE 113   8.657   8.699   1.005
  301   HD13  ILE 113          HD13      ILE 113   9.197   9.862   2.217
  302    HA   PRO 114           HA       PRO 114   6.159   2.431   2.658
  303    HB2  PRO 114           HB2      PRO 114   4.346   3.168   0.523
  304    HB3  PRO 114           HB1      PRO 114   3.969   2.627   2.158
  305    HG2  PRO 114           HG2      PRO 114   3.547   5.176   1.230
  306    HG3  PRO 114           HG1      PRO 114   3.744   4.748   2.936
  307    HD2  PRO 114           HD2      PRO 114   5.677   6.004   1.058
  308    HD3  PRO 114           HD1      PRO 114   5.484   6.216   2.810
  309    HA   PRO 115           HA       PRO 115   8.612   1.549  -1.009
  310    HB2  PRO 115           HB2      PRO 115   9.256  -0.961  -0.347
  311    HB3  PRO 115           HB1      PRO 115   9.963   0.426   0.467
  312    HG2  PRO 115           HG2      PRO 115   7.783  -1.370   1.393
  313    HG3  PRO 115           HG1      PRO 115   9.140  -0.690   2.308
  314    HD2  PRO 115           HD2      PRO 115   6.574   0.327   2.307
  315    HD3  PRO 115           HD1      PRO 115   8.028   1.256   2.721
  316    HA   PRO 116           HA       PRO 116   5.437  -0.214  -3.648
  317    HB2  PRO 116           HB2      PRO 116   7.434  -0.880  -5.537
  318    HB3  PRO 116           HB1      PRO 116   6.412   0.565  -5.537
  319    HG2  PRO 116           HG2      PRO 116   9.128   0.154  -4.375
  320    HG3  PRO 116           HG1      PRO 116   8.486   1.548  -5.284
  321    HD2  PRO 116           HD2      PRO 116   8.552   1.759  -2.750
  322    HD3  PRO 116           HD1      PRO 116   7.031   2.110  -3.534
  323    H    TYR 117           HN       TYR 117   5.604  -1.688  -5.073
  324    HA   TYR 117           HA       TYR 117   5.381  -4.233  -3.813
  325    HB2  TYR 117           HB2      TYR 117   4.459  -5.076  -5.839
  326    HB3  TYR 117           HB1      TYR 117   3.896  -3.423  -5.669
  327    HD1  TYR 117           HD1      TYR 117   6.101  -5.671  -7.551
  328    HD2  TYR 117           HD2      TYR 117   4.519  -1.732  -7.282
  329    HE1  TYR 117           HE1      TYR 117   6.875  -5.215  -9.834
  330    HE2  TYR 117           HE2      TYR 117   5.297  -1.262  -9.568
  331    HH   TYR 117           HH       TYR 117   6.493  -3.779 -11.646
  332    H    VAL 118           HN       VAL 118   6.647  -5.992  -3.800
  333    HA   VAL 118           HA       VAL 118   9.264  -5.798  -5.116
  334    HB   VAL 118           HB       VAL 118   8.353  -7.755  -2.989
  335   HG11  VAL 118          HG11      VAL 118  10.747  -8.194  -2.688
  336   HG12  VAL 118          HG12      VAL 118  11.113  -7.099  -4.020
  337   HG13  VAL 118          HG13      VAL 118  10.214  -8.585  -4.324
  338   HG21  VAL 118          HG21      VAL 118   9.959  -5.220  -2.684
  339   HG22  VAL 118          HG22      VAL 118   9.654  -6.400  -1.409
  340   HG23  VAL 118          HG23      VAL 118   8.315  -5.487  -2.108
  341    H    GLU 119           HN       GLU 119   6.255  -7.401  -5.090
  342    HA   GLU 119           HA       GLU 119   6.946  -9.890  -6.217
  343    HB2  GLU 119           HB2      GLU 119   4.302  -8.437  -6.449
  344    HB3  GLU 119           HB1      GLU 119   4.571 -10.168  -6.598
  345    HG2  GLU 119           HG2      GLU 119   3.797 -10.108  -4.472
  346    HG3  GLU 119           HG1      GLU 119   5.511  -9.872  -4.146
  347    HA   PRO 120           HA       PRO 120   8.045  -8.393 -10.296
  348    HB2  PRO 120           HB2      PRO 120   7.936 -11.298 -10.885
  349    HB3  PRO 120           HB1      PRO 120   9.245 -10.141 -11.150
  350    HG2  PRO 120           HG2      PRO 120   9.394 -11.931  -9.187
  351    HG3  PRO 120           HG1      PRO 120   9.984 -10.274  -8.956
  352    HD2  PRO 120           HD2      PRO 120   7.429 -11.524  -8.019
  353    HD3  PRO 120           HD1      PRO 120   8.515 -10.408  -7.165
  Start of MODEL   19
    1    H    PHE  12           H        PHE  12 -10.508  -7.207   0.370
    2    HA   PHE  12           HA       PHE  12 -13.082  -6.584  -0.946
    3    HB2  PHE  12           HB2      PHE  12 -13.670  -5.352   1.062
    4    HB3  PHE  12           HB1      PHE  12 -13.329  -7.026   1.475
    5    HD1  PHE  12           HD1      PHE  12 -11.102  -7.572   2.545
    6    HD2  PHE  12           HD2      PHE  12 -12.514  -3.588   2.070
    7    HE1  PHE  12           HE1      PHE  12  -9.527  -6.810   4.277
    8    HE2  PHE  12           HE2      PHE  12 -10.939  -2.818   3.795
    9    HZ   PHE  12           HZ       PHE  12  -9.442  -4.429   4.901
   10    H    LEU  13           HN       LEU  13 -10.136  -6.056  -1.635
   11    HA   LEU  13           HA       LEU  13 -10.291  -3.108  -1.586
   12    HB2  LEU  13           HB2      LEU  13  -7.909  -4.943  -1.510
   13    HB3  LEU  13           HB1      LEU  13  -7.761  -3.274  -2.025
   14    HG   LEU  13           HG       LEU  13  -8.919  -2.786   0.289
   15   HD11  LEU  13          HD11      LEU  13  -8.242  -4.361   2.015
   16   HD12  LEU  13          HD12      LEU  13  -7.577  -5.439   0.787
   17   HD13  LEU  13          HD13      LEU  13  -9.315  -5.135   0.847
   18   HD21  LEU  13          HD21      LEU  13  -6.699  -2.535   1.263
   19   HD22  LEU  13          HD22      LEU  13  -6.718  -2.012  -0.421
   20   HD23  LEU  13          HD23      LEU  13  -6.024  -3.574   0.010
   21    HA   PRO  14           HA       PRO  14 -10.181  -2.708  -6.047
   22    HB2  PRO  14           HB2      PRO  14  -7.959  -0.906  -5.208
   23    HB3  PRO  14           HB1      PRO  14  -9.142  -0.677  -6.499
   24    HG2  PRO  14           HG2      PRO  14  -9.574   0.464  -4.325
   25    HG3  PRO  14           HG1      PRO  14 -10.897  -0.508  -4.930
   26    HD2  PRO  14           HD2      PRO  14  -8.900  -1.176  -2.766
   27    HD3  PRO  14           HD1      PRO  14 -10.668  -1.423  -2.754
   28    H    LYS  15           HN       LYS  15  -9.017  -3.031  -7.697
   29    HA   LYS  15           HA       LYS  15  -7.375  -5.366  -7.503
   30    HB2  LYS  15           HB2      LYS  15  -8.153  -3.652  -9.855
   31    HB3  LYS  15           HB1      LYS  15  -7.101  -5.047 -10.018
   32    HG2  LYS  15           HG2      LYS  15  -9.297  -5.712 -10.607
   33    HG3  LYS  15           HG1      LYS  15  -8.922  -6.448  -9.053
   34    HD2  LYS  15           HD2      LYS  15 -10.260  -4.870  -7.889
   35    HD3  LYS  15           HD1      LYS  15 -10.438  -3.868  -9.328
   36    HE2  LYS  15           HE2      LYS  15 -11.744  -5.611 -10.405
   37    HE3  LYS  15           HE1      LYS  15 -11.507  -6.671  -9.016
   38    HZ1  LYS  15           HZ1      LYS  15 -12.756  -5.167  -7.652
   39    HZ2  LYS  15           HZ2      LYS  15 -13.682  -5.547  -9.025
   40    HZ3  LYS  15           HZ3      LYS  15 -12.897  -4.047  -8.917
   41    H    GLY  16           HN       GLY  16  -5.294  -5.528  -7.272
   42    HA2  GLY  16           HA2      GLY  16  -3.033  -5.069  -7.588
   43    HA3  GLY  16           HA1      GLY  16  -3.450  -3.533  -8.329
   44    H    TRP  17           HN       TRP  17  -5.249  -3.557  -5.619
   45    HA   TRP  17           HA       TRP  17  -3.264  -2.027  -4.137
   46    HB2  TRP  17           HB2      TRP  17  -6.230  -2.426  -3.827
   47    HB3  TRP  17           HB1      TRP  17  -5.266  -1.688  -2.554
   48    HD1  TRP  17           HD1      TRP  17  -6.132  -1.076  -6.296
   49    HE1  TRP  17           HE1      TRP  17  -6.155   1.464  -6.677
   50    HE3  TRP  17           HE3      TRP  17  -4.505   0.469  -1.686
   51    HZ2  TRP  17           HZ2      TRP  17  -5.526   3.810  -5.247
   52    HZ3  TRP  17           HZ3      TRP  17  -4.237   2.879  -1.289
   53    HH2  TRP  17           HH2      TRP  17  -4.735   4.515  -3.034
   54    H    GLU  18           HN       GLU  18  -2.002  -3.007  -2.780
   55    HA   GLU  18           HA       GLU  18  -2.914  -5.523  -1.559
   56    HB2  GLU  18           HB2      GLU  18  -0.338  -4.658  -2.717
   57    HB3  GLU  18           HB1      GLU  18  -0.264  -5.699  -1.307
   58    HG2  GLU  18           HG2      GLU  18  -1.733  -6.308  -3.860
   59    HG3  GLU  18           HG1      GLU  18  -0.169  -6.948  -3.371
   60    H    VAL  19           HN       VAL  19  -2.413  -5.979   0.497
   61    HA   VAL  19           HA       VAL  19  -1.564  -3.712   2.191
   62    HB   VAL  19           HB       VAL  19  -3.334  -5.945   3.166
   63   HG11  VAL  19          HG11      VAL  19  -2.164  -4.638   4.852
   64   HG12  VAL  19          HG12      VAL  19  -3.905  -4.360   4.921
   65   HG13  VAL  19          HG13      VAL  19  -2.848  -3.156   4.183
   66   HG21  VAL  19          HG21      VAL  19  -4.513  -4.895   1.315
   67   HG22  VAL  19          HG22      VAL  19  -4.257  -3.309   2.045
   68   HG23  VAL  19          HG23      VAL  19  -5.271  -4.500   2.859
   69    H    ARG  20           HN       ARG  20   0.478  -4.137   2.777
   70    HA   ARG  20           HA       ARG  20   0.981  -6.784   3.937
   71    HB2  ARG  20           HB2      ARG  20   2.154  -6.461   1.705
   72    HB3  ARG  20           HB1      ARG  20   3.081  -5.176   2.484
   73    HG2  ARG  20           HG2      ARG  20   4.051  -6.698   4.045
   74    HG3  ARG  20           HG1      ARG  20   2.988  -8.001   3.514
   75    HD2  ARG  20           HD2      ARG  20   5.051  -6.643   1.824
   76    HD3  ARG  20           HD1      ARG  20   5.267  -8.203   2.610
   77    HE   ARG  20           HE       ARG  20   2.931  -8.236   1.025
   78   HH11  ARG  20          HH11      ARG  20   6.429  -8.293   0.681
   79   HH12  ARG  20          HH12      ARG  20   6.371  -9.132  -0.842
   80   HH21  ARG  20          HH21      ARG  20   2.865  -9.354  -0.914
   81   HH22  ARG  20          HH22      ARG  20   4.349  -9.765  -1.741
   82    H    HIS  21           HN       HIS  21   2.479  -6.819   5.676
   83    HA   HIS  21           HA       HIS  21   2.379  -4.292   7.207
   84    HB2  HIS  21           HB2      HIS  21   1.682  -6.962   7.868
   85    HB3  HIS  21           HB1      HIS  21   3.141  -6.593   8.768
   86    HD1  HIS  21           HD1      HIS  21   1.281  -7.130  10.670
   87    HD2  HIS  21           HD2      HIS  21   1.004  -3.352   8.815
   88    HE1  HIS  21           HE1      HIS  21  -0.122  -5.704  12.192
   89    HE2  HIS  21           HE2      HIS  21  -0.352  -3.494  11.019
   90    H    ALA  22           HN       ALA  22   4.271  -3.248   7.019
   91    HA   ALA  22           HA       ALA  22   6.760  -4.438   6.426
   92    HB1  ALA  22           HB1      ALA  22   6.200  -1.777   7.741
   93    HB2  ALA  22           HB2      ALA  22   6.238  -2.072   6.003
   94    HB3  ALA  22           HB3      ALA  22   7.709  -2.257   6.961
   95    HA   PRO  23           HA       PRO  23   8.308  -6.135  10.148
   96    HB2  PRO  23           HB2      PRO  23  10.695  -4.367   9.988
   97    HB3  PRO  23           HB1      PRO  23  10.597  -6.129  10.090
   98    HG2  PRO  23           HG2      PRO  23  11.201  -4.951   7.787
   99    HG3  PRO  23           HG1      PRO  23  10.133  -6.367   7.829
  100    HD2  PRO  23           HD2      PRO  23   9.431  -3.477   7.492
  101    HD3  PRO  23           HD1      PRO  23   8.742  -4.905   6.693
  102    H    ASN  24           HN       ASN  24   7.930  -2.700  10.039
  103    HA   ASN  24           HA       ASN  24   8.503  -2.312  12.841
  104    HB2  ASN  24           HB2      ASN  24   7.824  -0.006  12.516
  105    HB3  ASN  24           HB1      ASN  24   8.904  -0.479  11.209
  106   HD21  ASN  24          HD21      ASN  24   6.896   1.649  11.378
  107   HD22  ASN  24          HD22      ASN  24   5.833   1.387  10.036
  108    H    GLY  25           HN       GLY  25   5.975  -3.437  10.944
  109    HA2  GLY  25           HA2      GLY  25   4.066  -4.469  11.869
  110    HA3  GLY  25           HA1      GLY  25   4.195  -3.393  13.240
  111    H    ARG  26           HN       ARG  26   4.434  -2.192   9.986
  112    HA   ARG  26           HA       ARG  26   1.725  -1.076  10.260
  113    HB2  ARG  26           HB2      ARG  26   4.263   0.186   9.280
  114    HB3  ARG  26           HB1      ARG  26   2.718   0.729   8.637
  115    HG2  ARG  26           HG2      ARG  26   3.565   0.747  11.527
  116    HG3  ARG  26           HG1      ARG  26   3.357   2.146  10.465
  117    HD2  ARG  26           HD2      ARG  26   0.971   1.518  10.200
  118    HD3  ARG  26           HD1      ARG  26   1.209   0.235  11.380
  119    HE   ARG  26           HE       ARG  26   1.468   3.118  11.971
  120   HH11  ARG  26          HH11      ARG  26   0.748  -0.175  12.946
  121   HH12  ARG  26          HH12      ARG  26   0.077   0.286  14.477
  122   HH21  ARG  26          HH21      ARG  26   0.570   3.729  13.990
  123   HH22  ARG  26          HH22      ARG  26  -0.053   2.503  15.060
  124    HA   PRO  27           HA       PRO  27   1.062  -3.003   6.279
  125    HB2  PRO  27           HB2      PRO  27  -1.546  -2.487   6.057
  126    HB3  PRO  27           HB1      PRO  27  -0.972  -3.623   7.282
  127    HG2  PRO  27           HG2      PRO  27  -1.694  -0.725   7.594
  128    HG3  PRO  27           HG1      PRO  27  -2.178  -2.105   8.603
  129    HD2  PRO  27           HD2      PRO  27  -0.085  -0.514   9.245
  130    HD3  PRO  27           HD1      PRO  27  -0.165  -2.166   9.702
  131    H    PHE  28           HN       PHE  28   1.977  -1.917   4.722
  132    HA   PHE  28           HA       PHE  28   1.004   0.715   3.950
  133    HB2  PHE  28           HB2      PHE  28   2.991   0.727   2.430
  134    HB3  PHE  28           HB1      PHE  28   3.407   0.591   4.128
  135    HD1  PHE  28           HD1      PHE  28   3.444  -2.102   4.849
  136    HD2  PHE  28           HD2      PHE  28   4.383  -0.444   1.041
  137    HE1  PHE  28           HE1      PHE  28   4.862  -4.044   4.356
  138    HE2  PHE  28           HE2      PHE  28   5.780  -2.398   0.541
  139    HZ   PHE  28           HZ       PHE  28   6.026  -4.199   2.197
  140    H    PHE  29           HN       PHE  29  -0.373   0.937   2.363
  141    HA   PHE  29           HA       PHE  29  -1.196  -1.445   0.922
  142    HB2  PHE  29           HB2      PHE  29  -2.443   1.318   0.972
  143    HB3  PHE  29           HB1      PHE  29  -3.134  -0.123   0.228
  144    HD1  PHE  29           HD2      PHE  29  -1.944   1.121   3.541
  145    HD2  PHE  29           HD1      PHE  29  -4.640  -1.374   1.398
  146    HE1  PHE  29           HE2      PHE  29  -3.093   0.563   5.641
  147    HE2  PHE  29           HE1      PHE  29  -5.796  -1.933   3.492
  148    HZ   PHE  29           HZ       PHE  29  -5.019  -0.974   5.616
  149    H    ILE  30           HN       ILE  30  -0.173  -1.850  -0.850
  150    HA   ILE  30           HA       ILE  30   1.095   0.320  -2.328
  151    HB   ILE  30           HB       ILE  30   1.327  -2.636  -2.883
  152   HG12  ILE  30          HG12      ILE  30   3.241  -0.944  -1.318
  153   HG13  ILE  30          HG11      ILE  30   2.035  -1.961  -0.542
  154   HG21  ILE  30          HG21      ILE  30   3.403  -1.964  -4.010
  155   HG22  ILE  30          HG22      ILE  30   3.066  -0.276  -3.620
  156   HG23  ILE  30          HG23      ILE  30   1.996  -1.163  -4.709
  157   HD11  ILE  30          HD11      ILE  30   4.200  -3.048  -0.584
  158   HD12  ILE  30          HD12      ILE  30   4.265  -2.888  -2.340
  159   HD13  ILE  30          HD13      ILE  30   3.049  -3.923  -1.592
  160    H    ASP  31           HN       ASP  31   0.314   1.075  -4.107
  161    HA   ASP  31           HA       ASP  31  -1.813  -0.337  -5.517
  162    HB2  ASP  31           HB2      ASP  31  -2.277   1.976  -5.415
  163    HB3  ASP  31           HB1      ASP  31  -0.618   2.416  -5.810
  164    H    HIS  32           HN       HIS  32  -1.105  -1.941  -6.663
  165    HA   HIS  32           HA       HIS  32   1.593  -1.992  -7.674
  166    HB2  HIS  32           HB2      HIS  32  -0.666  -4.002  -7.698
  167    HB3  HIS  32           HB1      HIS  32   0.899  -4.326  -8.423
  168    HD1  HIS  32           HD1      HIS  32   1.796  -6.101  -6.766
  169    HD2  HIS  32           HD2      HIS  32   0.420  -2.654  -4.895
  170    HE1  HIS  32           HE1      HIS  32   2.387  -6.327  -4.296
  171    HE2  HIS  32           HE2      HIS  32   1.312  -4.367  -3.208
  172    H    ASN  33           HN       ASN  33  -1.076  -0.552  -8.806
  173    HA   ASN  33           HA       ASN  33  -0.745  -1.266 -11.611
  174    HB2  ASN  33           HB2      ASN  33  -2.515   0.862 -10.383
  175    HB3  ASN  33           HB1      ASN  33  -2.572   0.289 -12.044
  176   HD21  ASN  33          HD21      ASN  33  -3.414  -0.332  -8.759
  177   HD22  ASN  33          HD22      ASN  33  -4.448  -1.697  -9.067
  178    H    THR  34           HN       THR  34  -0.691   1.768  -9.714
  179    HA   THR  34           HA       THR  34   0.848   3.044 -11.850
  180    HB   THR  34           HB       THR  34  -0.056   4.480  -9.374
  181    HG1  THR  34           HG1      THR  34  -1.950   3.493  -9.920
  182   HG21  THR  34          HG21      THR  34  -0.378   6.324 -10.954
  183   HG22  THR  34          HG22      THR  34   0.079   5.268 -12.289
  184   HG23  THR  34          HG23      THR  34   1.264   5.690 -11.053
  185    H    LYS  35           HN       LYS  35   1.591   1.244  -9.258
  186    HA   LYS  35           HA       LYS  35   3.536   0.818  -8.157
  187    HB2  LYS  35           HB2      LYS  35   4.586   2.955 -10.016
  188    HB3  LYS  35           HB1      LYS  35   5.604   2.121  -8.856
  189    HG2  LYS  35           HG2      LYS  35   5.930   1.081 -10.952
  190    HG3  LYS  35           HG1      LYS  35   4.968  -0.029  -9.978
  191    HD2  LYS  35           HD2      LYS  35   2.967   0.599 -11.141
  192    HD3  LYS  35           HD1      LYS  35   3.819   1.878 -12.008
  193    HE2  LYS  35           HE2      LYS  35   5.198   0.204 -13.129
  194    HE3  LYS  35           HE1      LYS  35   4.366  -1.078 -12.248
  195    HZ1  LYS  35           HZ1      LYS  35   3.617  -0.503 -14.625
  196    HZ2  LYS  35           HZ2      LYS  35   2.831   0.816 -13.904
  197    HZ3  LYS  35           HZ3      LYS  35   2.435  -0.767 -13.439
  198    H    THR  36           HN       THR  36   1.581   2.809  -7.235
  199    HA   THR  36           HA       THR  36   3.297   4.725  -5.795
  200    HB   THR  36           HB       THR  36   1.201   5.997  -5.355
  201    HG1  THR  36           HG1      THR  36   0.011   4.157  -7.197
  202   HG21  THR  36          HG21      THR  36   1.760   5.426  -8.265
  203   HG22  THR  36          HG22      THR  36   2.612   6.591  -7.252
  204   HG23  THR  36          HG23      THR  36   0.910   6.840  -7.641
  205    H    THR  37           HN       THR  37   2.973   5.037  -3.508
  206    HA   THR  37           HA       THR  37   1.632   2.763  -2.212
  207    HB   THR  37           HB       THR  37   3.582   3.088  -0.482
  208    HG1  THR  37           HG1      THR  37   5.467   3.813  -1.417
  209   HG21  THR  37          HG21      THR  37   3.099   1.028  -1.713
  210   HG22  THR  37          HG22      THR  37   4.836   1.330  -1.638
  211   HG23  THR  37          HG23      THR  37   3.945   1.668  -3.123
  212    H    THR  38           HN       THR  38   0.728   3.098  -0.193
  213    HA   THR  38           HA       THR  38   0.949   5.694   1.092
  214    HB   THR  38           HB       THR  38  -0.913   6.024  -0.482
  215    HG1  THR  38           HG1      THR  38  -2.600   6.207   1.422
  216   HG21  THR  38          HG21      THR  38  -2.999   4.747  -0.235
  217   HG22  THR  38          HG22      THR  38  -2.214   3.707   0.954
  218   HG23  THR  38          HG23      THR  38  -1.655   3.714  -0.718
  219    H    TRP  39           HN       TRP  39   0.304   5.605   3.347
  220    HA   TRP  39           HA       TRP  39   0.352   2.887   4.412
  221    HB2  TRP  39           HB2      TRP  39   0.265   5.513   5.909
  222    HB3  TRP  39           HB1      TRP  39   0.549   3.928   6.612
  223    HD1  TRP  39           HD1      TRP  39   2.244   6.770   4.895
  224    HE1  TRP  39           HE1      TRP  39   4.788   6.320   4.799
  225    HE3  TRP  39           HE3      TRP  39   2.240   1.900   6.400
  226    HZ2  TRP  39           HZ2      TRP  39   6.550   4.157   5.315
  227    HZ3  TRP  39           HZ3      TRP  39   4.383   0.708   6.589
  228    HH2  TRP  39           HH2      TRP  39   6.490   1.813   6.064
  229    H    GLU  40           HN       GLU  40  -1.950   5.115   3.481
  230    HA   GLU  40           HA       GLU  40  -3.727   4.347   5.661
  231    HB2  GLU  40           HB2      GLU  40  -4.983   6.420   5.145
  232    HB3  GLU  40           HB1      GLU  40  -3.316   6.682   5.650
  233    HG2  GLU  40           HG2      GLU  40  -3.782   8.201   3.943
  234    HG3  GLU  40           HG1      GLU  40  -2.709   6.986   3.268
  235    H    ASP  41           HN       ASP  41  -6.033   4.224   5.120
  236    HA   ASP  41           HA       ASP  41  -6.129   2.035   3.249
  237    HB2  ASP  41           HB2      ASP  41  -8.203   3.145   5.147
  238    HB3  ASP  41           HB1      ASP  41  -8.427   1.701   4.165
  239    HA   PRO  42           HA       PRO  42  -8.055   4.252  -0.112
  240    HB2  PRO  42           HB2      PRO  42  -9.102   2.062  -1.382
  241    HB3  PRO  42           HB1      PRO  42  -7.417   2.570  -1.533
  242    HG2  PRO  42           HG2      PRO  42  -8.609   0.451   0.214
  243    HG3  PRO  42           HG1      PRO  42  -7.111   0.405  -0.735
  244    HD2  PRO  42           HD2      PRO  42  -7.096   0.831   1.924
  245    HD3  PRO  42           HD1      PRO  42  -5.930   1.628   0.847
  246    H    ARG  43           HN       ARG  43  -9.555   2.402   2.285
  247    HA   ARG  43           HA       ARG  43 -12.262   2.782   1.398
  248    HB2  ARG  43           HB2      ARG  43 -11.045   1.691   3.919
  249    HB3  ARG  43           HB1      ARG  43 -12.775   1.984   3.785
  250    HG2  ARG  43           HG2      ARG  43 -11.159   0.183   1.987
  251    HG3  ARG  43           HG1      ARG  43 -12.211  -0.343   3.307
  252    HD2  ARG  43           HD2      ARG  43 -14.140   0.586   2.194
  253    HD3  ARG  43           HD1      ARG  43 -13.122   1.263   0.925
  254    HE   ARG  43           HE       ARG  43 -12.981  -1.612   1.227
  255   HH11  ARG  43          HH11      ARG  43 -14.520   1.090  -0.391
  256   HH12  ARG  43          HH12      ARG  43 -15.053   0.137  -1.745
  257   HH21  ARG  43          HH21      ARG  43 -13.672  -2.863  -0.549
  258   HH22  ARG  43          HH22      ARG  43 -14.591  -2.114  -1.822
  259    H    LEU  44           HN       LEU  44  -9.954   4.732   2.842
  260    HA   LEU  44           HA       LEU  44 -11.708   6.326   4.419
  261    HB2  LEU  44           HB2      LEU  44  -8.995   6.999   3.302
  262    HB3  LEU  44           HB1      LEU  44  -9.852   7.938   4.510
  263    HG   LEU  44           HG       LEU  44  -8.880   5.103   4.886
  264   HD11  LEU  44          HD11      LEU  44  -7.034   6.675   4.759
  265   HD12  LEU  44          HD12      LEU  44  -7.248   6.098   6.413
  266   HD13  LEU  44          HD13      LEU  44  -7.810   7.708   5.959
  267   HD21  LEU  44          HD21      LEU  44 -10.148   7.040   6.819
  268   HD22  LEU  44          HD22      LEU  44  -9.466   5.470   7.240
  269   HD23  LEU  44          HD23      LEU  44 -10.879   5.565   6.187
  270    H    LYS  45           HN       LYS  45 -11.329   5.919   1.223
  271    HA   LYS  45           HA       LYS  45 -12.536   8.528   0.590
  272    HB2  LYS  45           HB2      LYS  45 -10.989   6.649  -1.209
  273    HB3  LYS  45           HB1      LYS  45 -11.887   8.041  -1.792
  274    HG2  LYS  45           HG2      LYS  45  -9.830   8.967  -1.666
  275    HG3  LYS  45           HG1      LYS  45 -10.371   9.296  -0.020
  276    HD2  LYS  45           HD2      LYS  45  -9.157   7.411   0.820
  277    HD3  LYS  45           HD1      LYS  45  -8.774   6.866  -0.814
  278    HE2  LYS  45           HE2      LYS  45  -7.538   9.008  -1.154
  279    HE3  LYS  45           HE1      LYS  45  -7.793   9.366   0.554
  280    HZ1  LYS  45           HZ1      LYS  45  -6.498   7.489   1.175
  281    HZ2  LYS  45           HZ2      LYS  45  -5.606   8.340   0.010
  282    HZ3  LYS  45           HZ3      LYS  45  -6.424   6.926  -0.420
  283    H    GLN 112           H        GLN 112   5.814   9.807   6.309
  284    HA   GLN 112           HA       GLN 112   8.422   8.411   6.347
  285    HB2  GLN 112           HB2      GLN 112   7.031   7.973   8.340
  286    HB3  GLN 112           HB1      GLN 112   5.692   7.524   7.297
  287    HG2  GLN 112           HG2      GLN 112   6.861   5.587   8.264
  288    HG3  GLN 112           HG1      GLN 112   6.883   5.599   6.502
  289   HE21  GLN 112          HE21      GLN 112   8.800   5.710   5.439
  290   HE22  GLN 112          HE22      GLN 112  10.339   5.681   6.232
  291    H    ILE 113           HN       ILE 113   8.884   7.778   4.361
  292    HA   ILE 113           HA       ILE 113   6.869   7.545   2.347
  293    HB   ILE 113           HB       ILE 113   8.663   6.823   0.833
  294   HG12  ILE 113          HG12      ILE 113  10.018   5.641   2.642
  295   HG13  ILE 113          HG11      ILE 113  10.930   6.581   1.470
  296   HG21  ILE 113          HG21      ILE 113   9.313   9.264   2.475
  297   HG22  ILE 113          HG22      ILE 113   8.212   9.179   1.099
  298   HG23  ILE 113          HG23      ILE 113   9.941   8.921   0.862
  299   HD11  ILE 113          HD11      ILE 113  11.805   6.870   3.713
  300   HD12  ILE 113          HD12      ILE 113  10.234   7.449   4.267
  301   HD13  ILE 113          HD13      ILE 113  11.157   8.388   3.092
  302    HA   PRO 114           HA       PRO 114   6.155   3.191   3.024
  303    HB2  PRO 114           HB2      PRO 114   4.142   2.938   1.244
  304    HB3  PRO 114           HB1      PRO 114   3.933   3.679   2.833
  305    HG2  PRO 114           HG2      PRO 114   4.079   4.943   0.164
  306    HG3  PRO 114           HG1      PRO 114   3.248   5.492   1.626
  307    HD2  PRO 114           HD2      PRO 114   5.723   6.410   0.636
  308    HD3  PRO 114           HD1      PRO 114   5.003   6.779   2.212
  309    HA   PRO 115           HA       PRO 115   8.806   1.621  -0.320
  310    HB2  PRO 115           HB2      PRO 115   8.010  -0.894   1.052
  311    HB3  PRO 115           HB1      PRO 115   9.610  -0.329   0.593
  312    HG2  PRO 115           HG2      PRO 115   8.849  -0.265   3.127
  313    HG3  PRO 115           HG1      PRO 115   9.794   1.069   2.439
  314    HD2  PRO 115           HD2      PRO 115   6.869   0.922   3.034
  315    HD3  PRO 115           HD1      PRO 115   8.004   2.274   3.234
  316    HA   PRO 116           HA       PRO 116   5.631   0.246  -3.277
  317    HB2  PRO 116           HB2      PRO 116   7.748  -0.630  -4.921
  318    HB3  PRO 116           HB1      PRO 116   6.869   0.902  -5.059
  319    HG2  PRO 116           HG2      PRO 116   9.391   0.286  -3.582
  320    HG3  PRO 116           HG1      PRO 116   8.995   1.693  -4.606
  321    HD2  PRO 116           HD2      PRO 116   8.773   2.017  -2.099
  322    HD3  PRO 116           HD1      PRO 116   7.386   2.445  -3.067
  323    H    TYR 117           HN       TYR 117   5.833  -1.311  -4.609
  324    HA   TYR 117           HA       TYR 117   5.641  -3.863  -3.245
  325    HB2  TYR 117           HB2      TYR 117   4.621  -4.754  -5.240
  326    HB3  TYR 117           HB1      TYR 117   3.946  -3.163  -4.928
  327    HD1  TYR 117           HD1      TYR 117   5.109  -1.185  -6.259
  328    HD2  TYR 117           HD2      TYR 117   5.300  -5.290  -7.364
  329    HE1  TYR 117           HE1      TYR 117   5.633  -0.539  -8.575
  330    HE2  TYR 117           HE2      TYR 117   5.828  -4.652  -9.677
  331    HH   TYR 117           HH       TYR 117   6.769  -1.561 -10.573
  332    H    VAL 118           HN       VAL 118   7.279  -5.256  -3.017
  333    HA   VAL 118           HA       VAL 118   9.633  -5.038  -4.717
  334    HB   VAL 118           HB       VAL 118   9.220  -6.968  -2.431
  335   HG11  VAL 118          HG11      VAL 118  11.161  -7.421  -3.804
  336   HG12  VAL 118          HG12      VAL 118  11.668  -6.810  -2.228
  337   HG13  VAL 118          HG13      VAL 118  11.700  -5.750  -3.637
  338   HG21  VAL 118          HG21      VAL 118  10.212  -4.124  -2.264
  339   HG22  VAL 118          HG22      VAL 118  10.258  -5.302  -0.952
  340   HG23  VAL 118          HG23      VAL 118   8.709  -4.749  -1.586
  341    H    GLU 119           HN       GLU 119   6.765  -6.458  -4.932
  342    HA   GLU 119           HA       GLU 119   7.372  -9.150  -5.618
  343    HB2  GLU 119           HB2      GLU 119   4.919  -7.594  -6.428
  344    HB3  GLU 119           HB1      GLU 119   5.065  -9.328  -6.179
  345    HG2  GLU 119           HG2      GLU 119   5.264  -7.230  -4.035
  346    HG3  GLU 119           HG1      GLU 119   3.855  -8.236  -4.360
  347    HA   PRO 120           HA       PRO 120   8.796  -8.199  -9.775
  348    HB2  PRO 120           HB2      PRO 120   8.826 -11.116 -10.090
  349    HB3  PRO 120           HB1      PRO 120  10.165  -9.969 -10.164
  350    HG2  PRO 120           HG2      PRO 120   9.876 -11.696  -8.116
  351    HG3  PRO 120           HG1      PRO 120  10.559 -10.072  -7.895
  352    HD2  PRO 120           HD2      PRO 120   7.791 -11.062  -7.306
  353    HD3  PRO 120           HD1      PRO 120   8.830  -9.988  -6.345
  Start of MODEL   20
    1    H    PHE  12           H        PHE  12 -11.438  -8.743  -0.122
    2    HA   PHE  12           HA       PHE  12 -12.943  -6.987  -0.769
    3    HB2  PHE  12           HB2      PHE  12 -12.802  -7.745   1.592
    4    HB3  PHE  12           HB1      PHE  12 -11.609  -6.493   1.907
    5    HD1  PHE  12           HD2      PHE  12 -15.065  -6.848   0.550
    6    HD2  PHE  12           HD1      PHE  12 -12.332  -4.527   2.842
    7    HE1  PHE  12           HE2      PHE  12 -16.871  -5.267   1.095
    8    HE2  PHE  12           HE1      PHE  12 -14.131  -2.942   3.393
    9    HZ   PHE  12           HZ       PHE  12 -16.404  -3.309   2.515
   10    H    LEU  13           HN       LEU  13  -9.858  -6.209  -1.256
   11    HA   LEU  13           HA       LEU  13 -10.344  -3.307  -1.217
   12    HB2  LEU  13           HB2      LEU  13  -7.853  -4.951  -0.996
   13    HB3  LEU  13           HB1      LEU  13  -7.757  -3.322  -1.632
   14    HG   LEU  13           HG       LEU  13  -8.844  -2.529   0.508
   15   HD11  LEU  13          HD11      LEU  13  -9.814  -4.637   1.235
   16   HD12  LEU  13          HD12      LEU  13  -8.710  -3.990   2.450
   17   HD13  LEU  13          HD13      LEU  13  -8.199  -5.327   1.419
   18   HD21  LEU  13          HD21      LEU  13  -6.765  -2.643   1.787
   19   HD22  LEU  13          HD22      LEU  13  -6.460  -2.291   0.086
   20   HD23  LEU  13          HD23      LEU  13  -6.174  -3.914   0.715
   21    HA   PRO  14           HA       PRO  14 -10.177  -2.825  -5.661
   22    HB2  PRO  14           HB2      PRO  14  -7.934  -1.034  -4.857
   23    HB3  PRO  14           HB1      PRO  14  -9.126  -0.807  -6.141
   24    HG2  PRO  14           HG2      PRO  14  -9.545   0.345  -3.968
   25    HG3  PRO  14           HG1      PRO  14 -10.872  -0.629  -4.558
   26    HD2  PRO  14           HD2      PRO  14  -8.872  -1.279  -2.394
   27    HD3  PRO  14           HD1      PRO  14 -10.635  -1.537  -2.390
   28    H    LYS  15           HN       LYS  15  -9.053  -3.162  -7.336
   29    HA   LYS  15           HA       LYS  15  -7.510  -5.537  -7.204
   30    HB2  LYS  15           HB2      LYS  15  -7.265  -5.365  -9.614
   31    HB3  LYS  15           HB1      LYS  15  -8.914  -4.988  -9.139
   32    HG2  LYS  15           HG2      LYS  15  -8.587  -2.674  -9.514
   33    HG3  LYS  15           HG1      LYS  15  -6.842  -2.883  -9.686
   34    HD2  LYS  15           HD2      LYS  15  -7.120  -4.091 -11.726
   35    HD3  LYS  15           HD1      LYS  15  -8.867  -4.149 -11.508
   36    HE2  LYS  15           HE2      LYS  15  -7.197  -1.680 -11.984
   37    HE3  LYS  15           HE1      LYS  15  -8.257  -2.464 -13.156
   38    HZ1  LYS  15           HZ1      LYS  15 -10.095  -2.032 -11.491
   39    HZ2  LYS  15           HZ2      LYS  15  -9.481  -0.681 -12.307
   40    HZ3  LYS  15           HZ3      LYS  15  -9.012  -0.986 -10.704
   41    H    GLY  16           HN       GLY  16  -5.407  -5.931  -7.220
   42    HA2  GLY  16           HA2      GLY  16  -3.134  -5.611  -7.264
   43    HA3  GLY  16           HA1      GLY  16  -3.407  -4.071  -8.055
   44    H    TRP  17           HN       TRP  17  -5.214  -3.997  -5.271
   45    HA   TRP  17           HA       TRP  17  -3.152  -2.455  -3.913
   46    HB2  TRP  17           HB2      TRP  17  -6.110  -2.778  -3.469
   47    HB3  TRP  17           HB1      TRP  17  -5.079  -2.006  -2.268
   48    HD1  TRP  17           HD1      TRP  17  -6.172  -1.530  -5.960
   49    HE1  TRP  17           HE1      TRP  17  -6.065   0.977  -6.489
   50    HE3  TRP  17           HE3      TRP  17  -4.114   0.143  -1.576
   51    HZ2  TRP  17           HZ2      TRP  17  -5.196   3.360  -5.231
   52    HZ3  TRP  17           HZ3      TRP  17  -3.672   2.552  -1.329
   53    HH2  TRP  17           HH2      TRP  17  -4.202   4.125  -3.119
   54    H    GLU  18           HN       GLU  18  -1.858  -3.362  -2.547
   55    HA   GLU  18           HA       GLU  18  -2.734  -5.833  -1.215
   56    HB2  GLU  18           HB2      GLU  18  -0.216  -5.052  -2.540
   57    HB3  GLU  18           HB1      GLU  18  -0.054  -5.982  -1.058
   58    HG2  GLU  18           HG2      GLU  18  -1.753  -6.813  -3.390
   59    HG3  GLU  18           HG1      GLU  18  -0.090  -7.315  -3.135
   60    H    VAL  19           HN       VAL  19  -2.093  -6.243   0.833
   61    HA   VAL  19           HA       VAL  19  -1.293  -3.895   2.437
   62    HB   VAL  19           HB       VAL  19  -2.955  -6.193   3.464
   63   HG11  VAL  19          HG11      VAL  19  -1.780  -4.896   5.151
   64   HG12  VAL  19          HG12      VAL  19  -3.521  -4.636   5.262
   65   HG13  VAL  19          HG13      VAL  19  -2.492  -3.409   4.522
   66   HG21  VAL  19          HG21      VAL  19  -3.975  -3.559   2.421
   67   HG22  VAL  19          HG22      VAL  19  -4.938  -4.789   3.237
   68   HG23  VAL  19          HG23      VAL  19  -4.210  -5.135   1.667
   69    H    ARG  20           HN       ARG  20   0.765  -4.204   3.089
   70    HA   ARG  20           HA       ARG  20   1.434  -6.863   4.161
   71    HB2  ARG  20           HB2      ARG  20   2.553  -6.406   1.932
   72    HB3  ARG  20           HB1      ARG  20   3.393  -5.069   2.720
   73    HG2  ARG  20           HG2      ARG  20   4.125  -6.872   4.438
   74    HG3  ARG  20           HG1      ARG  20   3.702  -8.007   3.156
   75    HD2  ARG  20           HD2      ARG  20   5.615  -5.707   2.880
   76    HD3  ARG  20           HD1      ARG  20   6.091  -7.377   3.166
   77    HE   ARG  20           HE       ARG  20   4.555  -6.645   0.764
   78   HH11  ARG  20          HH11      ARG  20   7.425  -7.970   2.266
   79   HH12  ARG  20          HH12      ARG  20   8.018  -8.685   0.797
   80   HH21  ARG  20          HH21      ARG  20   5.381  -7.545  -1.209
   81   HH22  ARG  20          HH22      ARG  20   6.875  -8.426  -1.157
   82    H    HIS  21           HN       HIS  21   2.502  -6.882   6.092
   83    HA   HIS  21           HA       HIS  21   2.809  -4.329   7.486
   84    HB2  HIS  21           HB2      HIS  21   2.425  -7.111   8.258
   85    HB3  HIS  21           HB1      HIS  21   3.740  -6.375   9.148
   86    HD1  HIS  21           HD1      HIS  21   1.573  -7.274  10.809
   87    HD2  HIS  21           HD2      HIS  21   1.406  -3.445   9.066
   88    HE1  HIS  21           HE1      HIS  21  -0.001  -5.922  12.220
   89    HE2  HIS  21           HE2      HIS  21  -0.287  -3.762  11.000
   90    H    ALA  22           HN       ALA  22   4.672  -3.290   7.221
   91    HA   ALA  22           HA       ALA  22   7.109  -4.511   6.394
   92    HB1  ALA  22           HB1      ALA  22   6.610  -1.792   7.623
   93    HB2  ALA  22           HB2      ALA  22   6.585  -2.168   5.900
   94    HB3  ALA  22           HB3      ALA  22   8.091  -2.300   6.810
   95    HA   PRO  23           HA       PRO  23   8.982  -5.946  10.113
   96    HB2  PRO  23           HB2      PRO  23  11.254  -4.067   9.762
   97    HB3  PRO  23           HB1      PRO  23  11.260  -5.827   9.921
   98    HG2  PRO  23           HG2      PRO  23  11.690  -4.668   7.562
   99    HG3  PRO  23           HG1      PRO  23  10.737  -6.158   7.683
  100    HD2  PRO  23           HD2      PRO  23   9.815  -3.342   7.292
  101    HD3  PRO  23           HD1      PRO  23   9.190  -4.842   6.578
  102    H    ASN  24           HN       ASN  24   8.302  -2.612   9.814
  103    HA   ASN  24           HA       ASN  24   9.146  -1.890  12.473
  104    HB2  ASN  24           HB2      ASN  24   8.286   0.313  11.990
  105    HB3  ASN  24           HB1      ASN  24   9.233  -0.239  10.616
  106   HD21  ASN  24          HD21      ASN  24   7.295   1.823  10.626
  107   HD22  ASN  24          HD22      ASN  24   6.027   1.346   9.549
  108    H    GLY  25           HN       GLY  25   6.456  -3.295  10.969
  109    HA2  GLY  25           HA2      GLY  25   4.786  -4.356  12.321
  110    HA3  GLY  25           HA1      GLY  25   4.968  -3.049  13.472
  111    H    ARG  26           HN       ARG  26   4.934  -1.897  10.319
  112    HA   ARG  26           HA       ARG  26   2.093  -1.160  10.587
  113    HB2  ARG  26           HB2      ARG  26   4.482   0.295   9.488
  114    HB3  ARG  26           HB1      ARG  26   2.885   0.658   8.854
  115    HG2  ARG  26           HG2      ARG  26   3.644   0.835  11.761
  116    HG3  ARG  26           HG1      ARG  26   3.601   2.198  10.639
  117    HD2  ARG  26           HD2      ARG  26   1.314   0.509  11.620
  118    HD3  ARG  26           HD1      ARG  26   1.539   2.249  11.790
  119    HE   ARG  26           HE       ARG  26   1.423   1.548   9.053
  120   HH11  ARG  26          HH11      ARG  26  -0.604   2.046  11.867
  121   HH12  ARG  26          HH12      ARG  26  -2.066   2.241  10.934
  122   HH21  ARG  26          HH21      ARG  26  -0.505   1.796   7.828
  123   HH22  ARG  26          HH22      ARG  26  -2.006   2.089   8.648
  124    HA   PRO  27           HA       PRO  27   1.519  -3.051   6.543
  125    HB2  PRO  27           HB2      PRO  27  -1.089  -2.557   6.272
  126    HB3  PRO  27           HB1      PRO  27  -0.533  -3.714   7.489
  127    HG2  PRO  27           HG2      PRO  27  -1.289  -0.826   7.840
  128    HG3  PRO  27           HG1      PRO  27  -1.788  -2.233   8.806
  129    HD2  PRO  27           HD2      PRO  27   0.270  -0.637   9.540
  130    HD3  PRO  27           HD1      PRO  27   0.193  -2.302   9.957
  131    H    PHE  28           HN       PHE  28   2.259  -2.038   4.867
  132    HA   PHE  28           HA       PHE  28   1.249   0.621   4.179
  133    HB2  PHE  28           HB2      PHE  28   3.246   0.789   2.700
  134    HB3  PHE  28           HB1      PHE  28   3.660   0.614   4.393
  135    HD1  PHE  28           HD1      PHE  28   3.791  -2.131   4.988
  136    HD2  PHE  28           HD2      PHE  28   4.765  -0.220   1.305
  137    HE1  PHE  28           HE1      PHE  28   5.324  -3.969   4.439
  138    HE2  PHE  28           HE2      PHE  28   6.278  -2.072   0.753
  139    HZ   PHE  28           HZ       PHE  28   6.563  -3.946   2.316
  140    H    PHE  29           HN       PHE  29  -0.094   0.794   2.550
  141    HA   PHE  29           HA       PHE  29  -0.845  -1.648   1.168
  142    HB2  PHE  29           HB2      PHE  29  -2.184   1.070   1.176
  143    HB3  PHE  29           HB1      PHE  29  -2.830  -0.399   0.450
  144    HD1  PHE  29           HD2      PHE  29  -1.543   0.736   3.777
  145    HD2  PHE  29           HD1      PHE  29  -4.445  -1.504   1.620
  146    HE1  PHE  29           HE2      PHE  29  -2.674   0.176   5.887
  147    HE2  PHE  29           HE1      PHE  29  -5.581  -2.063   3.728
  148    HZ   PHE  29           HZ       PHE  29  -4.693  -1.225   5.865
  149    H    ILE  30           HN       ILE  30  -0.119  -2.077  -0.752
  150    HA   ILE  30           HA       ILE  30   1.148   0.082  -2.277
  151    HB   ILE  30           HB       ILE  30   1.461  -2.876  -2.780
  152   HG12  ILE  30          HG12      ILE  30   3.350  -1.126  -1.258
  153   HG13  ILE  30          HG11      ILE  30   2.166  -2.137  -0.449
  154   HG21  ILE  30          HG21      ILE  30   2.076  -1.388  -4.619
  155   HG22  ILE  30          HG22      ILE  30   3.507  -2.156  -3.928
  156   HG23  ILE  30          HG23      ILE  30   3.132  -0.477  -3.539
  157   HD11  ILE  30          HD11      ILE  30   4.392  -3.082  -2.242
  158   HD12  ILE  30          HD12      ILE  30   3.194  -4.115  -1.461
  159   HD13  ILE  30          HD13      ILE  30   4.344  -3.201  -0.485
  160    H    ASP  31           HN       ASP  31   0.373   0.714  -4.124
  161    HA   ASP  31           HA       ASP  31  -1.768  -0.786  -5.432
  162    HB2  ASP  31           HB2      ASP  31  -2.157   1.571  -5.467
  163    HB3  ASP  31           HB1      ASP  31  -0.509   1.907  -5.992
  164    H    HIS  32           HN       HIS  32  -1.167  -2.417  -6.644
  165    HA   HIS  32           HA       HIS  32   1.557  -2.525  -7.660
  166    HB2  HIS  32           HB2      HIS  32  -0.644  -4.599  -7.492
  167    HB3  HIS  32           HB1      HIS  32   0.924  -4.914  -8.217
  168    HD1  HIS  32           HD1      HIS  32   1.860  -6.568  -6.498
  169    HD2  HIS  32           HD2      HIS  32   0.449  -3.056  -4.775
  170    HE1  HIS  32           HE1      HIS  32   2.583  -6.613  -4.062
  171    HE2  HIS  32           HE2      HIS  32   1.500  -4.622  -3.035
  172    H    ASN  33           HN       ASN  33  -1.070  -1.112  -8.797
  173    HA   ASN  33           HA       ASN  33  -1.000  -2.148 -11.520
  174    HB2  ASN  33           HB2      ASN  33  -2.588   0.190 -10.441
  175    HB3  ASN  33           HB1      ASN  33  -2.824  -0.620 -11.985
  176   HD21  ASN  33          HD21      ASN  33  -3.423  -0.649  -8.618
  177   HD22  ASN  33          HD22      ASN  33  -4.485  -2.031  -8.598
  178    H    THR  34           HN       THR  34  -0.679   1.060  -9.994
  179    HA   THR  34           HA       THR  34   0.920   1.924 -12.317
  180    HB   THR  34           HB       THR  34  -0.504   3.660 -10.288
  181    HG1  THR  34           HG1      THR  34  -2.142   2.703 -11.355
  182   HG21  THR  34          HG21      THR  34   0.598   4.278 -13.029
  183   HG22  THR  34          HG22      THR  34   1.313   4.782 -11.498
  184   HG23  THR  34          HG23      THR  34  -0.263   5.408 -11.985
  185    H    LYS  35           HN       LYS  35   1.125   0.991  -9.152
  186    HA   LYS  35           HA       LYS  35   2.813   0.836  -7.675
  187    HB2  LYS  35           HB2      LYS  35   4.248   0.683  -9.777
  188    HB3  LYS  35           HB1      LYS  35   4.587   2.391  -9.557
  189    HG2  LYS  35           HG2      LYS  35   5.124   0.435  -7.352
  190    HG3  LYS  35           HG1      LYS  35   6.263   0.634  -8.680
  191    HD2  LYS  35           HD2      LYS  35   5.281   2.930  -6.996
  192    HD3  LYS  35           HD1      LYS  35   6.722   1.994  -6.602
  193    HE2  LYS  35           HE2      LYS  35   7.483   3.903  -7.765
  194    HE3  LYS  35           HE1      LYS  35   7.577   2.567  -8.908
  195    HZ1  LYS  35           HZ1      LYS  35   6.641   4.684  -9.811
  196    HZ2  LYS  35           HZ2      LYS  35   5.292   4.459  -8.810
  197    HZ3  LYS  35           HZ3      LYS  35   5.647   3.330 -10.023
  198    H    THR  36           HN       THR  36   1.493   2.138  -6.411
  199    HA   THR  36           HA       THR  36   2.888   4.567  -5.582
  200    HB   THR  36           HB       THR  36   0.574   5.558  -5.024
  201    HG1  THR  36           HG1      THR  36  -0.127   3.596  -6.968
  202   HG21  THR  36          HG21      THR  36   0.353   6.595  -7.236
  203   HG22  THR  36          HG22      THR  36   1.443   5.384  -7.914
  204   HG23  THR  36          HG23      THR  36   2.035   6.534  -6.714
  205    H    THR  37           HN       THR  37   2.597   4.988  -3.280
  206    HA   THR  37           HA       THR  37   1.556   2.643  -1.851
  207    HB   THR  37           HB       THR  37   3.591   3.035  -0.292
  208    HG1  THR  37           HG1      THR  37   5.390   3.896  -1.395
  209   HG21  THR  37          HG21      THR  37   4.935   1.479  -1.638
  210   HG22  THR  37          HG22      THR  37   3.918   1.816  -3.039
  211   HG23  THR  37          HG23      THR  37   3.233   1.014  -1.626
  212    H    THR  38           HN       THR  38   0.530   2.995   0.029
  213    HA   THR  38           HA       THR  38   0.766   5.544   1.412
  214    HB   THR  38           HB       THR  38  -1.023   5.798  -0.364
  215    HG1  THR  38           HG1      THR  38  -1.188   6.380   2.300
  216   HG21  THR  38          HG21      THR  38  -1.966   3.552  -0.285
  217   HG22  THR  38          HG22      THR  38  -3.207   4.760   0.047
  218   HG23  THR  38          HG23      THR  38  -2.512   3.824   1.370
  219    H    TRP  39           HN       TRP  39   0.095   5.361   3.646
  220    HA   TRP  39           HA       TRP  39   0.036   2.591   4.594
  221    HB2  TRP  39           HB2      TRP  39  -0.057   5.085   6.287
  222    HB3  TRP  39           HB1      TRP  39   0.414   3.465   6.780
  223    HD1  TRP  39           HD1      TRP  39   1.712   6.552   4.973
  224    HE1  TRP  39           HE1      TRP  39   4.294   6.373   4.826
  225    HE3  TRP  39           HE3      TRP  39   2.285   1.775   6.678
  226    HZ2  TRP  39           HZ2      TRP  39   6.297   4.432   5.397
  227    HZ3  TRP  39           HZ3      TRP  39   4.543   0.832   6.868
  228    HH2  TRP  39           HH2      TRP  39   6.504   2.127   6.242
  229    H    GLU  40           HN       GLU  40  -1.964   5.311   4.192
  230    HA   GLU  40           HA       GLU  40  -3.941   4.475   6.112
  231    HB2  GLU  40           HB2      GLU  40  -5.113   6.575   5.057
  232    HB3  GLU  40           HB1      GLU  40  -3.749   6.762   6.152
  233    HG2  GLU  40           HG2      GLU  40  -3.316   6.626   3.209
  234    HG3  GLU  40           HG1      GLU  40  -3.807   8.133   3.972
  235    H    ASP  41           HN       ASP  41  -5.655   3.400   5.732
  236    HA   ASP  41           HA       ASP  41  -6.000   1.753   3.553
  237    HB2  ASP  41           HB2      ASP  41  -8.130   2.693   5.489
  238    HB3  ASP  41           HB1      ASP  41  -8.244   1.275   4.458
  239    HA   PRO  42           HA       PRO  42  -7.759   4.385   0.425
  240    HB2  PRO  42           HB2      PRO  42  -8.822   2.395  -1.138
  241    HB3  PRO  42           HB1      PRO  42  -7.116   2.854  -1.148
  242    HG2  PRO  42           HG2      PRO  42  -8.460   0.598   0.283
  243    HG3  PRO  42           HG1      PRO  42  -6.922   0.604  -0.601
  244    HD2  PRO  42           HD2      PRO  42  -7.010   0.721   2.082
  245    HD3  PRO  42           HD1      PRO  42  -5.778   1.598   1.151
  246    H    ARG  43           HN       ARG  43  -9.512   2.324   2.497
  247    HA   ARG  43           HA       ARG  43 -12.125   2.972   1.473
  248    HB2  ARG  43           HB2      ARG  43 -11.236   1.607   4.014
  249    HB3  ARG  43           HB1      ARG  43 -12.923   1.874   3.594
  250    HG2  ARG  43           HG2      ARG  43 -10.959   0.276   1.959
  251    HG3  ARG  43           HG1      ARG  43 -12.160  -0.399   3.060
  252    HD2  ARG  43           HD2      ARG  43 -13.946   0.623   1.713
  253    HD3  ARG  43           HD1      ARG  43 -12.732   1.258   0.604
  254    HE   ARG  43           HE       ARG  43 -12.578  -1.586   0.936
  255   HH11  ARG  43          HH11      ARG  43 -14.244   0.975  -0.782
  256   HH12  ARG  43          HH12      ARG  43 -14.612  -0.020  -2.164
  257   HH21  ARG  43          HH21      ARG  43 -13.088  -2.909  -0.858
  258   HH22  ARG  43          HH22      ARG  43 -13.963  -2.236  -2.203
  259    H    LEU  44           HN       LEU  44  -9.843   4.619   3.279
  260    HA   LEU  44           HA       LEU  44 -11.616   5.985   5.052
  261    HB2  LEU  44           HB2      LEU  44  -8.790   6.655   4.262
  262    HB3  LEU  44           HB1      LEU  44  -9.684   7.437   5.552
  263    HG   LEU  44           HG       LEU  44  -8.861   4.533   5.485
  264   HD11  LEU  44          HD11      LEU  44  -6.983   6.039   5.828
  265   HD12  LEU  44          HD12      LEU  44  -7.364   5.167   7.314
  266   HD13  LEU  44          HD13      LEU  44  -7.854   6.851   7.128
  267   HD21  LEU  44          HD21      LEU  44 -10.257   6.124   7.636
  268   HD22  LEU  44          HD22      LEU  44  -9.675   4.467   7.794
  269   HD23  LEU  44          HD23      LEU  44 -10.976   4.841   6.662
  270    H    LYS  45           HN       LYS  45 -11.102   6.202   1.857
  271    HA   LYS  45           HA       LYS  45 -11.698   9.071   1.724
  272    HB2  LYS  45           HB2      LYS  45  -9.708   8.262   0.449
  273    HB3  LYS  45           HB1      LYS  45 -10.786   7.270  -0.527
  274    HG2  LYS  45           HG2      LYS  45 -11.985   9.337  -1.200
  275    HG3  LYS  45           HG1      LYS  45 -10.768  10.271  -0.335
  276    HD2  LYS  45           HD2      LYS  45  -9.029   9.334  -1.786
  277    HD3  LYS  45           HD1      LYS  45 -10.261   8.420  -2.661
  278    HE2  LYS  45           HE2      LYS  45 -10.034  11.420  -2.459
  279    HE3  LYS  45           HE1      LYS  45  -9.713  10.432  -3.883
  280    HZ1  LYS  45           HZ1      LYS  45 -12.024   9.806  -3.967
  281    HZ2  LYS  45           HZ2      LYS  45 -11.901  11.499  -3.948
  282    HZ3  LYS  45           HZ3      LYS  45 -12.357  10.668  -2.545
  283    H    GLN 112           H        GLN 112   4.964   9.200   5.939
  284    HA   GLN 112           HA       GLN 112   7.868   8.678   5.696
  285    HB2  GLN 112           HB2      GLN 112   6.456   7.754   7.685
  286    HB3  GLN 112           HB1      GLN 112   5.740   6.701   6.476
  287    HG2  GLN 112           HG2      GLN 112   7.439   5.431   7.431
  288    HG3  GLN 112           HG1      GLN 112   8.127   6.006   5.913
  289   HE21  GLN 112          HE21      GLN 112   9.789   7.531   5.960
  290   HE22  GLN 112          HE22      GLN 112  10.635   7.930   7.422
  291    H    ILE 113           HN       ILE 113   8.464   7.883   3.769
  292    HA   ILE 113           HA       ILE 113   6.474   7.415   1.731
  293    HB   ILE 113           HB       ILE 113   9.476   7.097   1.619
  294   HG12  ILE 113          HG12      ILE 113   7.695   9.344   0.648
  295   HG13  ILE 113          HG11      ILE 113   8.715   9.408   2.079
  296   HG21  ILE 113          HG21      ILE 113   8.376   5.757  -0.087
  297   HG22  ILE 113          HG22      ILE 113   9.182   7.143  -0.819
  298   HG23  ILE 113          HG23      ILE 113   7.432   7.156  -0.602
  299   HD11  ILE 113          HD11      ILE 113   9.740  10.581   0.225
  300   HD12  ILE 113          HD12      ILE 113   9.664   9.122  -0.764
  301   HD13  ILE 113          HD13      ILE 113  10.697   9.166   0.664
  302    HA   PRO 114           HA       PRO 114   6.416   3.010   2.833
  303    HB2  PRO 114           HB2      PRO 114   4.307   2.755   0.856
  304    HB3  PRO 114           HB1      PRO 114   4.227   2.524   2.604
  305    HG2  PRO 114           HG2      PRO 114   3.030   4.595   1.300
  306    HG3  PRO 114           HG1      PRO 114   3.568   4.674   2.986
  307    HD2  PRO 114           HD2      PRO 114   4.851   5.785   0.532
  308    HD3  PRO 114           HD1      PRO 114   4.764   6.452   2.175
  309    HA   PRO 115           HA       PRO 115   8.933   1.566  -0.655
  310    HB2  PRO 115           HB2      PRO 115   8.337  -0.987   0.762
  311    HB3  PRO 115           HB1      PRO 115   9.876  -0.352   0.193
  312    HG2  PRO 115           HG2      PRO 115   9.285  -0.308   2.772
  313    HG3  PRO 115           HG1      PRO 115  10.120   1.065   2.017
  314    HD2  PRO 115           HD2      PRO 115   7.253   0.795   2.819
  315    HD3  PRO 115           HD1      PRO 115   8.331   2.204   2.918
  316    HA   PRO 116           HA       PRO 116   5.696   0.089  -3.470
  317    HB2  PRO 116           HB2      PRO 116   7.747  -0.925  -5.132
  318    HB3  PRO 116           HB1      PRO 116   6.899   0.620  -5.317
  319    HG2  PRO 116           HG2      PRO 116   9.452   0.008  -3.898
  320    HG3  PRO 116           HG1      PRO 116   9.045   1.386  -4.955
  321    HD2  PRO 116           HD2      PRO 116   8.930   1.794  -2.451
  322    HD3  PRO 116           HD1      PRO 116   7.525   2.234  -3.386
  323    H    TYR 117           HN       TYR 117   5.812  -1.513  -4.765
  324    HA   TYR 117           HA       TYR 117   5.405  -3.976  -3.307
  325    HB2  TYR 117           HB2      TYR 117   4.353  -4.860  -5.258
  326    HB3  TYR 117           HB1      TYR 117   3.871  -3.177  -5.134
  327    HD1  TYR 117           HD2      TYR 117   5.942  -5.579  -6.988
  328    HD2  TYR 117           HD1      TYR 117   4.454  -1.598  -6.864
  329    HE1  TYR 117           HE2      TYR 117   6.649  -5.258  -9.311
  330    HE2  TYR 117           HE1      TYR 117   5.155  -1.262  -9.198
  331    HH   TYR 117           HH       TYR 117   6.116  -3.841 -11.222
  332    H    VAL 118           HN       VAL 118   6.385  -5.970  -3.582
  333    HA   VAL 118           HA       VAL 118   8.974  -5.925  -4.998
  334    HB   VAL 118           HB       VAL 118   8.112  -7.813  -2.790
  335   HG11  VAL 118          HG11      VAL 118  10.483  -8.401  -2.678
  336   HG12  VAL 118          HG12      VAL 118  10.814  -7.322  -4.032
  337   HG13  VAL 118          HG13      VAL 118   9.805  -8.749  -4.270
  338   HG21  VAL 118          HG21      VAL 118   9.621  -6.543  -1.330
  339   HG22  VAL 118          HG22      VAL 118   8.288  -5.548  -1.916
  340   HG23  VAL 118          HG23      VAL 118   9.891  -5.383  -2.629
  341    H    GLU 119           HN       GLU 119   5.910  -7.451  -4.599
  342    HA   GLU 119           HA       GLU 119   6.461  -9.797  -6.142
  343    HB2  GLU 119           HB2      GLU 119   3.711  -8.681  -5.670
  344    HB3  GLU 119           HB1      GLU 119   4.204 -10.360  -5.809
  345    HG2  GLU 119           HG2      GLU 119   3.861 -10.269  -3.572
  346    HG3  GLU 119           HG1      GLU 119   5.550  -9.763  -3.605
  347    HA   PRO 120           HA       PRO 120   6.009  -7.604 -10.030
  348    HB2  PRO 120           HB2      PRO 120   6.552 -10.151 -11.315
  349    HB3  PRO 120           HB1      PRO 120   7.572  -8.714 -11.242
  350    HG2  PRO 120           HG2      PRO 120   8.174 -11.036  -9.961
  351    HG3  PRO 120           HG1      PRO 120   8.685  -9.442  -9.377
  352    HD2  PRO 120           HD2      PRO 120   6.405 -11.155  -8.466
  353    HD3  PRO 120           HD1      PRO 120   7.549 -10.195  -7.502