*HEADER   DNA-BINDING PROTEIN                     21-FEB-95   1OCP    
*TITLE    SOLUTION STRUCTURE OF OCT3 POU-HOMEODOMAIN                  
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: OCT-3;                                           
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 DOMAIN: POU-HOMEODOMAIN;                                   
*COMPND  5 ENGINEERED: YES                                            
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                         
*SOURCE  3 ORGANISM_COMMON: MOUSE;                                    
*SOURCE  4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  5 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                       
*SOURCE  6 EXPRESSION_SYSTEM_PLASMID: PAR2113;                        
*SOURCE  7 EXPRESSION_SYSTEM_GENE: T7 GENE 1 UNDER CONTROL OF THE     
*SOURCE  8 LAC UV5 PROMOTER                                           
*EXPDTA   NMR, 20 STRUCTURES                                          
*AUTHOR   E.H.MORITA,F.HAYASHI,M.SHIRAKAWA,Y.KYOGOKU                  
*REVDAT  1   15-SEP-95 1OCP    0                                      


HEADER NMR structure of Oct3 POU-homeodomain (20 structures)
HEADER  Division of Molecular Biophysics
HEADER  Institute for Protein Research
HEADER  Osaka University
HEADER  Suita, Osaka 565, Japan
HEADER  Tel:+81-6-879-8598  Fax:+81-6-879-8599 (from abroad)
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assign (resid  59 and name HN)  (resid 61 and name HN)  4.5 2.7 0.0
assign (resid  59 and name HA)  (resid 62 and name HN)  4.5 2.7 0.0
assign (resid  59 and name HA)  (resid 62 and name HB#)  5.5 3.7 0.0
assign (resid  60 and name HN)  (resid 60 and name HG#)  4.5 2.7 0.0
assign (resid  60 and name HN)  (resid 61 and name HN)  3.5 1.7 0.0
assign (resid  61 and name HN)  (resid 61 and name HG#)  4.5 2.7 0.0
assign (resid  61 and name HN)  (resid 62 and name HN)  4.5 2.7 0.0
assign (resid  61 and name HA)  (resid 62 and name HB#)  5.5 3.7 0.0
assign (resid  61 and name HA)  (resid 62 and name HG#)  5.5 3.7 0.0
assign (resid  61 and name HA)  (resid 63 and name HA#)  5.5 3.7 0.0
assign (resid  61 and name HA)  (resid 64 and name HN)  4.5 2.7 0.0
assign (resid  61 and name HA)  (resid 64 and name HB#)  5.5 3.7 0.0
assign (resid  61 and name HG#)  (resid 62 and name HN)  5.5 3.7 0.0
assign (resid  62 and name HN)  (resid 62 and name HG#)  5.5 3.7 0.0
assign (resid  62 and name HN)  (resid 63 and name HN)  4.5 2.7 0.0
assign (resid  62 and name HA)  (resid 63 and name HN)  3.5 1.7 0.0
assign (resid  62 and name HA)  (resid 63 and name HA#)  5.5 3.7 0.0
assign (resid  62 and name HB#)  (resid 63 and name HN)  4.5 2.7 0.0
assign (resid  62 and name HG#)  (resid 63 and name HN)  5.5 3.7 0.0
assign (resid  63 and name HN)  (resid 64 and name HN)  4.5 2.7 0.0
assign (resid  63 and name HA#)  (resid 64 and name HA)  5.5 3.7 0.0
assign (resid  63 and name HA#)  (resid 66 and name HB#)  6.5 4.7 0.0
assign (resid  64 and name HN)  (resid 64 and name HG#)  5.5 3.7 0.0
assign (resid  64 and name HN)  (resid 65 and name HN)  4.5 2.7 0.0
assign (resid  64 and name HA)  (resid 65 and name HN)  3.5 1.7 0.0
assign (resid  64 and name HA)  (resid 65 and name HA)  4.5 2.7 0.0
assign (resid  65 and name HN)  (resid 65 and name HG#)  5.5 3.7 0.0
assign (resid  65 and name HN)  (resid 66 and name HN)  4.5 2.7 0.0
assign (resid  66 and name HN)  (resid 67 and name HN)  4.5 2.7 0.0
assign (resid  66 and name HA)  (resid 67 and name HB#)  5.5 3.7 0.0

restraints
  dihedral

    reset

    assign (resid 2 and name c) (resid 3 and name n)
      (resid 3 and name ca) (resid 3 and name c)  1.0 -120.0 40.0 2
    assign (resid 3 and name c) (resid 4 and name n)
      (resid 4 and name ca) (resid 4 and name c)  1.0 -120.0 40.0 2
    assign (resid 4 and name c) (resid 5 and name n)
      (resid 5 and name ca) (resid 5 and name c)  1.0 -120.0 40.0 2
    assign (resid 5 and name c) (resid 6 and name n)
      (resid 6 and name ca) (resid 6 and name c)  1.0 -120.0 40.0 2
    assign (resid 6 and name c) (resid 7 and name n)
      (resid 7 and name ca) (resid 7 and name c)  1.0 -65.0 25.0 2
    assign (resid 7 and name c) (resid 8 and name n)
      (resid 8 and name ca) (resid 8 and name c)  1.0 -120.0 40.0 2
    assign (resid 8 and name c) (resid 9 and name n)
      (resid 9 and name ca) (resid 9 and name c)  1.0 -120.0 40.0 2
    assign (resid 9 and name c) (resid 10 and name n)
      (resid 10 and name ca) (resid 10 and name c)  1.0 -120.0 40.0 2
    assign (resid 10 and name c) (resid 11 and name n)
      (resid 11 and name ca) (resid 11 and name c)  1.0 -120.0 40.0 2
    assign (resid 11 and name c) (resid 12 and name n)
      (resid 12 and name ca) (resid 12 and name c)  1.0 -120.0 40.0 2
    assign (resid 12 and name c) (resid 13 and name n)
      (resid 13 and name ca) (resid 13 and name c)  1.0 -120.0 40.0 2
    assign (resid 13 and name c) (resid 14 and name n)
      (resid 14 and name ca) (resid 14 and name c)  1.0 -120.0 40.0 2
    assign (resid 14 and name c) (resid 15 and name n)
      (resid 15 and name ca) (resid 15 and name c)  1.0 -120.0 40.0 2
    assign (resid 15 and name c) (resid 16 and name n)
      (resid 16 and name ca) (resid 16 and name c)  1.0 -65.0 25.0 2
    assign (resid 16 and name c) (resid 17 and name n)
      (resid 17 and name ca) (resid 17 and name c)  1.0 -65.0 25.0 2
    assign (resid 17 and name c) (resid 18 and name n)
      (resid 18 and name ca) (resid 18 and name c)  1.0 -65.0 25.0 2
    assign (resid 19 and name c) (resid 20 and name n)
      (resid 20 and name ca) (resid 20 and name c)  1.0 -65.0 25.0 2
    assign (resid 20 and name c) (resid 21 and name n)
      (resid 21 and name ca) (resid 21 and name c)  1.0 -65.0 25.0 2
    assign (resid 21 and name c) (resid 22 and name n)
      (resid 22 and name ca) (resid 22 and name c)  1.0 -65.0 25.0 2
    assign (resid 22 and name c) (resid 23 and name n)
      (resid 23 and name ca) (resid 23 and name c)  1.0 -65.0 25.0 2
    assign (resid 23 and name c) (resid 24 and name n)
      (resid 24 and name ca) (resid 24 and name c)  1.0 -65.0 25.0 2
    assign (resid 24 and name c) (resid 25 and name n)
      (resid 25 and name ca) (resid 25 and name c)  1.0 -65.0 25.0 2
    assign (resid 25 and name c) (resid 26 and name n)
      (resid 26 and name ca) (resid 26 and name c)  1.0 -65.0 25.0 2
    assign (resid 26 and name c) (resid 27 and name n)
      (resid 27 and name ca) (resid 27 and name c)  1.0 -65.0 25.0 2
    assign (resid 27 and name c) (resid 28 and name n)
      (resid 28 and name ca) (resid 28 and name c)  1.0 -65.0 25.0 2
    assign (resid 28 and name c) (resid 29 and name n)
      (resid 29 and name ca) (resid 29 and name c)  1.0 -120.0 20.0 2
    assign (resid 29 and name c) (resid 30 and name n)
      (resid 30 and name ca) (resid 30 and name c)  1.0 -120.0 20.0 2
    assign (resid 31 and name c) (resid 32 and name n)
      (resid 32 and name ca) (resid 32 and name c)  1.0 -120.0 20.0 2
    assign (resid 33 and name c) (resid 34 and name n)
      (resid 34 and name ca) (resid 34 and name c)  1.0 -65.0 25.0 2
    assign (resid 34 and name c) (resid 35 and name n)
      (resid 35 and name ca) (resid 35 and name c)  1.0 -65.0 25.0 2
    assign (resid 35 and name c) (resid 36 and name n)
      (resid 36 and name ca) (resid 36 and name c)  1.0 -65.0 25.0 2
    assign (resid 36 and name c) (resid 37 and name n)
      (resid 37 and name ca) (resid 37 and name c)  1.0 -65.0 25.0 2
    assign (resid 37 and name c) (resid 38 and name n)
      (resid 38 and name ca) (resid 38 and name c)  1.0 -65.0 25.0 2
    assign (resid 38 and name c) (resid 39 and name n)
      (resid 39 and name ca) (resid 39 and name c)  1.0 -65.0 25.0 2
    assign (resid 39 and name c) (resid 40 and name n)
      (resid 40 and name ca) (resid 40 and name c)  1.0 -65.0 25.0 2
    assign (resid 40 and name c) (resid 41 and name n)
      (resid 41 and name ca) (resid 41 and name c)  1.0 -65.0 25.0 2
    assign (resid 41 and name c) (resid 42 and name n)
      (resid 42 and name ca) (resid 42 and name c)  1.0 -65.0 25.0 2
    assign (resid 42 and name c) (resid 43 and name n)
      (resid 43 and name ca) (resid 43 and name c)  1.0 -65.0 25.0 2
    assign (resid 43 and name c) (resid 44 and name n)
      (resid 44 and name ca) (resid 44 and name c)  1.0 -65.0 25.0 2
    assign (resid 44 and name c) (resid 45 and name n)
      (resid 45 and name ca) (resid 45 and name c)  1.0 -120.0 40.0 2
    assign (resid 46 and name c) (resid 47 and name n)
      (resid 47 and name ca) (resid 47 and name c)  1.0 -120.0 20.0 2
    assign (resid 47 and name c) (resid 48 and name n)
      (resid 48 and name ca) (resid 48 and name c)  1.0 -65.0 25.0 2
    assign (resid 48 and name c) (resid 49 and name n)
      (resid 49 and name ca) (resid 49 and name c)  1.0 -65.0 25.0 2
    assign (resid 49 and name c) (resid 50 and name n)
      (resid 50 and name ca) (resid 50 and name c)  1.0 -65.0 25.0 2
    assign (resid 51 and name c) (resid 52 and name n)
      (resid 52 and name ca) (resid 52 and name c)  1.0 -65.0 25.0 2
    assign (resid 52 and name c) (resid 53 and name n)
      (resid 53 and name ca) (resid 53 and name c)  1.0 -65.0 25.0 2
    assign (resid 53 and name c) (resid 54 and name n)
      (resid 54 and name ca) (resid 54 and name c)  1.0 -65.0 25.0 2
    assign (resid 54 and name c) (resid 55 and name n)
      (resid 55 and name ca) (resid 55 and name c)  1.0 -65.0 25.0 2
    assign (resid 55 and name c) (resid 56 and name n)
      (resid 56 and name ca) (resid 56 and name c)  1.0 -65.0 25.0 2
    assign (resid 56 and name c) (resid 57 and name n)
      (resid 57 and name ca) (resid 57 and name c)  1.0 -65.0 25.0 2
    assign (resid 57 and name c) (resid 58 and name n)
      (resid 58 and name ca) (resid 58 and name c)  1.0 -65.0 25.0 2
    assign (resid 58 and name c) (resid 59 and name n)
      (resid 59 and name ca) (resid 59 and name c)  1.0 -65.0 25.0 2
    assign (resid 59 and name c) (resid 60 and name n)
      (resid 60 and name ca) (resid 60 and name c)  1.0 -65.0 25.0 2
    assign (resid 60 and name c) (resid 61 and name n)
      (resid 61 and name ca) (resid 61 and name c)  1.0 -120.0 40.0 2
    assign (resid 61 and name c) (resid 62 and name n)
      (resid 62 and name ca) (resid 62 and name c)  1.0 -120.0 40.0 2
    assign (resid 63 and name c) (resid 64 and name n)
      (resid 64 and name ca) (resid 64 and name c)  1.0 -120.0 40.0 2
    assign (resid 64 and name c) (resid 65 and name n)
      (resid 65 and name ca) (resid 65 and name c)  1.0 -120.0 40.0 2
    assign (resid 65 and name c) (resid 66 and name n)
      (resid 66 and name ca) (resid 66 and name c)  1.0 -120.0 40.0 2
    assign (resid 66 and name c) (resid 67 and name n)
      (resid 67 and name ca) (resid 67 and name c)  1.0 -120.0 40.0 2
    assign (resid 23 and name n) (resid 23 and name ca)
      (resid 23 and name cb) (resid 23 and name cg)  1.0 -60.0 60.0 2
    assign (resid 55 and name n) (resid 55 and name ca)
      (resid 55 and name cb) (resid 55 and name cg)  1.0 180.0 60.0 2
    assign (resid 59 and name n) (resid 59 and name ca)
      (resid 59 and name cb) (resid 59 and name cg)  1.0 180.0 60.0 2

end

  Entry H atom name         Orig H atom name
  Start of MODEL           1
 Raw file had  616 H/Q atoms
  Start of MODEL    1
    1   1H    MET   1           HT2      MET   1  45.515  -4.211  22.677
    2   2H    MET   1           HT1      MET   1  45.009  -4.059  24.291
    3   3H    MET   1           HT3      MET   1  44.399  -3.006  23.110
    4    HA   MET   1           HA       MET   1  46.324  -1.788  22.964
    5   1HB   MET   1           HB2      MET   1  45.572  -2.661  25.681
    6   2HB   MET   1           HB1      MET   1  47.200  -1.992  25.569
    7   1HG   MET   1           HG2      MET   1  44.927  -0.552  24.236
    8   2HG   MET   1           HG1      MET   1  45.154  -0.386  25.977
    9   1HE   MET   1           HE2      MET   1  45.001   1.543  23.804
   10   2HE   MET   1           HE1      MET   1  45.772   2.639  24.949
   11   3HE   MET   1           HE3      MET   1  46.448   2.429  23.328
   12    H    GLU   2           HN       GLU   2  47.068  -4.800  24.740
   13    HA   GLU   2           HA       GLU   2  49.884  -4.600  23.803
   14   1HB   GLU   2           HB2      GLU   2  49.070  -5.144  26.262
   15   2HB   GLU   2           HB1      GLU   2  48.894  -6.776  25.616
   16   1HG   GLU   2           HG2      GLU   2  51.190  -6.949  25.099
   17   2HG   GLU   2           HG1      GLU   2  51.432  -5.203  25.192
   18    H    THR   3           HN       THR   3  48.225  -5.134  21.717
   19    HA   THR   3           HA       THR   3  48.678  -8.050  21.229
   20    HB   THR   3           HB       THR   3  46.264  -7.601  21.488
   21    HG1  THR   3           HG1      THR   3  46.985  -9.125  19.940
   22   1HG2  THR   3          HG22      THR   3  46.593  -5.160  20.605
   23   2HG2  THR   3          HG21      THR   3  46.353  -5.888  19.018
   24   3HG2  THR   3          HG23      THR   3  45.089  -6.005  20.242
   25    H    LEU   4           HN       LEU   4  49.313  -8.591  19.068
   26    HA   LEU   4           HA       LEU   4  50.002  -6.285  17.305
   27   1HB   LEU   4           HB2      LEU   4  52.203  -7.398  16.834
   28   2HB   LEU   4           HB1      LEU   4  52.053  -6.824  18.495
   29    HG   LEU   4           HG       LEU   4  51.120  -9.599  17.974
   30   1HD1  LEU   4          HD12      LEU   4  53.366  -9.142  16.702
   31   2HD1  LEU   4          HD11      LEU   4  54.070  -9.124  18.319
   32   3HD1  LEU   4          HD13      LEU   4  53.240 -10.566  17.735
   33   1HD2  LEU   4          HD22      LEU   4  51.212  -8.329  20.212
   34   2HD2  LEU   4          HD21      LEU   4  51.913  -9.947  20.193
   35   3HD2  LEU   4          HD23      LEU   4  52.961  -8.531  20.122
   36    H    VAL   5           HN       VAL   5  47.786  -7.748  16.782
   37    HA   VAL   5           HA       VAL   5  48.563  -9.203  14.328
   38    HB   VAL   5           HB       VAL   5  46.711 -10.470  16.366
   39   1HG1  VAL   5          HG13      VAL   5  47.698 -11.148  13.626
   40   2HG1  VAL   5          HG12      VAL   5  47.449 -12.469  14.767
   41   3HG1  VAL   5          HG11      VAL   5  46.106 -11.409  14.340
   42   1HG2  VAL   5          HG23      VAL   5  49.637 -10.982  15.747
   43   2HG2  VAL   5          HG22      VAL   5  48.942 -10.515  17.299
   44   3HG2  VAL   5          HG21      VAL   5  48.618 -12.116  16.633
   45    H    GLN   6           HN       GLN   6  47.114  -6.671  15.106
   46    HA   GLN   6           HA       GLN   6  44.745  -7.132  13.388
   47   1HB   GLN   6           HB2      GLN   6  44.662  -6.060  16.214
   48   2HB   GLN   6           HB1      GLN   6  43.387  -5.711  15.045
   49   1HG   GLN   6           HG2      GLN   6  42.879  -8.046  14.780
   50   2HG   GLN   6           HG1      GLN   6  44.307  -8.520  15.701
   51   1HE2  GLN   6          HE22      GLN   6  41.164  -6.865  17.794
   52   2HE2  GLN   6          HE21      GLN   6  41.444  -6.360  16.198
   53    H    ALA   7           HN       ALA   7  46.959  -5.882  12.483
   54    HA   ALA   7           HA       ALA   7  46.985  -3.041  12.990
   55   1HB   ALA   7           HB3      ALA   7  48.781  -4.750  11.902
   56   2HB   ALA   7           HB2      ALA   7  48.089  -4.063  10.432
   57   3HB   ALA   7           HB1      ALA   7  48.830  -3.007  11.636
   58    NH1  ARG   8           NH2      ARG   8  45.875   3.046  13.302
   59    NH2  ARG   8           NH1      ARG   8  44.953   1.564  14.739
   60    H    ARG   8           HN       ARG   8  46.840  -1.630  10.822
   61    HA   ARG   8           HA       ARG   8  44.107  -2.067   9.802
   62   1HB   ARG   8           HB2      ARG   8  45.887   0.369   9.553
   63   2HB   ARG   8           HB1      ARG   8  44.175   0.280   9.137
   64   1HG   ARG   8           HG2      ARG   8  43.735  -0.389  11.544
   65   2HG   ARG   8           HG1      ARG   8  45.416   0.023  11.885
   66   1HD   ARG   8           HD2      ARG   8  45.000   2.312  10.989
   67   2HD   ARG   8           HD1      ARG   8  43.302   1.890  10.770
   68    HE   ARG   8           HE       ARG   8  42.998   2.124  13.102
   69   1HH1  ARG   8          HH21      ARG   8  45.847   3.543  12.435
   70   2HH1  ARG   8          HH22      ARG   8  46.637   3.185  13.935
   71   1HH2  ARG   8          HH11      ARG   8  44.219   0.927  14.973
   72   2HH2  ARG   8          HH12      ARG   8  45.715   1.703  15.371
   73    H    LYS   9           HN       LYS   9  47.344  -1.216   8.561
   74    HA   LYS   9           HA       LYS   9  46.486  -2.238   5.911
   75   1HB   LYS   9           HB2      LYS   9  48.283  -0.016   6.756
   76   2HB   LYS   9           HB1      LYS   9  48.706  -0.889   5.283
   77   1HG   LYS   9           HG2      LYS   9  45.912   0.152   5.761
   78   2HG   LYS   9           HG1      LYS   9  47.160   1.152   5.017
   79   1HD   LYS   9           HD2      LYS   9  47.292  -0.184   3.115
   80   2HD   LYS   9           HD1      LYS   9  46.679  -1.611   3.951
   81   1HE   LYS   9           HE2      LYS   9  44.449  -0.485   4.127
   82   2HE   LYS   9           HE1      LYS   9  45.083   0.839   3.151
   83   1HZ   LYS   9           HZ3      LYS   9  45.092  -1.993   2.274
   84   2HZ   LYS   9           HZ2      LYS   9  43.855  -0.895   1.884
   85   3HZ   LYS   9           HZ1      LYS   9  45.440  -0.624   1.336
   86    NH1  ARG  10           NH1      ARG  10  53.812  -7.029   4.115
   87    NH2  ARG  10           NH2      ARG  10  51.904  -8.219   3.886
   88    H    ARG  10           HN       ARG  10  49.362  -2.019   8.025
   89    HA   ARG  10           HA       ARG  10  49.981  -4.819   7.504
   90   1HB   ARG  10           HB2      ARG  10  51.038  -3.041   5.712
   91   2HB   ARG  10           HB1      ARG  10  52.317  -3.103   6.924
   92   1HG   ARG  10           HG2      ARG  10  52.944  -4.906   5.623
   93   2HG   ARG  10           HG1      ARG  10  51.859  -5.724   6.747
   94   1HD   ARG  10           HD2      ARG  10  50.316  -6.141   5.136
   95   2HD   ARG  10           HD1      ARG  10  50.486  -4.535   4.427
   96    HE   ARG  10           HE       ARG  10  51.906  -5.514   2.838
   97   1HH1  ARG  10          HH11      ARG  10  54.288  -6.149   4.128
   98   2HH1  ARG  10          HH12      ARG  10  54.322  -7.875   4.265
   99   1HH2  ARG  10          HH21      ARG  10  50.917  -8.253   3.724
  100   2HH2  ARG  10          HH22      ARG  10  52.415  -9.065   4.036
  101    H    LYS  11           HN       LYS  11  51.921  -1.984   8.517
  102    HA   LYS  11           HA       LYS  11  51.784  -2.770  11.311
  103   1HB   LYS  11           HB2      LYS  11  54.218  -3.186  11.553
  104   2HB   LYS  11           HB1      LYS  11  53.450  -4.383  10.511
  105   1HG   LYS  11           HG2      LYS  11  54.135  -2.919   8.536
  106   2HG   LYS  11           HG1      LYS  11  55.128  -2.008   9.672
  107   1HD   LYS  11           HD2      LYS  11  56.747  -3.532   9.233
  108   2HD   LYS  11           HD1      LYS  11  55.813  -4.631  10.247
  109   1HE   LYS  11           HE2      LYS  11  56.212  -5.763   8.159
  110   2HE   LYS  11           HE1      LYS  11  54.514  -5.286   8.174
  111   1HZ   LYS  11           HZ3      LYS  11  55.448  -3.158   7.039
  112   2HZ   LYS  11           HZ2      LYS  11  56.748  -4.171   6.626
  113   3HZ   LYS  11           HZ1      LYS  11  55.172  -4.558   6.122
  114    NH1  ARG  12           NH1      ARG  12  49.393   0.209  16.249
  115    NH2  ARG  12           NH2      ARG  12  48.169  -1.535  15.495
  116    H    ARG  12           HN       ARG  12  53.041  -1.250  12.687
  117    HA   ARG  12           HA       ARG  12  53.810   1.279  11.308
  118   1HB   ARG  12           HB2      ARG  12  52.588   2.547  13.105
  119   2HB   ARG  12           HB1      ARG  12  51.528   1.663  12.007
  120   1HG   ARG  12           HG2      ARG  12  52.439   0.158  14.397
  121   2HG   ARG  12           HG1      ARG  12  51.341   1.502  14.714
  122   1HD   ARG  12           HD2      ARG  12  49.646   0.587  13.318
  123   2HD   ARG  12           HD1      ARG  12  50.766  -0.557  12.579
  124    HE   ARG  12           HE       ARG  12  50.631  -1.916  14.563
  125   1HH1  ARG  12          HH11      ARG  12  50.215   0.777  16.199
  126   2HH1  ARG  12          HH12      ARG  12  48.687   0.411  16.928
  127   1HH2  ARG  12          HH21      ARG  12  48.053  -2.304  14.867
  128   2HH2  ARG  12          HH22      ARG  12  47.463  -1.333  16.174
  129    H    THR  13           HN       THR  13  55.072  -1.075  12.987
  130    HA   THR  13           HA       THR  13  56.176   0.333  15.304
  131    HB   THR  13           HB       THR  13  57.290  -2.198  14.088
  132    HG1  THR  13           HG1      THR  13  55.441  -3.085  14.445
  133   1HG2  THR  13          HG22      THR  13  58.216  -0.824  16.155
  134   2HG2  THR  13          HG21      THR  13  56.910  -1.650  17.006
  135   3HG2  THR  13          HG23      THR  13  58.166  -2.587  16.197
  136    H    SER  14           HN       SER  14  57.038  -0.268  11.967
  137    HA   SER  14           HA       SER  14  59.210   1.688  12.165
  138   1HB   SER  14           HB2      SER  14  60.755   0.010  10.923
  139   2HB   SER  14           HB1      SER  14  60.572  -0.181  12.665
  140    HG   SER  14           HG       SER  14  59.460  -1.677  10.555
  141    H    ILE  15           HN       ILE  15  56.621   1.447  10.852
  142    HA   ILE  15           HA       ILE  15  57.486   2.133   8.130
  143    HB   ILE  15           HB       ILE  15  55.544  -0.129   8.682
  144   1HG1  ILE  15          HG12      ILE  15  57.963  -0.719   8.611
  145   2HG1  ILE  15          HG11      ILE  15  57.073  -1.426   7.268
  146   1HG2  ILE  15          HG22      ILE  15  55.857   1.675   6.324
  147   2HG2  ILE  15          HG21      ILE  15  55.657  -0.045   5.988
  148   3HG2  ILE  15          HG23      ILE  15  54.425   0.824   6.905
  149   1HD1  ILE  15          HD11      ILE  15  57.987   1.180   6.466
  150   2HD1  ILE  15          HD13      ILE  15  59.353   0.285   7.135
  151   3HD1  ILE  15          HD12      ILE  15  58.423  -0.391   5.800
  152    H    GLU  16           HN       GLU  16  56.784   4.158   9.319
  153    HA   GLU  16           HA       GLU  16  54.013   4.601   9.900
  154   1HB   GLU  16           HB2      GLU  16  56.330   6.453   9.318
  155   2HB   GLU  16           HB1      GLU  16  54.703   7.059   9.633
  156   1HG   GLU  16           HG2      GLU  16  55.788   5.055  11.551
  157   2HG   GLU  16           HG1      GLU  16  56.488   6.673  11.604
  158    H    ASN  17           HN       ASN  17  52.523   5.828   8.551
  159    HA   ASN  17           HA       ASN  17  52.466   4.985   5.833
  160   1HB   ASN  17           HB2      ASN  17  50.565   5.959   7.398
  161   2HB   ASN  17           HB1      ASN  17  51.043   7.493   6.668
  162   1HD2  ASN  17          HD22      ASN  17  48.796   6.668   4.049
  163   2HD2  ASN  17          HD21      ASN  17  49.122   7.713   5.346
  164    NH1  ARG  18           NH1      ARG  18  52.057  12.702   8.281
  165    NH2  ARG  18           NH2      ARG  18  53.374  14.457   7.734
  166    H    ARG  18           HN       ARG  18  54.015   7.695   7.366
  167    HA   ARG  18           HA       ARG  18  54.396   9.175   4.876
  168   1HB   ARG  18           HB2      ARG  18  54.631   9.752   7.631
  169   2HB   ARG  18           HB1      ARG  18  56.266   9.886   6.985
  170   1HG   ARG  18           HG2      ARG  18  55.278  12.045   6.711
  171   2HG   ARG  18           HG1      ARG  18  55.261  11.303   5.111
  172   1HD   ARG  18           HD2      ARG  18  52.975  11.039   5.103
  173   2HD   ARG  18           HD1      ARG  18  52.890  10.819   6.851
  174    HE   ARG  18           HE       ARG  18  52.857  13.401   5.427
  175   1HH1  ARG  18          HH11      ARG  18  51.618  11.839   8.032
  176   2HH1  ARG  18          HH12      ARG  18  51.927  13.084   9.196
  177   1HH2  ARG  18          HH21      ARG  18  53.943  14.938   7.067
  178   2HH2  ARG  18          HH22      ARG  18  53.245  14.840   8.649
  179    H    VAL  19           HN       VAL  19  56.152   6.788   6.787
  180    HA   VAL  19           HA       VAL  19  58.682   7.132   5.501
  181    HB   VAL  19           HB       VAL  19  57.907   5.639   7.633
  182   1HG1  VAL  19          HG11      VAL  19  58.131   3.665   5.343
  183   2HG1  VAL  19          HG13      VAL  19  58.442   3.239   7.015
  184   3HG1  VAL  19          HG12      VAL  19  56.842   3.800   6.538
  185   1HG2  VAL  19          HG22      VAL  19  60.201   6.407   6.771
  186   2HG2  VAL  19          HG21      VAL  19  60.170   4.910   7.702
  187   3HG2  VAL  19          HG23      VAL  19  60.284   4.853   5.942
  188    NH1  ARG  20           NH2      ARG  20  52.347  -0.916   2.839
  189    NH2  ARG  20           NH1      ARG  20  53.526  -1.730   4.587
  190    H    ARG  20           HN       ARG  20  55.948   4.982   4.786
  191    HA   ARG  20           HA       ARG  20  57.130   3.670   2.552
  192   1HB   ARG  20           HB2      ARG  20  54.269   4.296   3.273
  193   2HB   ARG  20           HB1      ARG  20  54.678   3.416   1.804
  194   1HG   ARG  20           HG2      ARG  20  56.025   1.832   3.287
  195   2HG   ARG  20           HG1      ARG  20  55.232   2.605   4.661
  196   1HD   ARG  20           HD2      ARG  20  53.185   1.687   4.173
  197   2HD   ARG  20           HD1      ARG  20  53.470   1.717   2.433
  198    HE   ARG  20           HE       ARG  20  55.239  -0.201   3.318
  199   1HH1  ARG  20          HH21      ARG  20  52.244  -0.252   2.098
  200   2HH1  ARG  20          HH22      ARG  20  51.651  -1.618   2.982
  201   1HH2  ARG  20          HH11      ARG  20  54.327  -1.691   5.186
  202   2HH2  ARG  20          HH12      ARG  20  52.830  -2.433   4.729
  203    CH2  TRP  21           CH2      TRP  21  52.467   3.676  -1.476
  204    H    TRP  21           HN       TRP  21  55.166   6.642   2.623
  205    HA   TRP  21           HA       TRP  21  55.657   6.976  -0.221
  206   1HB   TRP  21           HB2      TRP  21  54.278   8.853   1.693
  207   2HB   TRP  21           HB1      TRP  21  54.282   8.992  -0.075
  208    HD1  TRP  21           HD1      TRP  21  51.818   8.065   2.141
  209    HE1  TRP  21           HE1      TRP  21  50.463   5.963   1.496
  210    HE3  TRP  21           HE3      TRP  21  54.894   6.030  -1.419
  211    HZ2  TRP  21           HZ2      TRP  21  50.692   3.692  -0.267
  212    HZ3  TRP  21           HZ3      TRP  21  54.343   3.916  -2.510
  213    HH2  TRP  21           HH2      TRP  21  52.214   2.754  -1.978
  214    H    SER  22           HN       SER  22  57.541   7.481   2.417
  215    HA   SER  22           HA       SER  22  59.009   9.791   1.404
  216   1HB   SER  22           HB2      SER  22  58.965   8.869   3.873
  217   2HB   SER  22           HB1      SER  22  60.138   7.701   3.272
  218    HG   SER  22           HG       SER  22  61.548   9.304   2.881
  219    H    LEU  23           HN       LEU  23  59.068   6.251   1.343
  220    HA   LEU  23           HA       LEU  23  61.456   5.752  -0.140
  221   1HB   LEU  23           HB2      LEU  23  58.754   4.417  -0.417
  222   2HB   LEU  23           HB1      LEU  23  60.250   3.747  -0.999
  223    HG   LEU  23           HG       LEU  23  59.954   4.362   1.915
  224   1HD1  LEU  23          HD11      LEU  23  57.947   3.043   0.780
  225   2HD1  LEU  23          HD13      LEU  23  59.105   1.715   0.739
  226   3HD1  LEU  23          HD12      LEU  23  58.642   2.436   2.279
  227   1HD2  LEU  23          HD22      LEU  23  61.547   2.536   0.119
  228   2HD2  LEU  23          HD21      LEU  23  62.114   3.554   1.443
  229   3HD2  LEU  23          HD23      LEU  23  61.264   2.049   1.789
  230    H    GLU  24           HN       GLU  24  58.122   6.410  -1.092
  231    HA   GLU  24           HA       GLU  24  58.282   6.245  -3.874
  232   1HB   GLU  24           HB2      GLU  24  56.395   7.114  -2.051
  233   2HB   GLU  24           HB1      GLU  24  56.707   8.564  -2.998
  234   1HG   GLU  24           HG2      GLU  24  56.370   7.199  -5.082
  235   2HG   GLU  24           HG1      GLU  24  55.885   5.845  -4.060
  236    H    THR  25           HN       THR  25  58.830   9.281  -2.000
  237    HA   THR  25           HA       THR  25  59.557  10.813  -4.297
  238    HB   THR  25           HB       THR  25  58.991  11.929  -2.208
  239    HG1  THR  25           HG1      THR  25  60.712  13.371  -2.183
  240   1HG2  THR  25          HG22      THR  25  61.368  10.393  -1.175
  241   2HG2  THR  25          HG21      THR  25  60.823  11.871  -0.382
  242   3HG2  THR  25          HG23      THR  25  59.739  10.486  -0.505
  243    H    MET  26           HN       MET  26  61.378   8.567  -2.309
  244    HA   MET  26           HA       MET  26  63.980   9.403  -3.333
  245   1HB   MET  26           HB2      MET  26  63.148   6.823  -1.973
  246   2HB   MET  26           HB1      MET  26  64.810   7.341  -2.254
  247   1HG   MET  26           HG2      MET  26  62.773   8.880  -0.617
  248   2HG   MET  26           HG1      MET  26  64.038   7.857   0.058
  249   1HE   MET  26           HE1      MET  26  66.308   7.910  -0.819
  250   2HE   MET  26           HE3      MET  26  67.275   9.374  -1.049
  251   3HE   MET  26           HE2      MET  26  66.644   8.973   0.546
  252    H    PHE  27           HN       PHE  27  61.474   7.213  -4.432
  253    HA   PHE  27           HA       PHE  27  63.286   5.929  -6.381
  254   1HB   PHE  27           HB2      PHE  27  60.379   5.483  -5.644
  255   2HB   PHE  27           HB1      PHE  27  61.092   4.753  -7.080
  256    HD1  PHE  27           HD2      PHE  27  63.521   3.665  -6.628
  257    HD2  PHE  27           HD1      PHE  27  60.443   4.230  -3.686
  258    HE1  PHE  27           HE2      PHE  27  64.532   1.885  -5.228
  259    HE2  PHE  27           HE1      PHE  27  61.453   2.449  -2.287
  260    HZ   PHE  27           HZ       PHE  27  63.498   1.277  -3.057
  261    H    LEU  28           HN       LEU  28  61.143   8.630  -6.248
  262    HA   LEU  28           HA       LEU  28  60.677   8.622  -9.160
  263   1HB   LEU  28           HB2      LEU  28  59.821  10.578  -7.012
  264   2HB   LEU  28           HB1      LEU  28  59.315  10.632  -8.703
  265    HG   LEU  28           HG       LEU  28  58.912   8.193  -6.962
  266   1HD1  LEU  28          HD11      LEU  28  57.207  10.648  -7.316
  267   2HD1  LEU  28          HD13      LEU  28  56.464   9.083  -6.984
  268   3HD1  LEU  28          HD12      LEU  28  57.605   9.780  -5.833
  269   1HD2  LEU  28          HD23      LEU  28  58.535   8.792  -9.751
  270   2HD2  LEU  28          HD22      LEU  28  58.203   7.285  -8.900
  271   3HD2  LEU  28          HD21      LEU  28  56.953   8.523  -9.019
  272    H    LYS  29           HN       LYS  29  63.417   9.082  -7.875
  273    HA   LYS  29           HA       LYS  29  63.964  11.837  -8.858
  274   1HB   LYS  29           HB2      LYS  29  66.135  11.617  -7.747
  275   2HB   LYS  29           HB1      LYS  29  64.865  11.172  -6.611
  276   1HG   LYS  29           HG2      LYS  29  65.269   8.741  -7.342
  277   2HG   LYS  29           HG1      LYS  29  66.735   9.332  -8.123
  278   1HD   LYS  29           HD2      LYS  29  67.328  10.388  -5.862
  279   2HD   LYS  29           HD1      LYS  29  66.036   9.397  -5.182
  280   1HE   LYS  29           HE2      LYS  29  67.423   7.562  -6.701
  281   2HE   LYS  29           HE1      LYS  29  68.716   8.604  -6.104
  282   1HZ   LYS  29           HZ2      LYS  29  67.488   8.351  -3.866
  283   2HZ   LYS  29           HZ1      LYS  29  66.793   6.977  -4.583
  284   3HZ   LYS  29           HZ3      LYS  29  68.477   7.083  -4.413
  285    H    CYS  30           HN       CYS  30  64.868   8.468  -9.279
  286    HA   CYS  30           HA       CYS  30  65.696   9.049 -12.044
  287   1HB   CYS  30           HB2      CYS  30  67.364   7.766  -9.888
  288   2HB   CYS  30           HB1      CYS  30  67.580   7.280 -11.569
  289    HG   CYS  30           HG       CYS  30  68.341   9.663 -12.165
  290    HA   PRO  31           HA       PRO  31  63.281   5.320 -12.455
  291   1HB   PRO  31           HB2      PRO  31  63.822   4.777 -15.083
  292   2HB   PRO  31           HB1      PRO  31  62.741   6.088 -14.576
  293   1HG   PRO  31           HG2      PRO  31  65.503   6.253 -15.670
  294   2HG   PRO  31           HG1      PRO  31  64.213   7.466 -15.694
  295   1HD   PRO  31           HD2      PRO  31  66.448   7.388 -13.915
  296   2HD   PRO  31           HD1      PRO  31  65.050   8.479 -13.818
  297    H    LYS  32           HN       LYS  32  66.583   5.353 -12.180
  298    HA   LYS  32           HA       LYS  32  66.815   2.471 -12.835
  299   1HB   LYS  32           HB2      LYS  32  69.257   2.965 -13.213
  300   2HB   LYS  32           HB1      LYS  32  68.173   3.744 -14.364
  301   1HG   LYS  32           HG2      LYS  32  68.301   5.849 -13.141
  302   2HG   LYS  32           HG1      LYS  32  69.260   5.094 -11.870
  303   1HD   LYS  32           HD2      LYS  32  70.207   5.016 -14.727
  304   2HD   LYS  32           HD1      LYS  32  70.499   6.441 -13.730
  305   1HE   LYS  32           HE2      LYS  32  71.301   4.547 -11.995
  306   2HE   LYS  32           HE1      LYS  32  71.648   3.704 -13.504
  307   1HZ   LYS  32           HZ3      LYS  32  72.900   5.661 -14.236
  308   2HZ   LYS  32           HZ2      LYS  32  72.615   6.404 -12.735
  309   3HZ   LYS  32           HZ1      LYS  32  73.549   4.988 -12.821
  310    HA   PRO  33           HA       PRO  33  67.914   3.169  -8.330
  311   1HB   PRO  33           HB2      PRO  33  65.998   1.536  -7.218
  312   2HB   PRO  33           HB1      PRO  33  65.775   3.276  -7.469
  313   1HG   PRO  33           HG2      PRO  33  64.624   0.995  -8.997
  314   2HG   PRO  33           HG1      PRO  33  63.987   2.632  -8.770
  315   1HD   PRO  33           HD2      PRO  33  65.289   1.690 -11.097
  316   2HD   PRO  33           HD1      PRO  33  64.983   3.393 -10.693
  317    H    SER  34           HN       SER  34  69.586   1.845  -7.785
  318    HA   SER  34           HA       SER  34  69.872  -0.787  -9.009
  319   1HB   SER  34           HB2      SER  34  71.560   0.998  -7.324
  320   2HB   SER  34           HB1      SER  34  71.952  -0.718  -7.375
  321    HG   SER  34           HG       SER  34  71.892  -0.486  -9.710
  322    H    LEU  35           HN       LEU  35  70.089  -2.778  -7.841
  323    HA   LEU  35           HA       LEU  35  68.248  -3.081  -5.662
  324   1HB   LEU  35           HB2      LEU  35  68.888  -5.368  -5.603
  325   2HB   LEU  35           HB1      LEU  35  69.086  -4.909  -7.288
  326    HG   LEU  35           HG       LEU  35  71.370  -4.876  -5.300
  327   1HD1  LEU  35          HD12      LEU  35  70.339  -7.073  -7.094
  328   2HD1  LEU  35          HD11      LEU  35  72.020  -7.022  -6.561
  329   3HD1  LEU  35          HD13      LEU  35  70.722  -7.156  -5.374
  330   1HD2  LEU  35          HD21      LEU  35  71.114  -4.673  -8.303
  331   2HD2  LEU  35          HD23      LEU  35  71.903  -3.547  -7.200
  332   3HD2  LEU  35          HD22      LEU  35  72.637  -5.115  -7.534
  333    H    GLN  36           HN       GLN  36  71.553  -2.058  -5.884
  334    HA   GLN  36           HA       GLN  36  72.316  -2.590  -3.124
  335   1HB   GLN  36           HB2      GLN  36  73.458  -1.245  -5.467
  336   2HB   GLN  36           HB1      GLN  36  73.753  -0.339  -3.984
  337   1HG   GLN  36           HG2      GLN  36  74.187  -3.280  -3.852
  338   2HG   GLN  36           HG1      GLN  36  75.355  -2.350  -4.792
  339   1HE2  GLN  36          HE22      GLN  36  75.359  -2.069  -0.739
  340   2HE2  GLN  36          HE21      GLN  36  74.235  -3.050  -1.550
  341    H    GLN  37           HN       GLN  37  70.878   0.077  -4.933
  342    HA   GLN  37           HA       GLN  37  70.646   1.895  -2.712
  343   1HB   GLN  37           HB2      GLN  37  70.393   2.473  -5.195
  344   2HB   GLN  37           HB1      GLN  37  68.786   1.752  -5.101
  345   1HG   GLN  37           HG2      GLN  37  68.045   3.765  -4.392
  346   2HG   GLN  37           HG1      GLN  37  68.887   3.444  -2.877
  347   1HE2  GLN  37          HE22      GLN  37  70.911   6.265  -3.442
  348   2HE2  GLN  37          HE21      GLN  37  69.930   5.389  -2.369
  349    H    ILE  38           HN       ILE  38  68.850  -0.923  -3.788
  350    HA   ILE  38           HA       ILE  38  66.464  -0.372  -2.256
  351    HB   ILE  38           HB       ILE  38  67.578  -2.883  -3.545
  352   1HG1  ILE  38          HG12      ILE  38  66.573  -1.184  -5.024
  353   2HG1  ILE  38          HG11      ILE  38  65.547  -2.616  -4.957
  354   1HG2  ILE  38          HG23      ILE  38  64.975  -2.617  -1.977
  355   2HG2  ILE  38          HG22      ILE  38  65.453  -4.020  -2.932
  356   3HG2  ILE  38          HG21      ILE  38  66.368  -3.583  -1.489
  357   1HD1  ILE  38          HD13      ILE  38  64.590  -1.087  -2.850
  358   2HD1  ILE  38          HD12      ILE  38  64.981   0.129  -4.065
  359   3HD1  ILE  38          HD11      ILE  38  63.860  -1.176  -4.453
  360    H    THR  39           HN       THR  39  69.582  -1.813  -1.643
  361    HA   THR  39           HA       THR  39  68.946  -3.001   0.911
  362    HB   THR  39           HB       THR  39  71.680  -1.901   0.505
  363    HG1  THR  39           HG1      THR  39  72.141  -3.333  -1.131
  364   1HG2  THR  39          HG23      THR  39  70.551  -4.632   1.184
  365   2HG2  THR  39          HG22      THR  39  72.266  -4.219   1.188
  366   3HG2  THR  39          HG21      THR  39  71.169  -3.446   2.333
  367    H    HIS  40           HN       HIS  40  70.258   0.129  -0.122
  368    HA   HIS  40           HA       HIS  40  70.374   1.291   2.530
  369   1HB   HIS  40           HB2      HIS  40  71.358   2.064   0.132
  370   2HB   HIS  40           HB1      HIS  40  69.903   3.059   0.182
  371    HD1  HIS  40           HD1      HIS  40  72.933   2.261   2.347
  372    HD2  HIS  40           HD2      HIS  40  70.145   5.310   1.791
  373    HE1  HIS  40           HE1      HIS  40  73.680   4.189   3.809
  374    H    ILE  41           HN       ILE  41  67.811   0.693   0.279
  375    HA   ILE  41           HA       ILE  41  65.987   2.700   1.271
  376    HB   ILE  41           HB       ILE  41  66.008   0.543  -0.689
  377   1HG1  ILE  41          HG12      ILE  41  63.854   2.259  -1.226
  378   2HG1  ILE  41          HG11      ILE  41  65.021   3.268  -0.373
  379   1HG2  ILE  41          HG23      ILE  41  64.393  -0.559   0.801
  380   2HG2  ILE  41          HG22      ILE  41  63.405   0.902   0.808
  381   3HG2  ILE  41          HG21      ILE  41  63.622  -0.009  -0.686
  382   1HD1  ILE  41          HD11      ILE  41  65.877   1.469  -2.640
  383   2HD1  ILE  41          HD13      ILE  41  65.244   3.085  -2.943
  384   3HD1  ILE  41          HD12      ILE  41  66.708   2.879  -1.985
  385    H    ALA  42           HN       ALA  42  66.629  -0.718   1.949
  386    HA   ALA  42           HA       ALA  42  64.593  -1.110   3.900
  387   1HB   ALA  42           HB1      ALA  42  66.162  -2.840   2.721
  388   2HB   ALA  42           HB3      ALA  42  67.263  -2.490   4.053
  389   3HB   ALA  42           HB2      ALA  42  65.661  -3.148   4.384
  390    H    ASN  43           HN       ASN  43  68.043  -0.322   4.316
  391    HA   ASN  43           HA       ASN  43  67.863   0.108   7.143
  392   1HB   ASN  43           HB2      ASN  43  69.773   1.395   5.163
  393   2HB   ASN  43           HB1      ASN  43  70.007   1.273   6.907
  394   1HD2  ASN  43          HD22      ASN  43  71.601  -1.622   4.892
  395   2HD2  ASN  43          HD21      ASN  43  71.511   0.026   4.496
  396    H    GLN  44           HN       GLN  44  66.824   1.930   4.387
  397    HA   GLN  44           HA       GLN  44  66.820   4.532   5.630
  398   1HB   GLN  44           HB2      GLN  44  65.994   3.343   3.085
  399   2HB   GLN  44           HB1      GLN  44  64.984   4.684   3.598
  400   1HG   GLN  44           HG2      GLN  44  68.006   4.734   3.330
  401   2HG   GLN  44           HG1      GLN  44  66.867   5.449   2.190
  402   1HE2  GLN  44          HE22      GLN  44  67.958   7.566   5.418
  403   2HE2  GLN  44          HE21      GLN  44  68.746   6.143   4.933
  404    H    LEU  45           HN       LEU  45  64.502   1.862   5.475
  405    HA   LEU  45           HA       LEU  45  62.823   3.417   7.373
  406   1HB   LEU  45           HB2      LEU  45  60.785   2.941   6.284
  407   2HB   LEU  45           HB1      LEU  45  61.876   3.431   4.999
  408    HG   LEU  45           HG       LEU  45  61.448   0.529   5.699
  409   1HD1  LEU  45          HD12      LEU  45  59.394   2.123   4.899
  410   2HD1  LEU  45          HD11      LEU  45  60.087   1.683   3.340
  411   3HD1  LEU  45          HD13      LEU  45  59.545   0.429   4.446
  412   1HD2  LEU  45          HD21      LEU  45  62.782   2.137   3.576
  413   2HD2  LEU  45          HD23      LEU  45  63.274   0.614   4.315
  414   3HD2  LEU  45          HD22      LEU  45  62.008   0.629   3.088
  415    H    GLY  46           HN       GLY  46  64.772   1.181   7.649
  416   1HA   GLY  46           HA2      GLY  46  64.986  -0.902   8.717
  417   2HA   GLY  46           HA1      GLY  46  63.854  -0.163   9.835
  418    H    LEU  47           HN       LEU  47  62.974  -1.097   6.513
  419    HA   LEU  47           HA       LEU  47  61.058  -3.032   7.732
  420   1HB   LEU  47           HB2      LEU  47  59.571  -2.648   6.020
  421   2HB   LEU  47           HB1      LEU  47  60.421  -1.116   5.960
  422    HG   LEU  47           HG       LEU  47  60.865  -3.519   4.182
  423   1HD1  LEU  47          HD12      LEU  47  58.973  -1.604   3.938
  424   2HD1  LEU  47          HD11      LEU  47  60.305  -0.824   3.088
  425   3HD1  LEU  47          HD13      LEU  47  59.722  -2.400   2.554
  426   1HD2  LEU  47          HD22      LEU  47  62.539  -1.146   4.713
  427   2HD2  LEU  47          HD21      LEU  47  63.013  -2.753   4.187
  428   3HD2  LEU  47          HD23      LEU  47  62.353  -1.602   3.030
  429    H    GLU  48           HN       GLU  48  60.551  -4.901   6.026
  430    HA   GLU  48           HA       GLU  48  63.111  -6.330   5.641
  431   1HB   GLU  48           HB2      GLU  48  60.865  -7.274   6.686
  432   2HB   GLU  48           HB1      GLU  48  60.428  -7.513   4.994
  433   1HG   GLU  48           HG2      GLU  48  61.990  -9.158   4.680
  434   2HG   GLU  48           HG1      GLU  48  63.152  -8.406   5.773
  435    H    LYS  49           HN       LYS  49  63.794  -7.000   3.576
  436    HA   LYS  49           HA       LYS  49  63.246  -5.356   1.350
  437   1HB   LYS  49           HB2      LYS  49  64.279  -8.203   1.394
  438   2HB   LYS  49           HB1      LYS  49  64.341  -7.134  -0.007
  439   1HG   LYS  49           HG2      LYS  49  65.957  -5.767   0.930
  440   2HG   LYS  49           HG1      LYS  49  65.460  -6.137   2.582
  441   1HD   LYS  49           HD2      LYS  49  67.566  -7.240   2.235
  442   2HD   LYS  49           HD1      LYS  49  66.325  -8.492   2.200
  443   1HE   LYS  49           HE2      LYS  49  66.325  -8.478  -0.243
  444   2HE   LYS  49           HE1      LYS  49  67.488  -7.153  -0.259
  445   1HZ   LYS  49           HZ3      LYS  49  68.115  -9.645   1.173
  446   2HZ   LYS  49           HZ2      LYS  49  68.318  -9.565  -0.511
  447   3HZ   LYS  49           HZ1      LYS  49  69.172  -8.501   0.502
  448    H    ASP  50           HN       ASP  50  61.451  -8.089   2.546
  449    HA   ASP  50           HA       ASP  50  60.105  -8.744   0.078
  450   1HB   ASP  50           HB2      ASP  50  60.325 -10.082   2.346
  451   2HB   ASP  50           HB1      ASP  50  58.842  -9.220   2.757
  452    H    VAL  51           HN       VAL  51  59.297  -6.563   2.810
  453    HA   VAL  51           HA       VAL  51  56.703  -5.917   1.597
  454    HB   VAL  51           HB       VAL  51  57.019  -5.868   4.061
  455   1HG1  VAL  51          HG11      VAL  51  59.284  -4.212   3.310
  456   2HG1  VAL  51          HG13      VAL  51  58.264  -3.380   4.481
  457   3HG1  VAL  51          HG12      VAL  51  58.927  -4.968   4.861
  458   1HG2  VAL  51          HG21      VAL  51  56.331  -3.246   2.703
  459   2HG2  VAL  51          HG23      VAL  51  55.218  -4.534   3.167
  460   3HG2  VAL  51          HG22      VAL  51  56.016  -3.568   4.408
  461    H    VAL  52           HN       VAL  52  59.970  -4.751   1.392
  462    HA   VAL  52           HA       VAL  52  59.215  -2.147   0.331
  463    HB   VAL  52           HB       VAL  52  61.446  -3.008   1.567
  464   1HG1  VAL  52          HG11      VAL  52  61.905  -4.360  -0.679
  465   2HG1  VAL  52          HG13      VAL  52  62.569  -2.806  -1.187
  466   3HG1  VAL  52          HG12      VAL  52  63.216  -3.619   0.238
  467   1HG2  VAL  52          HG21      VAL  52  60.563  -0.678   0.591
  468   2HG2  VAL  52          HG23      VAL  52  62.194  -0.875   1.223
  469   3HG2  VAL  52          HG22      VAL  52  61.910  -0.937  -0.515
  470    NH1  ARG  53           NH1      ARG  53  58.438 -10.384  -4.660
  471    NH2  ARG  53           NH2      ARG  53  57.593  -9.607  -6.608
  472    H    ARG  53           HN       ARG  53  59.840  -5.343  -0.949
  473    HA   ARG  53           HA       ARG  53  60.171  -4.434  -3.707
  474   1HB   ARG  53           HB2      ARG  53  60.986  -6.667  -2.603
  475   2HB   ARG  53           HB1      ARG  53  59.348  -7.226  -2.951
  476   1HG   ARG  53           HG2      ARG  53  60.834  -5.830  -5.136
  477   2HG   ARG  53           HG1      ARG  53  61.311  -7.482  -4.745
  478   1HD   ARG  53           HD2      ARG  53  58.404  -7.179  -4.885
  479   2HD   ARG  53           HD1      ARG  53  59.197  -6.746  -6.398
  480    HE   ARG  53           HE       ARG  53  60.394  -9.060  -6.057
  481   1HH1  ARG  53          HH11      ARG  53  59.143 -10.359  -3.952
  482   2HH1  ARG  53          HH12      ARG  53  57.675 -11.026  -4.585
  483   1HH2  ARG  53          HH21      ARG  53  57.651  -8.989  -7.392
  484   2HH2  ARG  53          HH22      ARG  53  56.830 -10.250  -6.533
  485    H    VAL  54           HN       VAL  54  57.555  -5.984  -1.817
  486    HA   VAL  54           HA       VAL  54  55.632  -5.935  -3.973
  487    HB   VAL  54           HB       VAL  54  55.103  -5.889  -0.981
  488   1HG1  VAL  54          HG12      VAL  54  53.289  -5.530  -2.940
  489   2HG1  VAL  54          HG11      VAL  54  53.350  -7.293  -2.937
  490   3HG1  VAL  54          HG13      VAL  54  52.922  -6.424  -1.464
  491   1HG2  VAL  54          HG23      VAL  54  56.612  -7.767  -2.182
  492   2HG2  VAL  54          HG22      VAL  54  55.479  -8.161  -0.892
  493   3HG2  VAL  54          HG21      VAL  54  55.018  -8.409  -2.576
  494    CH2  TRP  55           CH2      TRP  55  57.914   3.618  -2.445
  495    H    TRP  55           HN       TRP  55  56.645  -3.607  -1.545
  496    HA   TRP  55           HA       TRP  55  54.452  -1.763  -2.028
  497   1HB   TRP  55           HB2      TRP  55  55.617  -1.640   0.100
  498   2HB   TRP  55           HB1      TRP  55  57.170  -1.433  -0.706
  499    HD1  TRP  55           HD1      TRP  55  54.078   0.487   0.392
  500    HE1  TRP  55           HE1      TRP  55  54.444   2.970  -0.081
  501    HE3  TRP  55           HE3      TRP  55  58.387   0.258  -2.349
  502    HZ2  TRP  55           HZ2      TRP  55  56.285   4.662  -1.506
  503    HZ3  TRP  55           HZ3      TRP  55  59.417   2.313  -3.256
  504    HH2  TRP  55           HH2      TRP  55  58.367   4.512  -2.842
  505    H    PHE  56           HN       PHE  56  57.702  -2.227  -3.393
  506    HA   PHE  56           HA       PHE  56  57.390   0.196  -5.023
  507   1HB   PHE  56           HB2      PHE  56  59.656  -0.815  -4.175
  508   2HB   PHE  56           HB1      PHE  56  59.502  -1.869  -5.582
  509    HD1  PHE  56           HD2      PHE  56  58.638   1.739  -5.003
  510    HD2  PHE  56           HD1      PHE  56  60.883  -1.084  -7.320
  511    HE1  PHE  56           HE2      PHE  56  59.410   3.571  -6.459
  512    HE2  PHE  56           HE1      PHE  56  61.658   0.758  -8.792
  513    HZ   PHE  56           HZ       PHE  56  60.911   3.088  -8.356
  514    H    CYS  57           HN       CYS  57  56.283  -3.009  -5.216
  515    HA   CYS  57           HA       CYS  57  56.419  -3.397  -8.072
  516   1HB   CYS  57           HB2      CYS  57  55.684  -5.002  -6.007
  517   2HB   CYS  57           HB1      CYS  57  54.092  -4.489  -6.563
  518    HG   CYS  57           HG       CYS  57  55.027  -6.661  -7.889
  519    H    ASN  58           HN       ASN  58  54.029  -2.017  -5.840
  520    HA   ASN  58           HA       ASN  58  52.182  -1.270  -7.953
  521   1HB   ASN  58           HB2      ASN  58  51.081   0.113  -6.223
  522   2HB   ASN  58           HB1      ASN  58  51.391  -1.516  -5.633
  523   1HD2  ASN  58          HD22      ASN  58  53.353  -0.387  -2.949
  524   2HD2  ASN  58          HD21      ASN  58  52.508  -1.665  -3.677
  525    NH1  ARG  59           NH1      ARG  59  56.333   5.751  -9.952
  526    NH2  ARG  59           NH2      ARG  59  54.808   7.188  -9.105
  527    H    ARG  59           HN       ARG  59  54.807   0.381  -6.183
  528    HA   ARG  59           HA       ARG  59  54.452   2.969  -7.389
  529   1HB   ARG  59           HB2      ARG  59  56.256   1.875  -5.563
  530   2HB   ARG  59           HB1      ARG  59  57.272   2.256  -6.955
  531   1HG   ARG  59           HG2      ARG  59  55.334   4.231  -5.741
  532   2HG   ARG  59           HG1      ARG  59  57.037   4.133  -5.293
  533   1HD   ARG  59           HD2      ARG  59  57.366   5.593  -6.997
  534   2HD   ARG  59           HD1      ARG  59  57.183   4.182  -8.039
  535    HE   ARG  59           HE       ARG  59  54.597   5.257  -7.454
  536   1HH1  ARG  59          HH11      ARG  59  56.892   4.927  -9.861
  537   2HH1  ARG  59          HH12      ARG  59  56.385   6.300 -10.786
  538   1HH2  ARG  59          HH21      ARG  59  54.198   7.465  -8.363
  539   2HH2  ARG  59          HH22      ARG  59  54.862   7.735  -9.940
  540    NH1  ARG  60           NH2      ARG  60  58.086  -3.587 -13.144
  541    NH2  ARG  60           NH1      ARG  60  58.725  -4.887 -11.406
  542    H    ARG  60           HN       ARG  60  55.659  -0.021  -8.669
  543    HA   ARG  60           HA       ARG  60  57.151   1.216 -10.864
  544   1HB   ARG  60           HB2      ARG  60  56.554  -1.550  -9.918
  545   2HB   ARG  60           HB1      ARG  60  56.934  -1.346 -11.628
  546   1HG   ARG  60           HG2      ARG  60  59.045  -0.271 -11.083
  547   2HG   ARG  60           HG1      ARG  60  58.651  -0.293  -9.363
  548   1HD   ARG  60           HD2      ARG  60  60.031  -2.180  -9.592
  549   2HD   ARG  60           HD1      ARG  60  58.411  -2.871  -9.696
  550    HE   ARG  60           HE       ARG  60  60.161  -2.345 -12.064
  551   1HH1  ARG  60          HH21      ARG  60  58.107  -2.708 -13.621
  552   2HH1  ARG  60          HH22      ARG  60  57.559  -4.348 -13.521
  553   1HH2  ARG  60          HH11      ARG  60  59.235  -5.003 -10.554
  554   2HH2  ARG  60          HH12      ARG  60  58.198  -5.650 -11.782
  555    H    GLN  61           HN       GLN  61  53.995  -0.324 -10.371
  556    HA   GLN  61           HA       GLN  61  53.290   0.437 -13.181
  557   1HB   GLN  61           HB2      GLN  61  51.532  -1.350 -12.993
  558   2HB   GLN  61           HB1      GLN  61  53.180  -1.970 -12.886
  559   1HG   GLN  61           HG2      GLN  61  52.992  -2.483 -10.647
  560   2HG   GLN  61           HG1      GLN  61  51.849  -1.177 -10.336
  561   1HE2  GLN  61          HE22      GLN  61  50.231  -4.480 -12.182
  562   2HE2  GLN  61          HE21      GLN  61  51.722  -3.877 -12.725
  563    H    LYS  62           HN       LYS  62  53.053   2.550 -11.646
  564    HA   LYS  62           HA       LYS  62  50.460   2.662 -10.275
  565   1HB   LYS  62           HB2      LYS  62  52.395   4.882 -11.017
  566   2HB   LYS  62           HB1      LYS  62  50.989   5.061  -9.968
  567   1HG   LYS  62           HG2      LYS  62  53.214   3.092  -9.401
  568   2HG   LYS  62           HG1      LYS  62  53.209   4.737  -8.771
  569   1HD   LYS  62           HD2      LYS  62  50.834   2.923  -8.368
  570   2HD   LYS  62           HD1      LYS  62  52.210   2.874  -7.270
  571   1HE   LYS  62           HE2      LYS  62  51.670   4.861  -6.315
  572   2HE   LYS  62           HE1      LYS  62  51.253   5.598  -7.861
  573   1HZ   LYS  62           HZ2      LYS  62  49.220   4.051  -7.736
  574   2HZ   LYS  62           HZ1      LYS  62  49.575   3.962  -6.077
  575   3HZ   LYS  62           HZ3      LYS  62  49.230   5.462  -6.789
  576    H    GLY  63           HN       GLY  63  51.823   3.516 -13.396
  577   1HA   GLY  63           HA2      GLY  63  49.395   3.449 -14.801
  578   2HA   GLY  63           HA1      GLY  63  49.628   5.129 -14.316
  579    H    LYS  64           HN       LYS  64  52.108   2.753 -15.235
  580    HA   LYS  64           HA       LYS  64  53.164   4.688 -17.205
  581   1HB   LYS  64           HB2      LYS  64  54.227   2.009 -16.259
  582   2HB   LYS  64           HB1      LYS  64  55.070   3.101 -17.358
  583   1HG   LYS  64           HG2      LYS  64  54.724   4.877 -15.479
  584   2HG   LYS  64           HG1      LYS  64  54.447   3.480 -14.438
  585   1HD   LYS  64           HD2      LYS  64  56.760   3.809 -14.234
  586   2HD   LYS  64           HD1      LYS  64  56.661   2.570 -15.485
  587   1HE   LYS  64           HE2      LYS  64  58.117   4.097 -16.476
  588   2HE   LYS  64           HE1      LYS  64  56.564   4.637 -17.115
  589   1HZ   LYS  64           HZ2      LYS  64  57.832   5.734 -14.666
  590   2HZ   LYS  64           HZ1      LYS  64  57.951   6.448 -16.203
  591   3HZ   LYS  64           HZ3      LYS  64  56.439   6.318 -15.445
  592    NH1  ARG  65           NH1      ARG  65  51.341  -4.965 -18.527
  593    NH2  ARG  65           NH2      ARG  65  53.301  -4.839 -17.409
  594    H    ARG  65           HN       ARG  65  51.488   1.615 -17.089
  595    HA   ARG  65           HA       ARG  65  51.308   1.696 -20.061
  596   1HB   ARG  65           HB2      ARG  65  51.440  -0.822 -20.056
  597   2HB   ARG  65           HB1      ARG  65  52.945  -0.030 -19.595
  598   1HG   ARG  65           HG2      ARG  65  52.048  -0.274 -17.155
  599   2HG   ARG  65           HG1      ARG  65  50.970  -1.484 -17.847
  600   1HD   ARG  65           HD2      ARG  65  53.950  -1.543 -18.330
  601   2HD   ARG  65           HD1      ARG  65  53.216  -2.329 -16.932
  602    HE   ARG  65           HE       ARG  65  52.624  -3.065 -19.769
  603   1HH1  ARG  65          HH11      ARG  65  50.682  -4.570 -19.167
  604   2HH1  ARG  65          HH12      ARG  65  51.157  -5.853 -18.105
  605   1HH2  ARG  65          HH21      ARG  65  54.144  -4.347 -17.193
  606   2HH2  ARG  65          HH22      ARG  65  53.117  -5.727 -16.987
  607    H    SER  66           HN       SER  66  49.221   2.734 -19.389
  608    HA   SER  66           HA       SER  66  47.230   0.881 -18.218
  609   1HB   SER  66           HB2      SER  66  45.792   2.799 -18.036
  610   2HB   SER  66           HB1      SER  66  47.394   3.313 -17.515
  611    HG   SER  66           HG       SER  66  47.709   4.240 -19.533
  612    H    SER  67           HN       SER  67  45.701  -0.127 -19.433
  613    HA   SER  67           HA       SER  67  45.341   0.736 -22.270
  614   1HB   SER  67           HB2      SER  67  46.831  -1.290 -22.087
  615   2HB   SER  67           HB1      SER  67  45.487  -2.146 -21.339
  616    HG   SER  67           HG       SER  67  45.953  -1.942 -23.871
   
  Start of MODEL           2
 Raw file had  616 H/Q atoms
  Start of MODEL    2
    1   1H    MET   1           HT2      MET   1  59.127  22.017  14.390
    2   2H    MET   1           HT1      MET   1  59.824  21.525  15.859
    3   3H    MET   1           HT3      MET   1  59.714  23.175  15.485
    4    HA   MET   1           HA       MET   1  61.367  23.072  13.871
    5   1HB   MET   1           HB2      MET   1  61.915  21.434  16.326
    6   2HB   MET   1           HB1      MET   1  63.158  21.555  15.080
    7   1HG   MET   1           HG2      MET   1  63.684  23.398  16.399
    8   2HG   MET   1           HG1      MET   1  62.605  24.135  15.214
    9   1HE   MET   1           HE2      MET   1  63.608  24.600  18.349
   10   2HE   MET   1           HE1      MET   1  62.328  24.443  19.550
   11   3HE   MET   1           HE3      MET   1  63.125  23.001  18.907
   12    H    GLU   2           HN       GLU   2  60.704  19.714  14.943
   13    HA   GLU   2           HA       GLU   2  61.408  18.820  12.176
   14   1HB   GLU   2           HB2      GLU   2  61.449  17.262  14.780
   15   2HB   GLU   2           HB1      GLU   2  61.867  16.610  13.195
   16   1HG   GLU   2           HG2      GLU   2  63.460  18.827  13.268
   17   2HG   GLU   2           HG1      GLU   2  63.426  18.389  14.976
   18    H    THR   3           HN       THR   3  58.793  19.860  13.020
   19    HA   THR   3           HA       THR   3  57.100  17.413  13.025
   20    HB   THR   3           HB       THR   3  56.062  20.237  13.165
   21    HG1  THR   3           HG1      THR   3  56.956  18.684  15.358
   22   1HG2  THR   3          HG23      THR   3  54.569  18.193  12.927
   23   2HG2  THR   3          HG22      THR   3  55.123  17.707  14.529
   24   3HG2  THR   3          HG21      THR   3  54.233  19.216  14.325
   25    H    LEU   4           HN       LEU   4  58.591  18.182  10.640
   26    HA   LEU   4           HA       LEU   4  56.286  18.457   8.787
   27   1HB   LEU   4           HB2      LEU   4  57.615  20.069   7.392
   28   2HB   LEU   4           HB1      LEU   4  57.132  20.728   8.955
   29    HG   LEU   4           HG       LEU   4  59.768  19.322   8.756
   30   1HD1  LEU   4          HD13      LEU   4  59.391  21.079   6.837
   31   2HD1  LEU   4          HD12      LEU   4  59.581  22.256   8.137
   32   3HD1  LEU   4          HD11      LEU   4  60.884  21.124   7.775
   33   1HD2  LEU   4          HD22      LEU   4  58.400  21.350  10.462
   34   2HD2  LEU   4          HD21      LEU   4  59.457  20.018  10.930
   35   3HD2  LEU   4          HD23      LEU   4  60.148  21.506  10.281
   36    H    VAL   5           HN       VAL   5  57.869  16.159   9.517
   37    HA   VAL   5           HA       VAL   5  59.798  15.727   7.348
   38    HB   VAL   5           HB       VAL   5  60.206  14.729   9.560
   39   1HG1  VAL   5          HG11      VAL   5  57.497  13.540   9.064
   40   2HG1  VAL   5          HG13      VAL   5  58.666  12.638  10.024
   41   3HG1  VAL   5          HG12      VAL   5  58.156  14.245  10.538
   42   1HG2  VAL   5          HG21      VAL   5  60.931  13.583   7.396
   43   2HG2  VAL   5          HG23      VAL   5  60.840  12.544   8.818
   44   3HG2  VAL   5          HG22      VAL   5  59.553  12.505   7.613
   45    H    GLN   6           HN       GLN   6  56.423  15.050   7.983
   46    HA   GLN   6           HA       GLN   6  56.295  13.417   5.483
   47   1HB   GLN   6           HB2      GLN   6  54.584  13.534   7.961
   48   2HB   GLN   6           HB1      GLN   6  53.925  12.906   6.450
   49   1HG   GLN   6           HG2      GLN   6  55.691  11.231   6.324
   50   2HG   GLN   6           HG1      GLN   6  56.471  11.904   7.756
   51   1HE2  GLN   6          HE22      GLN   6  53.758   9.090   8.333
   52   2HE2  GLN   6          HE21      GLN   6  54.646   9.322   6.906
   53    H    ALA   7           HN       ALA   7  56.410  15.465   4.249
   54    HA   ALA   7           HA       ALA   7  54.477  17.546   4.508
   55   1HB   ALA   7           HB1      ALA   7  56.712  17.389   3.106
   56   2HB   ALA   7           HB3      ALA   7  55.627  16.828   1.835
   57   3HB   ALA   7           HB2      ALA   7  55.390  18.419   2.556
   58    NH1  ARG   8           NH2      ARG   8  48.414  13.255   3.363
   59    NH2  ARG   8           NH1      ARG   8  47.007  14.024   4.957
   60    H    ARG   8           HN       ARG   8  53.274  17.839   2.038
   61    HA   ARG   8           HA       ARG   8  51.416  15.526   1.964
   62   1HB   ARG   8           HB2      ARG   8  51.000  18.481   1.732
   63   2HB   ARG   8           HB1      ARG   8  49.897  17.402   0.877
   64   1HG   ARG   8           HG2      ARG   8  50.543  16.956   3.788
   65   2HG   ARG   8           HG1      ARG   8  49.285  18.093   3.304
   66   1HD   ARG   8           HD2      ARG   8  47.927  16.429   2.417
   67   2HD   ARG   8           HD1      ARG   8  49.282  15.342   2.114
   68    HE   ARG   8           HE       ARG   8  48.896  15.803   4.950
   69   1HH1  ARG   8          HH21      ARG   8  49.183  13.406   2.741
   70   2HH1  ARG   8          HH22      ARG   8  47.955  12.368   3.386
   71   1HH2  ARG   8          HH11      ARG   8  46.698  14.763   5.556
   72   2HH2  ARG   8          HH12      ARG   8  46.547  13.137   4.980
   73    H    LYS   9           HN       LYS   9  52.939  18.035  -0.058
   74    HA   LYS   9           HA       LYS   9  53.221  16.114  -2.240
   75   1HB   LYS   9           HB2      LYS   9  50.885  17.227  -2.391
   76   2HB   LYS   9           HB1      LYS   9  51.769  18.680  -2.859
   77   1HG   LYS   9           HG2      LYS   9  52.855  17.406  -4.695
   78   2HG   LYS   9           HG1      LYS   9  51.905  15.988  -4.249
   79   1HD   LYS   9           HD2      LYS   9  49.902  16.932  -4.975
   80   2HD   LYS   9           HD1      LYS   9  50.496  18.582  -4.793
   81   1HE   LYS   9           HE2      LYS   9  51.173  18.628  -6.940
   82   2HE   LYS   9           HE1      LYS   9  52.125  17.160  -6.718
   83   1HZ   LYS   9           HZ3      LYS   9  49.197  17.221  -7.208
   84   2HZ   LYS   9           HZ2      LYS   9  50.372  16.915  -8.396
   85   3HZ   LYS   9           HZ1      LYS   9  50.171  15.838  -7.098
   86    NH1  ARG  10           NH2      ARG  10  59.760  23.371   2.016
   87    NH2  ARG  10           NH1      ARG  10  58.292  22.833   3.647
   88    H    ARG  10           HN       ARG  10  54.905  17.887  -0.473
   89    HA   ARG  10           HA       ARG  10  56.007  19.878  -2.307
   90   1HB   ARG  10           HB2      ARG  10  55.869  20.075   0.265
   91   2HB   ARG  10           HB1      ARG  10  57.260  18.991   0.288
   92   1HG   ARG  10           HG2      ARG  10  58.250  20.683  -1.466
   93   2HG   ARG  10           HG1      ARG  10  57.065  21.792  -0.775
   94   1HD   ARG  10           HD2      ARG  10  58.744  20.217   1.125
   95   2HD   ARG  10           HD1      ARG  10  59.520  21.545   0.260
   96    HE   ARG  10           HE       ARG  10  56.970  22.281   1.489
   97   1HH1  ARG  10          HH21      ARG  10  60.044  23.328   1.058
   98   2HH1  ARG  10          HH22      ARG  10  60.316  23.869   2.680
   99   1HH2  ARG  10          HH11      ARG  10  57.450  22.379   3.939
  100   2HH2  ARG  10          HH12      ARG  10  58.848  23.331   4.312
  101    H    LYS  11           HN       LYS  11  56.819  16.674  -1.090
  102    HA   LYS  11           HA       LYS  11  58.631  16.234  -3.320
  103   1HB   LYS  11           HB2      LYS  11  59.799  17.387  -1.135
  104   2HB   LYS  11           HB1      LYS  11  59.991  15.676  -0.752
  105   1HG   LYS  11           HG2      LYS  11  61.895  16.003  -2.025
  106   2HG   LYS  11           HG1      LYS  11  60.759  15.558  -3.300
  107   1HD   LYS  11           HD2      LYS  11  60.466  17.790  -3.990
  108   2HD   LYS  11           HD1      LYS  11  61.098  18.436  -2.475
  109   1HE   LYS  11           HE2      LYS  11  63.343  17.686  -3.032
  110   2HE   LYS  11           HE1      LYS  11  62.750  16.872  -4.479
  111   1HZ   LYS  11           HZ2      LYS  11  61.851  19.220  -5.048
  112   2HZ   LYS  11           HZ1      LYS  11  63.037  19.749  -3.952
  113   3HZ   LYS  11           HZ3      LYS  11  63.488  18.857  -5.323
  114    NH1  ARG  12           NH2      ARG  12  62.874  10.558  -6.007
  115    NH2  ARG  12           NH1      ARG  12  63.255   8.640  -4.874
  116    H    ARG  12           HN       ARG  12  59.944  13.966  -2.330
  117    HA   ARG  12           HA       ARG  12  57.629  12.136  -1.951
  118   1HB   ARG  12           HB2      ARG  12  59.262  10.355  -2.601
  119   2HB   ARG  12           HB1      ARG  12  59.069  11.595  -3.840
  120   1HG   ARG  12           HG2      ARG  12  61.211  12.328  -3.617
  121   2HG   ARG  12           HG1      ARG  12  61.177  12.188  -1.859
  122   1HD   ARG  12           HD2      ARG  12  62.051  10.087  -1.886
  123   2HD   ARG  12           HD1      ARG  12  61.102   9.605  -3.292
  124    HE   ARG  12           HE       ARG  12  63.638  11.182  -3.471
  125   1HH1  ARG  12          HH21      ARG  12  62.691  11.542  -6.008
  126   2HH1  ARG  12          HH22      ARG  12  62.948  10.062  -6.872
  127   1HH2  ARG  12          HH11      ARG  12  63.364   8.153  -4.008
  128   2HH2  ARG  12          HH12      ARG  12  63.329   8.145  -5.740
  129    H    THR  13           HN       THR  13  58.495  13.654   0.299
  130    HA   THR  13           HA       THR  13  60.221  11.967   1.954
  131    HB   THR  13           HB       THR  13  58.499  14.010   3.251
  132    HG1  THR  13           HG1      THR  13  59.113  15.609   2.048
  133   1HG2  THR  13          HG21      THR  13  61.471  13.418   3.211
  134   2HG2  THR  13          HG23      THR  13  60.705  14.639   4.226
  135   3HG2  THR  13          HG22      THR  13  60.325  12.933   4.460
  136    H    SER  14           HN       SER  14  56.777  12.457   1.467
  137    HA   SER  14           HA       SER  14  56.135  10.626   3.716
  138   1HB   SER  14           HB2      SER  14  53.838  11.305   3.393
  139   2HB   SER  14           HB1      SER  14  54.831  12.759   3.361
  140    HG   SER  14           HG       SER  14  53.152  12.202   1.587
  141    H    ILE  15           HN       ILE  15  53.853   9.389   2.728
  142    HA   ILE  15           HA       ILE  15  55.048   7.465   0.838
  143    HB   ILE  15           HB       ILE  15  52.451   7.429   2.392
  144   1HG1  ILE  15          HG12      ILE  15  54.539   7.148   3.712
  145   2HG1  ILE  15          HG11      ILE  15  53.572   5.675   3.693
  146   1HG2  ILE  15          HG21      ILE  15  53.608   5.513   0.366
  147   2HG2  ILE  15          HG23      ILE  15  52.554   4.929   1.654
  148   3HG2  ILE  15          HG22      ILE  15  51.955   6.114   0.493
  149   1HD1  ILE  15          HD12      ILE  15  55.317   5.577   1.429
  150   2HD1  ILE  15          HD11      ILE  15  56.289   6.021   2.833
  151   3HD1  ILE  15          HD13      ILE  15  55.326   4.545   2.857
  152    H    GLU  16           HN       GLU  16  55.044   8.744  -1.066
  153    HA   GLU  16           HA       GLU  16  52.519   9.768  -2.116
  154   1HB   GLU  16           HB2      GLU  16  55.064  10.536  -2.562
  155   2HB   GLU  16           HB1      GLU  16  54.887   9.385  -3.887
  156   1HG   GLU  16           HG2      GLU  16  52.769  10.569  -4.545
  157   2HG   GLU  16           HG1      GLU  16  53.133  11.790  -3.325
  158    H    ASN  17           HN       ASN  17  51.565   8.851  -4.094
  159    HA   ASN  17           HA       ASN  17  51.357   6.008  -4.018
  160   1HB   ASN  17           HB2      ASN  17  50.317   8.183  -5.707
  161   2HB   ASN  17           HB1      ASN  17  50.554   6.672  -6.585
  162   1HD2  ASN  17          HD22      ASN  17  47.615   5.300  -5.241
  163   2HD2  ASN  17          HD21      ASN  17  48.711   5.389  -6.534
  164    NH1  ARG  18           NH1      ARG  18  53.259   6.024 -10.733
  165    NH2  ARG  18           NH2      ARG  18  51.826   7.738 -11.064
  166    H    ARG  18           HN       ARG  18  53.668   8.100  -5.527
  167    HA   ARG  18           HA       ARG  18  54.614   6.048  -7.398
  168   1HB   ARG  18           HB2      ARG  18  54.926   8.880  -7.106
  169   2HB   ARG  18           HB1      ARG  18  56.531   8.159  -7.020
  170   1HG   ARG  18           HG2      ARG  18  56.489   8.050  -9.276
  171   2HG   ARG  18           HG1      ARG  18  55.279   6.779  -9.113
  172   1HD   ARG  18           HD2      ARG  18  53.611   8.807  -8.874
  173   2HD   ARG  18           HD1      ARG  18  54.894   9.700  -9.691
  174    HE   ARG  18           HE       ARG  18  54.506   8.394 -11.657
  175   1HH1  ARG  18          HH11      ARG  18  54.190   5.689 -10.587
  176   2HH1  ARG  18          HH12      ARG  18  52.496   5.379 -10.769
  177   1HH2  ARG  18          HH21      ARG  18  51.657   8.718 -11.172
  178   2HH2  ARG  18          HH22      ARG  18  51.062   7.093 -11.098
  179    H    VAL  19           HN       VAL  19  55.367   7.260  -4.176
  180    HA   VAL  19           HA       VAL  19  57.950   6.023  -3.978
  181    HB   VAL  19           HB       VAL  19  56.674   7.799  -2.383
  182   1HG1  VAL  19          HG13      VAL  19  56.309   5.128  -0.990
  183   2HG1  VAL  19          HG12      VAL  19  56.378   6.660  -0.145
  184   3HG1  VAL  19          HG11      VAL  19  55.085   6.359  -1.304
  185   1HG2  VAL  19          HG23      VAL  19  58.891   5.839  -1.820
  186   2HG2  VAL  19          HG22      VAL  19  59.015   7.542  -2.262
  187   3HG2  VAL  19          HG21      VAL  19  58.467   7.087  -0.648
  188    NH1  ARG  20           NH2      ARG  20  50.109   3.330   1.931
  189    NH2  ARG  20           NH1      ARG  20  49.178   2.099   0.280
  190    H    ARG  20           HN       ARG  20  54.695   4.942  -3.065
  191    HA   ARG  20           HA       ARG  20  55.506   2.422  -1.984
  192   1HB   ARG  20           HB2      ARG  20  52.925   3.146  -3.400
  193   2HB   ARG  20           HB1      ARG  20  53.170   1.706  -2.411
  194   1HG   ARG  20           HG2      ARG  20  53.663   3.130  -0.455
  195   2HG   ARG  20           HG1      ARG  20  53.413   4.571  -1.440
  196   1HD   ARG  20           HD2      ARG  20  51.237   4.468  -0.847
  197   2HD   ARG  20           HD1      ARG  20  51.108   3.035  -1.866
  198    HE   ARG  20           HE       ARG  20  52.079   2.045   0.527
  199   1HH1  ARG  20          HH21      ARG  20  50.906   3.783   2.330
  200   2HH1  ARG  20          HH22      ARG  20  49.227   3.368   2.400
  201   1HH2  ARG  20          HH11      ARG  20  49.262   1.608  -0.587
  202   2HH2  ARG  20          HH12      ARG  20  48.296   2.138   0.749
  203    CH2  TRP  21           CH2      TRP  21  51.292  -1.111  -4.557
  204    H    TRP  21           HN       TRP  21  54.800   3.437  -5.287
  205    HA   TRP  21           HA       TRP  21  55.335   0.725  -6.210
  206   1HB   TRP  21           HB2      TRP  21  54.620   3.162  -7.830
  207   2HB   TRP  21           HB1      TRP  21  54.686   1.497  -8.435
  208    HD1  TRP  21           HD1      TRP  21  52.030   3.585  -7.743
  209    HE1  TRP  21           HE1      TRP  21  50.083   2.517  -6.422
  210    HE3  TRP  21           HE3      TRP  21  54.336  -0.617  -5.936
  211    HZ2  TRP  21           HZ2      TRP  21  49.600   0.190  -4.770
  212    HZ3  TRP  21           HZ3      TRP  21  53.155  -2.178  -4.497
  213    HH2  TRP  21           HH2      TRP  21  50.771  -1.825  -3.936
  214    H    SER  22           HN       SER  22  57.238   3.255  -5.353
  215    HA   SER  22           HA       SER  22  59.414   2.751  -7.234
  216   1HB   SER  22           HB2      SER  22  59.348   4.930  -6.066
  217   2HB   SER  22           HB1      SER  22  59.342   4.110  -4.508
  218    HG   SER  22           HG       SER  22  61.400   3.280  -5.024
  219    H    LEU  23           HN       LEU  23  58.247   1.785  -4.036
  220    HA   LEU  23           HA       LEU  23  60.316   0.015  -3.190
  221   1HB   LEU  23           HB2      LEU  23  57.320  -0.394  -2.942
  222   2HB   LEU  23           HB1      LEU  23  58.531  -1.185  -1.970
  223    HG   LEU  23           HG       LEU  23  58.337   1.805  -1.962
  224   1HD1  LEU  23          HD13      LEU  23  56.075   0.516  -1.620
  225   2HD1  LEU  23          HD12      LEU  23  56.773   0.042  -0.072
  226   3HD1  LEU  23          HD11      LEU  23  56.526   1.747  -0.443
  227   1HD2  LEU  23          HD21      LEU  23  59.561  -0.379  -0.355
  228   2HD2  LEU  23          HD23      LEU  23  60.094   1.289  -0.564
  229   3HD2  LEU  23          HD22      LEU  23  58.817   0.909   0.590
  230    H    GLU  24           HN       GLU  24  57.355  -0.525  -5.053
  231    HA   GLU  24           HA       GLU  24  57.542  -3.241  -5.662
  232   1HB   GLU  24           HB2      GLU  24  56.120  -0.982  -6.676
  233   2HB   GLU  24           HB1      GLU  24  56.708  -1.895  -8.058
  234   1HG   GLU  24           HG2      GLU  24  55.817  -3.964  -6.679
  235   2HG   GLU  24           HG1      GLU  24  54.814  -2.742  -5.895
  236    H    THR  25           HN       THR  25  59.331  -0.601  -7.237
  237    HA   THR  25           HA       THR  25  60.392  -2.256  -9.355
  238    HB   THR  25           HB       THR  25  62.008   0.047  -8.388
  239    HG1  THR  25           HG1      THR  25  60.491   1.494  -8.683
  240   1HG2  THR  25          HG23      THR  25  61.966  -1.425 -10.656
  241   2HG2  THR  25          HG22      THR  25  60.865  -0.127 -11.121
  242   3HG2  THR  25          HG21      THR  25  62.510   0.252 -10.609
  243    H    MET  26           HN       MET  26  61.615  -1.202  -6.205
  244    HA   MET  26           HA       MET  26  64.161  -2.488  -6.368
  245   1HB   MET  26           HB2      MET  26  63.362  -0.774  -4.649
  246   2HB   MET  26           HB1      MET  26  62.592  -2.124  -3.814
  247   1HG   MET  26           HG2      MET  26  64.767  -1.851  -2.828
  248   2HG   MET  26           HG1      MET  26  64.842  -3.291  -3.842
  249   1HE   MET  26           HE1      MET  26  66.499  -0.875  -2.514
  250   2HE   MET  26           HE3      MET  26  67.861  -1.760  -3.216
  251   3HE   MET  26           HE2      MET  26  67.611  -0.061  -3.611
  252    H    PHE  27           HN       PHE  27  60.986  -3.794  -5.551
  253    HA   PHE  27           HA       PHE  27  62.172  -6.317  -4.581
  254   1HB   PHE  27           HB2      PHE  27  59.302  -5.354  -4.832
  255   2HB   PHE  27           HB1      PHE  27  59.727  -6.985  -4.325
  256    HD1  PHE  27           HD1      PHE  27  61.582  -7.114  -2.424
  257    HD2  PHE  27           HD2      PHE  27  59.077  -3.712  -3.192
  258    HE1  PHE  27           HE1      PHE  27  61.969  -6.308  -0.111
  259    HE2  PHE  27           HE2      PHE  27  59.463  -2.904  -0.879
  260    HZ   PHE  27           HZ       PHE  27  60.909  -4.203   0.662
  261    H    LEU  28           HN       LEU  28  60.822  -5.027  -7.513
  262    HA   LEU  28           HA       LEU  28  60.410  -7.710  -8.664
  263   1HB   LEU  28           HB2      LEU  28  59.944  -4.936  -9.778
  264   2HB   LEU  28           HB1      LEU  28  59.593  -6.431 -10.651
  265    HG   LEU  28           HG       LEU  28  58.448  -5.747  -7.928
  266   1HD1  LEU  28          HD12      LEU  28  57.659  -4.228  -9.764
  267   2HD1  LEU  28          HD11      LEU  28  57.078  -5.651 -10.629
  268   3HD1  LEU  28          HD13      LEU  28  56.376  -5.220  -9.070
  269   1HD2  LEU  28          HD23      LEU  28  58.313  -8.072  -9.780
  270   2HD2  LEU  28          HD22      LEU  28  58.199  -8.027  -8.021
  271   3HD2  LEU  28          HD21      LEU  28  56.800  -7.598  -9.006
  272    H    LYS  29           HN       LYS  29  63.116  -5.878  -8.215
  273    HA   LYS  29           HA       LYS  29  64.246  -6.474 -10.903
  274   1HB   LYS  29           HB2      LYS  29  66.146  -5.070 -10.210
  275   2HB   LYS  29           HB1      LYS  29  64.632  -4.194  -9.998
  276   1HG   LYS  29           HG2      LYS  29  64.633  -4.734  -7.596
  277   2HG   LYS  29           HG1      LYS  29  66.115  -5.668  -7.794
  278   1HD   LYS  29           HD2      LYS  29  66.661  -3.440  -6.944
  279   2HD   LYS  29           HD1      LYS  29  67.280  -3.621  -8.584
  280   1HE   LYS  29           HE2      LYS  29  64.567  -2.615  -8.662
  281   2HE   LYS  29           HE1      LYS  29  65.563  -1.594  -7.626
  282   1HZ   LYS  29           HZ1      LYS  29  66.632  -2.465 -10.217
  283   2HZ   LYS  29           HZ3      LYS  29  65.492  -1.209 -10.184
  284   3HZ   LYS  29           HZ2      LYS  29  66.954  -1.050  -9.334
  285    H    CYS  30           HN       CYS  30  64.564  -7.211  -7.490
  286    HA   CYS  30           HA       CYS  30  66.156  -9.597  -8.194
  287   1HB   CYS  30           HB2      CYS  30  66.984  -7.325  -6.463
  288   2HB   CYS  30           HB1      CYS  30  67.325  -8.938  -5.840
  289    HG   CYS  30           HG       CYS  30  68.244  -8.325  -8.743
  290    HA   PRO  31           HA       PRO  31  63.074 -11.059  -5.239
  291   1HB   PRO  31           HB2      PRO  31  63.629 -13.726  -5.483
  292   2HB   PRO  31           HB1      PRO  31  62.717 -12.825  -6.707
  293   1HG   PRO  31           HG2      PRO  31  65.506 -13.843  -6.825
  294   2HG   PRO  31           HG1      PRO  31  64.398 -13.455  -8.150
  295   1HD   PRO  31           HD2      PRO  31  66.548 -11.834  -7.175
  296   2HD   PRO  31           HD1      PRO  31  65.337 -11.385  -8.394
  297    H    LYS  32           HN       LYS  32  66.012 -10.383  -4.453
  298    HA   LYS  32           HA       LYS  32  66.230 -12.313  -2.213
  299   1HB   LYS  32           HB2      LYS  32  68.686 -11.801  -2.287
  300   2HB   LYS  32           HB1      LYS  32  68.081 -12.575  -3.753
  301   1HG   LYS  32           HG2      LYS  32  68.252 -10.633  -5.020
  302   2HG   LYS  32           HG1      LYS  32  68.070  -9.579  -3.617
  303   1HD   LYS  32           HD2      LYS  32  70.326  -9.315  -3.871
  304   2HD   LYS  32           HD1      LYS  32  70.389 -10.824  -2.962
  305   1HE   LYS  32           HE2      LYS  32  69.967 -11.458  -5.731
  306   2HE   LYS  32           HE1      LYS  32  71.321 -10.334  -5.612
  307   1HZ   LYS  32           HZ2      LYS  32  71.112 -12.661  -3.809
  308   2HZ   LYS  32           HZ1      LYS  32  71.794 -12.813  -5.358
  309   3HZ   LYS  32           HZ3      LYS  32  72.489 -11.757  -4.227
  310    HA   PRO  33           HA       PRO  33  66.056  -7.827  -0.635
  311   1HB   PRO  33           HB2      PRO  33  63.525  -7.784   0.429
  312   2HB   PRO  33           HB1      PRO  33  63.903  -7.231  -1.212
  313   1HG   PRO  33           HG2      PRO  33  62.596  -9.770  -0.336
  314   2HG   PRO  33           HG1      PRO  33  62.375  -8.850  -1.834
  315   1HD   PRO  33           HD2      PRO  33  63.913 -11.188  -1.607
  316   2HD   PRO  33           HD1      PRO  33  64.037  -9.989  -2.914
  317    H    SER  34           HN       SER  34  67.434  -8.398   1.050
  318    HA   SER  34           HA       SER  34  66.784 -10.368   3.068
  319   1HB   SER  34           HB2      SER  34  69.102  -9.206   2.256
  320   2HB   SER  34           HB1      SER  34  68.770  -8.280   3.718
  321    HG   SER  34           HG       SER  34  68.868 -11.113   3.479
  322    H    LEU  35           HN       LEU  35  66.431  -9.888   5.357
  323    HA   LEU  35           HA       LEU  35  64.415  -7.912   5.827
  324   1HB   LEU  35           HB2      LEU  35  66.298  -9.348   7.725
  325   2HB   LEU  35           HB1      LEU  35  64.991  -8.298   8.272
  326    HG   LEU  35           HG       LEU  35  64.042 -10.198   6.277
  327   1HD1  LEU  35          HD12      LEU  35  65.988 -11.455   7.455
  328   2HD1  LEU  35          HD11      LEU  35  64.929 -11.470   8.864
  329   3HD1  LEU  35          HD13      LEU  35  64.419 -12.255   7.369
  330   1HD2  LEU  35          HD22      LEU  35  62.738  -8.819   7.989
  331   2HD2  LEU  35          HD21      LEU  35  62.284 -10.519   7.871
  332   3HD2  LEU  35          HD23      LEU  35  63.299  -9.967   9.204
  333    H    GLN  36           HN       GLN  36  67.881  -7.796   5.708
  334    HA   GLN  36           HA       GLN  36  68.227  -5.286   7.153
  335   1HB   GLN  36           HB2      GLN  36  69.888  -7.090   5.476
  336   2HB   GLN  36           HB1      GLN  36  70.347  -5.388   5.430
  337   1HG   GLN  36           HG2      GLN  36  71.579  -6.325   7.240
  338   2HG   GLN  36           HG1      GLN  36  70.246  -5.446   7.988
  339   1HE2  GLN  36          HE22      GLN  36  70.616  -9.267   8.908
  340   2HE2  GLN  36          HE21      GLN  36  71.868  -8.254   8.372
  341    H    GLN  37           HN       GLN  37  67.854  -6.276   3.778
  342    HA   GLN  37           HA       GLN  37  67.994  -3.649   2.638
  343   1HB   GLN  37           HB2      GLN  37  68.026  -6.036   1.507
  344   2HB   GLN  37           HB1      GLN  37  66.279  -5.805   1.445
  345   1HG   GLN  37           HG2      GLN  37  66.508  -4.474  -0.356
  346   2HG   GLN  37           HG1      GLN  37  67.496  -3.360   0.588
  347   1HE2  GLN  37          HE22      GLN  37  69.267  -5.835  -2.103
  348   2HE2  GLN  37          HE21      GLN  37  67.589  -5.871  -1.850
  349    H    ILE  38           HN       ILE  38  65.478  -5.384   4.360
  350    HA   ILE  38           HA       ILE  38  63.326  -3.691   3.405
  351    HB   ILE  38           HB       ILE  38  63.535  -5.701   5.662
  352   1HG1  ILE  38          HG12      ILE  38  63.299  -6.567   3.369
  353   2HG1  ILE  38          HG11      ILE  38  61.827  -6.870   4.291
  354   1HG2  ILE  38          HG22      ILE  38  61.195  -3.877   4.986
  355   2HG2  ILE  38          HG21      ILE  38  61.043  -5.335   5.966
  356   3HG2  ILE  38          HG23      ILE  38  62.035  -3.990   6.532
  357   1HD1  ILE  38          HD11      ILE  38  61.314  -4.384   3.214
  358   2HD1  ILE  38          HD13      ILE  38  62.240  -5.155   1.926
  359   3HD1  ILE  38          HD12      ILE  38  60.761  -5.908   2.520
  360    H    THR  39           HN       THR  39  65.674  -3.647   5.985
  361    HA   THR  39           HA       THR  39  64.488  -1.520   7.538
  362    HB   THR  39           HB       THR  39  67.469  -1.875   7.298
  363    HG1  THR  39           HG1      THR  39  67.399  -3.790   8.186
  364   1HG2  THR  39          HG23      THR  39  65.487  -1.138   9.442
  365   2HG2  THR  39          HG22      THR  39  67.118  -1.662   9.860
  366   3HG2  THR  39          HG21      THR  39  66.882  -0.224   8.868
  367    H    HIS  40           HN       HIS  40  66.736  -1.682   4.819
  368    HA   HIS  40           HA       HIS  40  67.110   1.199   4.601
  369   1HB   HIS  40           HB2      HIS  40  67.748  -1.175   2.868
  370   2HB   HIS  40           HB1      HIS  40  67.870   0.455   2.205
  371    HD1  HIS  40           HD1      HIS  40  69.146   2.103   4.269
  372    HD2  HIS  40           HD2      HIS  40  70.242  -1.889   3.776
  373    HE1  HIS  40           HE1      HIS  40  71.453   1.862   5.290
  374    H    ILE  41           HN       ILE  41  64.693  -1.069   3.556
  375    HA   ILE  41           HA       ILE  41  63.606   0.506   1.395
  376    HB   ILE  41           HB       ILE  41  63.017  -1.980   2.777
  377   1HG1  ILE  41          HG12      ILE  41  61.585  -2.001   0.407
  378   2HG1  ILE  41          HG11      ILE  41  62.853  -0.819   0.085
  379   1HG2  ILE  41          HG22      ILE  41  60.619  -0.264   2.126
  380   2HG2  ILE  41          HG21      ILE  41  60.550  -2.007   2.384
  381   3HG2  ILE  41          HG23      ILE  41  61.043  -0.940   3.699
  382   1HD1  ILE  41          HD11      ILE  41  63.669  -3.353   1.430
  383   2HD1  ILE  41          HD13      ILE  41  63.232  -3.450  -0.276
  384   3HD1  ILE  41          HD12      ILE  41  64.538  -2.384   0.241
  385    H    ALA  42           HN       ALA  42  62.932   0.186   4.858
  386    HA   ALA  42           HA       ALA  42  60.758   2.003   5.000
  387   1HB   ALA  42           HB2      ALA  42  61.473   0.387   6.806
  388   2HB   ALA  42           HB1      ALA  42  62.804   1.486   7.168
  389   3HB   ALA  42           HB3      ALA  42  61.137   2.019   7.385
  390    H    ASN  43           HN       ASN  43  64.211   2.538   5.698
  391    HA   ASN  43           HA       ASN  43  63.956   5.381   5.994
  392   1HB   ASN  43           HB2      ASN  43  66.269   3.546   5.361
  393   2HB   ASN  43           HB1      ASN  43  66.475   5.297   5.370
  394   1HD2  ASN  43          HD22      ASN  43  65.826   3.332   8.912
  395   2HD2  ASN  43          HD21      ASN  43  65.504   2.543   7.445
  396    H    GLN  44           HN       GLN  44  63.882   3.270   3.262
  397    HA   GLN  44           HA       GLN  44  64.781   5.151   1.278
  398   1HB   GLN  44           HB2      GLN  44  63.761   2.422   1.371
  399   2HB   GLN  44           HB1      GLN  44  63.195   3.303  -0.039
  400   1HG   GLN  44           HG2      GLN  44  66.093   3.060   0.823
  401   2HG   GLN  44           HG1      GLN  44  65.337   2.099  -0.448
  402   1HE2  GLN  44          HE22      GLN  44  65.154   4.849  -2.760
  403   2HE2  GLN  44          HE21      GLN  44  64.399   3.390  -2.332
  404    H    LEU  45           HN       LEU  45  61.648   4.386   2.728
  405    HA   LEU  45           HA       LEU  45  60.549   6.666   1.158
  406   1HB   LEU  45           HB2      LEU  45  58.510   5.575   0.693
  407   2HB   LEU  45           HB1      LEU  45  59.754   4.384   0.346
  408    HG   LEU  45           HG       LEU  45  58.324   4.494   3.004
  409   1HD1  LEU  45          HD12      LEU  45  57.018   4.021   0.655
  410   2HD1  LEU  45          HD11      LEU  45  57.612   2.407   1.030
  411   3HD1  LEU  45          HD13      LEU  45  56.589   3.256   2.179
  412   1HD2  LEU  45          HD23      LEU  45  60.220   2.683   1.573
  413   2HD2  LEU  45          HD22      LEU  45  60.201   3.165   3.270
  414   3HD2  LEU  45          HD21      LEU  45  59.049   1.968   2.679
  415    H    GLY  46           HN       GLY  46  61.574   6.309   4.004
  416   1HA   GLY  46           HA2      GLY  46  60.999   7.021   6.163
  417   2HA   GLY  46           HA1      GLY  46  60.146   8.282   5.288
  418    H    LEU  47           HN       LEU  47  59.152   4.873   5.177
  419    HA   LEU  47           HA       LEU  47  56.627   5.723   6.521
  420   1HB   LEU  47           HB2      LEU  47  55.454   4.141   5.326
  421   2HB   LEU  47           HB1      LEU  47  56.773   4.388   4.200
  422    HG   LEU  47           HG       LEU  47  56.490   2.145   6.201
  423   1HD1  LEU  47          HD11      LEU  47  55.353   2.338   3.753
  424   2HD1  LEU  47          HD13      LEU  47  56.915   1.650   3.311
  425   3HD1  LEU  47          HD12      LEU  47  55.871   0.804   4.454
  426   1HD2  LEU  47          HD22      LEU  47  58.820   3.139   4.699
  427   2HD2  LEU  47          HD21      LEU  47  58.758   2.273   6.223
  428   3HD2  LEU  47          HD23      LEU  47  58.588   1.401   4.703
  429    H    GLU  48           HN       GLU  48  55.615   3.628   7.716
  430    HA   GLU  48           HA       GLU  48  57.548   2.991   9.853
  431   1HB   GLU  48           HB2      GLU  48  54.965   3.714  10.037
  432   2HB   GLU  48           HB1      GLU  48  54.741   1.970   9.905
  433   1HG   GLU  48           HG2      GLU  48  55.021   2.118  12.186
  434   2HG   GLU  48           HG1      GLU  48  56.714   1.969  11.711
  435    H    LYS  49           HN       LYS  49  58.183   0.860  10.284
  436    HA   LYS  49           HA       LYS  49  58.464  -0.963   8.158
  437   1HB   LYS  49           HB2      LYS  49  59.513  -0.832  10.613
  438   2HB   LYS  49           HB1      LYS  49  58.292  -2.064  10.921
  439   1HG   LYS  49           HG2      LYS  49  59.680  -2.588   8.416
  440   2HG   LYS  49           HG1      LYS  49  60.823  -2.453   9.751
  441   1HD   LYS  49           HD2      LYS  49  58.829  -3.975  10.881
  442   2HD   LYS  49           HD1      LYS  49  58.805  -4.536   9.211
  443   1HE   LYS  49           HE2      LYS  49  60.551  -5.856   9.768
  444   2HE   LYS  49           HE1      LYS  49  61.523  -4.386   9.810
  445   1HZ   LYS  49           HZ1      LYS  49  59.931  -5.065  12.176
  446   2HZ   LYS  49           HZ3      LYS  49  61.345  -5.955  11.883
  447   3HZ   LYS  49           HZ2      LYS  49  61.428  -4.268  12.068
  448    H    ASP  50           HN       ASP  50  55.705  -0.448  10.224
  449    HA   ASP  50           HA       ASP  50  54.512  -3.059   9.814
  450   1HB   ASP  50           HB2      ASP  50  53.704  -0.482  11.053
  451   2HB   ASP  50           HB1      ASP  50  52.396  -1.520  10.485
  452    H    VAL  51           HN       VAL  51  54.193   0.107   8.163
  453    HA   VAL  51           HA       VAL  51  52.066  -0.960   6.439
  454    HB   VAL  51           HB       VAL  51  52.121   1.445   7.031
  455   1HG1  VAL  51          HG12      VAL  51  54.870   1.160   6.139
  456   2HG1  VAL  51          HG11      VAL  51  54.072   2.491   5.304
  457   3HG1  VAL  51          HG13      VAL  51  54.131   2.462   7.067
  458   1HG2  VAL  51          HG21      VAL  51  51.271   0.459   4.762
  459   2HG2  VAL  51          HG23      VAL  51  51.448   2.207   4.915
  460   3HG2  VAL  51          HG22      VAL  51  52.682   1.267   4.078
  461    H    VAL  52           HN       VAL  52  55.521  -0.949   6.476
  462    HA   VAL  52           HA       VAL  52  55.812  -1.280   3.599
  463    HB   VAL  52           HB       VAL  52  57.515  -0.402   5.500
  464   1HG1  VAL  52          HG11      VAL  52  57.611  -2.846   6.396
  465   2HG1  VAL  52          HG13      VAL  52  58.663  -3.131   5.009
  466   3HG1  VAL  52          HG12      VAL  52  59.112  -1.937   6.226
  467   1HG2  VAL  52          HG22      VAL  52  57.588  -0.608   2.869
  468   2HG2  VAL  52          HG21      VAL  52  59.054  -0.270   3.785
  469   3HG2  VAL  52          HG23      VAL  52  58.727  -1.908   3.221
  470    NH1  ARG  53           NH1      ARG  53  52.569  -9.737   8.359
  471    NH2  ARG  53           NH2      ARG  53  51.994  -7.640   8.974
  472    H    ARG  53           HN       ARG  53  55.550  -3.363   6.429
  473    HA   ARG  53           HA       ARG  53  56.213  -5.797   4.960
  474   1HB   ARG  53           HB2      ARG  53  56.349  -5.322   7.544
  475   2HB   ARG  53           HB1      ARG  53  54.650  -5.797   7.527
  476   1HG   ARG  53           HG2      ARG  53  56.529  -7.559   6.036
  477   2HG   ARG  53           HG1      ARG  53  56.653  -7.587   7.795
  478   1HD   ARG  53           HD2      ARG  53  54.055  -7.939   6.276
  479   2HD   ARG  53           HD1      ARG  53  55.033  -9.276   6.881
  480    HE   ARG  53           HE       ARG  53  54.634  -7.705   9.120
  481   1HH1  ARG  53          HH11      ARG  53  53.260 -10.391   8.051
  482   2HH1  ARG  53          HH12      ARG  53  51.626 -10.038   8.504
  483   1HH2  ARG  53          HH21      ARG  53  52.245  -6.686   9.138
  484   2HH2  ARG  53          HH22      ARG  53  51.051  -7.941   9.120
  485    H    VAL  54           HN       VAL  54  53.264  -4.090   5.912
  486    HA   VAL  54           HA       VAL  54  51.472  -6.184   4.981
  487    HB   VAL  54           HB       VAL  54  50.887  -3.234   5.378
  488   1HG1  VAL  54          HG11      VAL  54  49.205  -5.726   5.119
  489   2HG1  VAL  54          HG13      VAL  54  48.584  -4.279   5.913
  490   3HG1  VAL  54          HG12      VAL  54  49.072  -4.215   4.220
  491   1HG2  VAL  54          HG23      VAL  54  51.848  -4.919   7.319
  492   2HG2  VAL  54          HG22      VAL  54  50.772  -3.560   7.634
  493   3HG2  VAL  54          HG21      VAL  54  50.111  -5.186   7.464
  494    CH2  TRP  55           CH2      TRP  55  56.352  -2.561  -2.975
  495    H    TRP  55           HN       TRP  55  52.990  -3.337   3.591
  496    HA   TRP  55           HA       TRP  55  51.433  -3.351   1.139
  497   1HB   TRP  55           HB2      TRP  55  52.494  -1.282   1.829
  498   2HB   TRP  55           HB1      TRP  55  54.071  -2.057   1.918
  499    HD1  TRP  55           HD1      TRP  55  51.672  -0.403  -0.517
  500    HE1  TRP  55           HE1      TRP  55  52.792  -0.251  -2.801
  501    HE3  TRP  55           HE3      TRP  55  55.784  -3.353   0.274
  502    HZ2  TRP  55           HZ2      TRP  55  55.086  -1.301  -4.179
  503    HZ3  TRP  55           HZ3      TRP  55  57.413  -3.758  -1.536
  504    HH2  TRP  55           HH2      TRP  55  57.063  -2.743  -3.764
  505    H    PHE  56           HN       PHE  56  54.440  -4.883   2.232
  506    HA   PHE  56           HA       PHE  56  54.872  -5.944  -0.479
  507   1HB   PHE  56           HB2      PHE  56  56.770  -5.235   1.156
  508   2HB   PHE  56           HB1      PHE  56  56.494  -6.816   1.891
  509    HD1  PHE  56           HD2      PHE  56  56.441  -5.585  -1.662
  510    HD2  PHE  56           HD1      PHE  56  58.111  -8.356   1.161
  511    HE1  PHE  56           HE2      PHE  56  57.717  -6.661  -3.484
  512    HE2  PHE  56           HE1      PHE  56  59.385  -9.442  -0.670
  513    HZ   PHE  56           HZ       PHE  56  59.183  -8.589  -2.995
  514    H    CYS  57           HN       CYS  57  53.094  -6.834   2.272
  515    HA   CYS  57           HA       CYS  57  53.371  -9.706   2.087
  516   1HB   CYS  57           HB2      CYS  57  51.572  -7.778   3.454
  517   2HB   CYS  57           HB1      CYS  57  50.843  -9.337   3.075
  518    HG   CYS  57           HG       CYS  57  53.569  -9.318   4.581
  519    H    ASN  58           HN       ASN  58  51.301  -7.258   0.631
  520    HA   ASN  58           HA       ASN  58  49.704  -9.174  -0.888
  521   1HB   ASN  58           HB2      ASN  58  48.913  -6.859  -0.236
  522   2HB   ASN  58           HB1      ASN  58  50.081  -6.201  -1.382
  523   1HD2  ASN  58          HD22      ASN  58  46.610  -7.825  -2.749
  524   2HD2  ASN  58          HD21      ASN  58  46.989  -7.848  -1.094
  525    NH1  ARG  59           NH1      ARG  59  50.533  -6.109  -5.442
  526    NH2  ARG  59           NH2      ARG  59  51.723  -6.469  -7.329
  527    H    ARG  59           HN       ARG  59  52.486  -7.040  -1.452
  528    HA   ARG  59           HA       ARG  59  52.780  -7.615  -4.255
  529   1HB   ARG  59           HB2      ARG  59  54.186  -6.124  -2.244
  530   2HB   ARG  59           HB1      ARG  59  55.363  -7.118  -3.107
  531   1HG   ARG  59           HG2      ARG  59  55.097  -4.947  -4.209
  532   2HG   ARG  59           HG1      ARG  59  54.497  -6.237  -5.251
  533   1HD   ARG  59           HD2      ARG  59  52.252  -5.561  -3.775
  534   2HD   ARG  59           HD1      ARG  59  53.042  -4.010  -4.014
  535    HE   ARG  59           HE       ARG  59  52.809  -4.316  -6.420
  536   1HH1  ARG  59          HH11      ARG  59  50.418  -5.639  -4.566
  537   2HH1  ARG  59          HH12      ARG  59  49.851  -6.774  -5.745
  538   1HH2  ARG  59          HH21      ARG  59  52.519  -6.274  -7.901
  539   2HH2  ARG  59          HH22      ARG  59  51.042  -7.137  -7.630
  540    NH1  ARG  60           NH1      ARG  60  57.790 -14.516   1.478
  541    NH2  ARG  60           NH2      ARG  60  58.148 -13.000   3.118
  542    H    ARG  60           HN       ARG  60  53.388  -9.528  -1.443
  543    HA   ARG  60           HA       ARG  60  55.382 -11.252  -2.744
  544   1HB   ARG  60           HB2      ARG  60  54.308 -10.872  -0.051
  545   2HB   ARG  60           HB1      ARG  60  54.381 -12.579  -0.482
  546   1HG   ARG  60           HG2      ARG  60  56.706 -12.526  -0.819
  547   2HG   ARG  60           HG1      ARG  60  56.732 -10.772  -1.008
  548   1HD   ARG  60           HD2      ARG  60  57.582 -11.084   1.166
  549   2HD   ARG  60           HD1      ARG  60  55.880 -10.718   1.449
  550    HE   ARG  60           HE       ARG  60  55.500 -13.109   1.858
  551   1HH1  ARG  60          HH11      ARG  60  57.251 -14.839   0.700
  552   2HH1  ARG  60          HH12      ARG  60  58.590 -15.033   1.780
  553   1HH2  ARG  60          HH21      ARG  60  57.884 -12.162   3.595
  554   2HH2  ARG  60          HH22      ARG  60  58.950 -13.516   3.420
  555    H    GLN  61           HN       GLN  61  51.986 -11.460  -1.690
  556    HA   GLN  61           HA       GLN  61  51.672 -13.855  -3.450
  557   1HB   GLN  61           HB2      GLN  61  49.703 -14.421  -2.086
  558   2HB   GLN  61           HB1      GLN  61  51.128 -14.252  -1.064
  559   1HG   GLN  61           HG2      GLN  61  50.124 -11.675  -1.102
  560   2HG   GLN  61           HG1      GLN  61  48.657 -12.652  -1.119
  561   1HE2  GLN  61          HE22      GLN  61  49.186 -13.985   2.156
  562   2HE2  GLN  61          HE21      GLN  61  48.390 -14.245   0.679
  563    H    LYS  62           HN       LYS  62  51.693 -11.891  -5.048
  564    HA   LYS  62           HA       LYS  62  49.190 -10.397  -5.235
  565   1HB   LYS  62           HB2      LYS  62  50.142  -9.645  -7.430
  566   2HB   LYS  62           HB1      LYS  62  51.230  -9.367  -6.070
  567   1HG   LYS  62           HG2      LYS  62  52.618 -11.190  -6.658
  568   2HG   LYS  62           HG1      LYS  62  51.392 -11.891  -7.714
  569   1HD   LYS  62           HD2      LYS  62  52.253  -9.140  -8.413
  570   2HD   LYS  62           HD1      LYS  62  53.475 -10.394  -8.623
  571   1HE   LYS  62           HE2      LYS  62  52.087 -11.638 -10.112
  572   2HE   LYS  62           HE1      LYS  62  50.662 -10.689  -9.689
  573   1HZ   LYS  62           HZ2      LYS  62  52.082  -8.730 -10.554
  574   2HZ   LYS  62           HZ1      LYS  62  52.963  -9.939 -11.361
  575   3HZ   LYS  62           HZ3      LYS  62  51.306  -9.750 -11.669
  576    H    GLY  63           HN       GLY  63  50.466 -13.413  -6.470
  577   1HA   GLY  63           HA2      GLY  63  48.135 -14.669  -7.117
  578   2HA   GLY  63           HA1      GLY  63  48.410 -13.668  -8.542
  579    H    LYS  64           HN       LYS  64  50.177 -15.968  -6.446
  580    HA   LYS  64           HA       LYS  64  51.143 -17.369  -8.857
  581   1HB   LYS  64           HB2      LYS  64  52.890 -15.812  -6.985
  582   2HB   LYS  64           HB1      LYS  64  53.507 -17.316  -7.671
  583   1HG   LYS  64           HG2      LYS  64  52.397 -16.075  -9.878
  584   2HG   LYS  64           HG1      LYS  64  53.049 -14.713  -8.968
  585   1HD   LYS  64           HD2      LYS  64  55.248 -15.561  -9.037
  586   2HD   LYS  64           HD1      LYS  64  54.702 -17.191  -9.433
  587   1HE   LYS  64           HE2      LYS  64  53.775 -16.163 -11.607
  588   2HE   LYS  64           HE1      LYS  64  54.766 -14.758 -11.223
  589   1HZ   LYS  64           HZ1      LYS  64  56.429 -16.931 -10.891
  590   2HZ   LYS  64           HZ3      LYS  64  55.549 -17.272 -12.301
  591   3HZ   LYS  64           HZ2      LYS  64  56.435 -15.829 -12.184
  592    NH1  ARG  65           NH1      ARG  65  55.986 -22.669  -3.932
  593    NH2  ARG  65           NH2      ARG  65  57.514 -21.102  -3.367
  594    H    ARG  65           HN       ARG  65  51.368 -17.144  -5.316
  595    HA   ARG  65           HA       ARG  65  51.144 -20.124  -5.241
  596   1HB   ARG  65           HB2      ARG  65  52.706 -18.228  -3.476
  597   2HB   ARG  65           HB1      ARG  65  52.335 -19.881  -2.983
  598   1HG   ARG  65           HG2      ARG  65  53.541 -20.802  -4.835
  599   2HG   ARG  65           HG1      ARG  65  53.683 -19.224  -5.610
  600   1HD   ARG  65           HD2      ARG  65  55.763 -19.310  -4.629
  601   2HD   ARG  65           HD1      ARG  65  54.861 -18.629  -3.275
  602    HE   ARG  65           HE       ARG  65  54.812 -20.866  -2.266
  603   1HH1  ARG  65          HH11      ARG  65  55.033 -22.963  -4.005
  604   2HH1  ARG  65          HH12      ARG  65  56.722 -23.283  -4.218
  605   1HH2  ARG  65          HH21      ARG  65  57.732 -20.195  -3.008
  606   2HH2  ARG  65          HH22      ARG  65  58.250 -21.718  -3.651
  607    H    SER  66           HN       SER  66  49.205 -20.731  -4.453
  608    HA   SER  66           HA       SER  66  48.103 -19.480  -2.042
  609   1HB   SER  66           HB2      SER  66  45.964 -18.856  -3.061
  610   2HB   SER  66           HB1      SER  66  47.276 -17.990  -3.856
  611    HG   SER  66           HG       SER  66  45.502 -19.740  -4.881
  612    H    SER  67           HN       SER  67  46.653 -20.882  -0.996
  613    HA   SER  67           HA       SER  67  45.570 -23.227  -2.377
  614   1HB   SER  67           HB2      SER  67  48.015 -23.761  -1.768
  615   2HB   SER  67           HB1      SER  67  47.479 -23.739  -0.091
  616    HG   SER  67           HG       SER  67  46.334 -25.514  -0.421
   
  Start of MODEL           3
 Raw file had  616 H/Q atoms
  Start of MODEL    3
    1   1H    MET   1           HT2      MET   1  81.451  11.027 -19.196
    2   2H    MET   1           HT1      MET   1  82.564  12.086 -18.471
    3   3H    MET   1           HT3      MET   1  83.016  10.488 -18.812
    4    HA   MET   1           HA       MET   1  81.562   9.617 -17.170
    5   1HB   MET   1           HB2      MET   1  83.805  10.860 -16.551
    6   2HB   MET   1           HB1      MET   1  82.716  12.024 -15.795
    7   1HG   MET   1           HG2      MET   1  81.701  10.249 -14.450
    8   2HG   MET   1           HG1      MET   1  82.709   9.041 -15.247
    9   1HE   MET   1           HE2      MET   1  83.229   8.129 -13.395
   10   2HE   MET   1           HE1      MET   1  84.971   8.269 -13.176
   11   3HE   MET   1           HE3      MET   1  83.870   8.819 -11.907
   12    H    GLU   2           HN       GLU   2  79.821   9.945 -15.677
   13    HA   GLU   2           HA       GLU   2  78.425  12.571 -15.826
   14   1HB   GLU   2           HB2      GLU   2  77.486  10.956 -17.546
   15   2HB   GLU   2           HB1      GLU   2  76.979   9.936 -16.199
   16   1HG   GLU   2           HG2      GLU   2  75.663  11.811 -15.275
   17   2HG   GLU   2           HG1      GLU   2  76.160  12.824 -16.631
   18    H    THR   3           HN       THR   3  78.521   9.338 -14.315
   19    HA   THR   3           HA       THR   3  77.132  10.349 -11.929
   20    HB   THR   3           HB       THR   3  78.426   7.638 -12.172
   21    HG1  THR   3           HG1      THR   3  75.927   8.462 -13.231
   22   1HG2  THR   3          HG23      THR   3  76.007   8.775 -10.752
   23   2HG2  THR   3          HG22      THR   3  76.353   7.047 -10.840
   24   3HG2  THR   3          HG21      THR   3  77.476   8.132 -10.020
   25    H    LEU   4           HN       LEU   4  78.115  10.287  -9.831
   26    HA   LEU   4           HA       LEU   4  81.072  10.063  -9.731
   27   1HB   LEU   4           HB2      LEU   4  81.212  12.236  -8.504
   28   2HB   LEU   4           HB1      LEU   4  80.693  12.430 -10.178
   29    HG   LEU   4           HG       LEU   4  78.282  12.107  -8.979
   30   1HD1  LEU   4          HD13      LEU   4  79.990  12.347  -6.795
   31   2HD1  LEU   4          HD12      LEU   4  79.347  13.977  -6.990
   32   3HD1  LEU   4          HD11      LEU   4  78.248  12.615  -6.776
   33   1HD2  LEU   4          HD21      LEU   4  79.901  14.651  -9.299
   34   2HD2  LEU   4          HD23      LEU   4  78.808  13.932 -10.482
   35   3HD2  LEU   4          HD22      LEU   4  78.165  14.627  -8.994
   36    H    VAL   5           HN       VAL   5  81.635  10.676  -7.216
   37    HA   VAL   5           HA       VAL   5  79.685   9.124  -5.561
   38    HB   VAL   5           HB       VAL   5  81.743   7.844  -6.012
   39   1HG1  VAL   5          HG11      VAL   5  82.985  10.398  -5.632
   40   2HG1  VAL   5          HG13      VAL   5  83.647   9.279  -4.440
   41   3HG1  VAL   5          HG12      VAL   5  83.725   8.887  -6.156
   42   1HG2  VAL   5          HG22      VAL   5  81.319   8.873  -3.200
   43   2HG2  VAL   5          HG21      VAL   5  80.771   7.351  -3.901
   44   3HG2  VAL   5          HG23      VAL   5  82.483   7.599  -3.560
   45    H    GLN   6           HN       GLN   6  78.849  11.422  -5.236
   46    HA   GLN   6           HA       GLN   6  80.084  12.521  -2.785
   47   1HB   GLN   6           HB2      GLN   6  80.926  13.695  -4.997
   48   2HB   GLN   6           HB1      GLN   6  79.349  14.484  -4.932
   49   1HG   GLN   6           HG2      GLN   6  79.841  15.621  -2.981
   50   2HG   GLN   6           HG1      GLN   6  80.970  14.385  -2.422
   51   1HE2  GLN   6          HE22      GLN   6  82.768  17.493  -3.744
   52   2HE2  GLN   6          HE21      GLN   6  81.440  17.341  -2.697
   53    H    ALA   7           HN       ALA   7  77.527  11.139  -3.637
   54    HA   ALA   7           HA       ALA   7  75.455  13.160  -3.404
   55   1HB   ALA   7           HB1      ALA   7  75.076  11.070  -4.670
   56   2HB   ALA   7           HB3      ALA   7  75.280  10.141  -3.185
   57   3HB   ALA   7           HB2      ALA   7  73.912  11.242  -3.357
   58    NH1  ARG   8           NH1      ARG   8  72.745  17.240  -1.076
   59    NH2  ARG   8           NH2      ARG   8  74.472  18.581  -1.645
   60    H    ARG   8           HN       ARG   8  73.679  12.419  -1.594
   61    HA   ARG   8           HA       ARG   8  75.171  12.445   0.969
   62   1HB   ARG   8           HB2      ARG   8  72.633  13.748   0.064
   63   2HB   ARG   8           HB1      ARG   8  72.836  13.367   1.775
   64   1HG   ARG   8           HG2      ARG   8  73.683  15.578   1.526
   65   2HG   ARG   8           HG1      ARG   8  75.108  14.542   1.610
   66   1HD   ARG   8           HD2      ARG   8  75.644  14.862  -0.601
   67   2HD   ARG   8           HD1      ARG   8  73.959  15.027  -1.094
   68    HE   ARG   8           HE       ARG   8  75.526  17.203   0.231
   69   1HH1  ARG   8          HH11      ARG   8  72.393  16.439  -0.590
   70   2HH1  ARG   8          HH12      ARG   8  72.123  17.813  -1.609
   71   1HH2  ARG   8          HH21      ARG   8  75.444  18.809  -1.596
   72   2HH2  ARG   8          HH22      ARG   8  73.850  19.155  -2.179
   73    H    LYS   9           HN       LYS   9  72.181  11.201  -0.531
   74    HA   LYS   9           HA       LYS   9  72.386   8.862   1.267
   75   1HB   LYS   9           HB2      LYS   9  69.917   8.891   1.573
   76   2HB   LYS   9           HB1      LYS   9  70.690  10.322   2.254
   77   1HG   LYS   9           HG2      LYS   9  70.223  11.245  -0.230
   78   2HG   LYS   9           HG1      LYS   9  68.904  10.080  -0.116
   79   1HD   LYS   9           HD2      LYS   9  67.922  11.174   1.710
   80   2HD   LYS   9           HD1      LYS   9  69.420  11.998   2.143
   81   1HE   LYS   9           HE2      LYS   9  68.015  13.658   1.143
   82   2HE   LYS   9           HE1      LYS   9  69.228  13.246  -0.070
   83   1HZ   LYS   9           HZ3      LYS   9  67.523  11.554  -0.870
   84   2HZ   LYS   9           HZ2      LYS   9  66.395  12.424   0.056
   85   3HZ   LYS   9           HZ1      LYS   9  67.224  13.188  -1.216
   86    NH1  ARG  10           NH2      ARG  10  71.048   9.956  -8.067
   87    NH2  ARG  10           NH1      ARG  10  72.885   9.259  -9.184
   88    H    ARG  10           HN       ARG  10  73.378   8.310  -0.995
   89    HA   ARG  10           HA       ARG  10  71.258   7.485  -2.886
   90   1HB   ARG  10           HB2      ARG  10  73.405   8.828  -3.557
   91   2HB   ARG  10           HB1      ARG  10  74.200   7.258  -3.450
   92   1HG   ARG  10           HG2      ARG  10  73.305   6.571  -5.405
   93   2HG   ARG  10           HG1      ARG  10  71.685   7.067  -4.916
   94   1HD   ARG  10           HD2      ARG  10  72.220   9.402  -5.526
   95   2HD   ARG  10           HD1      ARG  10  73.832   8.897  -6.033
   96    HE   ARG  10           HE       ARG  10  72.059   7.285  -7.482
   97   1HH1  ARG  10          HH21      ARG  10  70.419   9.867  -7.295
   98   2HH1  ARG  10          HH22      ARG  10  70.898  10.665  -8.756
   99   1HH2  ARG  10          HH11      ARG  10  73.664   8.637  -9.268
  100   2HH2  ARG  10          HH12      ARG  10  72.735   9.968  -9.873
  101    H    LYS  11           HN       LYS  11  70.982   5.880  -0.879
  102    HA   LYS  11           HA       LYS  11  72.226   3.352  -1.730
  103   1HB   LYS  11           HB2      LYS  11  73.535   4.437   0.212
  104   2HB   LYS  11           HB1      LYS  11  72.121   4.061   1.198
  105   1HG   LYS  11           HG2      LYS  11  72.471   1.787   1.085
  106   2HG   LYS  11           HG1      LYS  11  73.220   1.875  -0.509
  107   1HD   LYS  11           HD2      LYS  11  75.306   2.197   0.346
  108   2HD   LYS  11           HD1      LYS  11  74.723   3.253   1.631
  109   1HE   LYS  11           HE2      LYS  11  75.174   1.494   2.995
  110   2HE   LYS  11           HE1      LYS  11  73.657   0.836   2.382
  111   1HZ   LYS  11           HZ1      LYS  11  74.894  -0.285   0.634
  112   2HZ   LYS  11           HZ3      LYS  11  76.351   0.344   1.233
  113   3HZ   LYS  11           HZ2      LYS  11  75.455  -0.756   2.167
  114    NH1  ARG  12           NH1      ARG  12  65.298   7.462  -3.113
  115    NH2  ARG  12           NH2      ARG  12  67.509   7.489  -3.577
  116    H    ARG  12           HN       ARG  12  70.045   2.970  -2.520
  117    HA   ARG  12           HA       ARG  12  67.997   2.593  -0.380
  118   1HB   ARG  12           HB2      ARG  12  67.845   3.756  -2.929
  119   2HB   ARG  12           HB1      ARG  12  67.061   2.189  -3.118
  120   1HG   ARG  12           HG2      ARG  12  65.339   2.727  -1.698
  121   2HG   ARG  12           HG1      ARG  12  66.360   3.739  -0.676
  122   1HD   ARG  12           HD2      ARG  12  65.412   4.492  -3.456
  123   2HD   ARG  12           HD1      ARG  12  64.693   5.075  -1.955
  124    HE   ARG  12           HE       ARG  12  67.436   5.677  -1.788
  125   1HH1  ARG  12          HH11      ARG  12  64.509   7.026  -2.679
  126   2HH1  ARG  12          HH12      ARG  12  65.181   8.314  -3.624
  127   1HH2  ARG  12          HH21      ARG  12  68.416   7.075  -3.499
  128   2HH2  ARG  12          HH22      ARG  12  67.391   8.341  -4.087
  129    H    THR  13           HN       THR  13  70.311   0.751  -1.084
  130    HA   THR  13           HA       THR  13  68.994  -1.601  -2.254
  131    HB   THR  13           HB       THR  13  71.648  -1.729  -0.867
  132    HG1  THR  13           HG1      THR  13  72.124   0.007  -1.989
  133   1HG2  THR  13          HG22      THR  13  70.159  -3.414  -2.544
  134   2HG2  THR  13          HG21      THR  13  71.434  -2.763  -3.574
  135   3HG2  THR  13          HG23      THR  13  71.851  -3.611  -2.087
  136    H    SER  14           HN       SER  14  68.665  -0.219   0.701
  137    HA   SER  14           HA       SER  14  68.203  -2.856   2.000
  138   1HB   SER  14           HB2      SER  14  68.927  -1.364   4.142
  139   2HB   SER  14           HB1      SER  14  70.064  -2.370   3.250
  140    HG   SER  14           HG       SER  14  70.570  -0.027   3.626
  141    H    ILE  15           HN       ILE  15  67.070  -2.071   4.329
  142    HA   ILE  15           HA       ILE  15  64.640  -0.653   3.403
  143    HB   ILE  15           HB       ILE  15  65.241  -2.255   5.900
  144   1HG1  ILE  15          HG12      ILE  15  64.920  -3.551   3.817
  145   2HG1  ILE  15          HG11      ILE  15  63.585  -3.812   4.938
  146   1HG2  ILE  15          HG23      ILE  15  63.178  -0.260   5.427
  147   2HG2  ILE  15          HG22      ILE  15  62.457  -1.848   5.686
  148   3HG2  ILE  15          HG21      ILE  15  63.535  -1.160   6.901
  149   1HD1  ILE  15          HD13      ILE  15  62.337  -1.961   3.685
  150   2HD1  ILE  15          HD12      ILE  15  63.608  -2.064   2.467
  151   3HD1  ILE  15          HD11      ILE  15  62.583  -3.457   2.788
  152    H    GLU  16           HN       GLU  16  65.643   1.477   3.351
  153    HA   GLU  16           HA       GLU  16  66.700   2.675   5.760
  154   1HB   GLU  16           HB2      GLU  16  66.515   3.408   3.049
  155   2HB   GLU  16           HB1      GLU  16  65.492   4.571   3.891
  156   1HG   GLU  16           HG2      GLU  16  67.659   5.538   3.936
  157   2HG   GLU  16           HG1      GLU  16  67.452   4.837   5.542
  158    H    ASN  17           HN       ASN  17  65.510   4.198   7.106
  159    HA   ASN  17           HA       ASN  17  62.875   3.342   7.767
  160   1HB   ASN  17           HB2      ASN  17  64.546   5.727   8.511
  161   2HB   ASN  17           HB1      ASN  17  62.844   5.686   8.976
  162   1HD2  ASN  17          HD22      ASN  17  65.327   3.808  11.358
  163   2HD2  ASN  17          HD21      ASN  17  65.671   5.166  10.399
  164    NH1  ARG  18           NH2      ARG  18  66.827   9.717   6.171
  165    NH2  ARG  18           NH1      ARG  18  68.130   9.451   4.344
  166    H    ARG  18           HN       ARG  18  64.022   5.676   5.452
  167    HA   ARG  18           HA       ARG  18  61.384   6.916   5.121
  168   1HB   ARG  18           HB2      ARG  18  63.871   7.126   3.392
  169   2HB   ARG  18           HB1      ARG  18  62.444   8.158   3.286
  170   1HG   ARG  18           HG2      ARG  18  62.830   9.017   5.524
  171   2HG   ARG  18           HG1      ARG  18  64.161   7.886   5.769
  172   1HD   ARG  18           HD2      ARG  18  64.242   9.774   3.435
  173   2HD   ARG  18           HD1      ARG  18  64.680  10.359   5.040
  174    HE   ARG  18           HE       ARG  18  66.070   8.078   3.690
  175   1HH1  ARG  18          HH21      ARG  18  65.938   9.632   6.620
  176   2HH1  ARG  18          HH22      ARG  18  67.608  10.090   6.673
  177   1HH2  ARG  18          HH11      ARG  18  68.240   9.162   3.392
  178   2HH2  ARG  18          HH12      ARG  18  68.911   9.824   4.845
  179    H    VAL  19           HN       VAL  19  63.224   4.267   3.736
  180    HA   VAL  19           HA       VAL  19  61.679   4.055   1.324
  181    HB   VAL  19           HB       VAL  19  63.981   2.854   2.127
  182   1HG1  VAL  19          HG12      VAL  19  61.842   0.721   2.441
  183   2HG1  VAL  19          HG11      VAL  19  63.555   0.396   2.231
  184   3HG1  VAL  19          HG13      VAL  19  62.996   1.249   3.668
  185   1HG2  VAL  19          HG21      VAL  19  62.815   3.109  -0.158
  186   2HG2  VAL  19          HG23      VAL  19  63.889   1.726   0.049
  187   3HG2  VAL  19          HG22      VAL  19  62.142   1.509   0.153
  188    NH1  ARG  20           NH1      ARG  20  58.451  -1.846   8.227
  189    NH2  ARG  20           NH2      ARG  20  59.493  -1.375  10.175
  190    H    ARG  20           HN       ARG  20  61.409   2.504   4.515
  191    HA   ARG  20           HA       ARG  20  59.155   0.874   3.851
  192   1HB   ARG  20           HB2      ARG  20  60.192   2.010   6.435
  193   2HB   ARG  20           HB1      ARG  20  58.666   1.131   6.397
  194   1HG   ARG  20           HG2      ARG  20  59.701  -0.866   5.655
  195   2HG   ARG  20           HG1      ARG  20  61.191  -0.026   5.222
  196   1HD   ARG  20           HD2      ARG  20  61.278  -1.339   7.404
  197   2HD   ARG  20           HD1      ARG  20  61.755   0.353   7.520
  198    HE   ARG  20           HE       ARG  20  59.613   0.824   8.602
  199   1HH1  ARG  20          HH11      ARG  20  58.279  -1.637   7.264
  200   2HH1  ARG  20          HH12      ARG  20  57.995  -2.623   8.659
  201   1HH2  ARG  20          HH21      ARG  20  60.120  -0.805  10.706
  202   2HH2  ARG  20          HH22      ARG  20  59.036  -2.153  10.608
  203    CH2  TRP  21           CH2      TRP  21  55.962   1.642   9.205
  204    H    TRP  21           HN       TRP  21  59.208   4.125   5.346
  205    HA   TRP  21           HA       TRP  21  56.316   4.219   5.026
  206   1HB   TRP  21           HB2      TRP  21  58.327   5.941   6.353
  207   2HB   TRP  21           HB1      TRP  21  56.937   6.801   5.672
  208    HD1  TRP  21           HD1      TRP  21  55.172   7.059   7.556
  209    HE1  TRP  21           HE1      TRP  21  54.081   5.459   9.269
  210    HE3  TRP  21           HE3      TRP  21  58.005   2.893   6.830
  211    HZ2  TRP  21           HZ2      TRP  21  54.379   2.716  10.174
  212    HZ3  TRP  21           HZ3      TRP  21  57.591   0.818   8.060
  213    HH2  TRP  21           HH2      TRP  21  55.776   0.732   9.751
  214    H    SER  22           HN       SER  22  58.805   4.523   2.862
  215    HA   SER  22           HA       SER  22  57.597   6.563   1.160
  216   1HB   SER  22           HB2      SER  22  59.939   6.275   0.755
  217   2HB   SER  22           HB1      SER  22  59.803   4.522   0.778
  218    HG   SER  22           HG       SER  22  59.884   5.078  -1.341
  219    H    LEU  23           HN       LEU  23  57.637   3.064   1.658
  220    HA   LEU  23           HA       LEU  23  56.014   2.193  -0.537
  221   1HB   LEU  23           HB2      LEU  23  56.057   1.192   2.346
  222   2HB   LEU  23           HB1      LEU  23  55.358   0.327   1.005
  223    HG   LEU  23           HG       LEU  23  58.225   1.084   0.750
  224   1HD1  LEU  23          HD13      LEU  23  57.504   0.065   3.145
  225   2HD1  LEU  23          HD12      LEU  23  57.587  -1.437   2.228
  226   3HD1  LEU  23          HD11      LEU  23  59.007  -0.400   2.348
  227   1HD2  LEU  23          HD23      LEU  23  56.314  -0.995  -0.199
  228   2HD2  LEU  23          HD22      LEU  23  57.650  -0.229  -1.058
  229   3HD2  LEU  23          HD21      LEU  23  57.968  -1.542   0.074
  230    H    GLU  24           HN       GLU  24  55.373   3.391   2.706
  231    HA   GLU  24           HA       GLU  24  52.525   3.265   2.695
  232   1HB   GLU  24           HB2      GLU  24  54.101   3.686   4.661
  233   2HB   GLU  24           HB1      GLU  24  54.192   5.356   4.108
  234   1HG   GLU  24           HG2      GLU  24  51.438   4.702   4.148
  235   2HG   GLU  24           HG1      GLU  24  52.113   4.058   5.643
  236    H    THR  25           HN       THR  25  54.753   5.694   1.443
  237    HA   THR  25           HA       THR  25  52.758   7.742   1.024
  238    HB   THR  25           HB       THR  25  55.400   7.372  -0.417
  239    HG1  THR  25           HG1      THR  25  54.789   8.793   1.960
  240   1HG2  THR  25          HG21      THR  25  53.300   9.405  -0.462
  241   2HG2  THR  25          HG23      THR  25  54.871  10.076  -0.024
  242   3HG2  THR  25          HG22      THR  25  54.681   9.194  -1.538
  243    H    MET  26           HN       MET  26  53.836   4.967  -0.827
  244    HA   MET  26           HA       MET  26  52.501   5.895  -3.283
  245   1HB   MET  26           HB2      MET  26  54.595   4.169  -2.765
  246   2HB   MET  26           HB1      MET  26  53.278   3.061  -3.146
  247   1HG   MET  26           HG2      MET  26  52.956   4.958  -5.100
  248   2HG   MET  26           HG1      MET  26  54.708   4.972  -4.896
  249   1HE   MET  26           HE3      MET  26  55.413   4.439  -6.712
  250   2HE   MET  26           HE2      MET  26  56.121   2.826  -6.674
  251   3HE   MET  26           HE1      MET  26  54.885   3.209  -7.870
  252    H    PHE  27           HN       PHE  27  51.763   3.768  -0.580
  253    HA   PHE  27           HA       PHE  27  49.433   2.616  -1.976
  254   1HB   PHE  27           HB2      PHE  27  50.701   2.166   0.723
  255   2HB   PHE  27           HB1      PHE  27  49.127   1.481   0.325
  256    HD1  PHE  27           HD1      PHE  27  52.454   1.893  -1.389
  257    HD2  PHE  27           HD2      PHE  27  49.177  -0.713  -0.432
  258    HE1  PHE  27           HE1      PHE  27  53.572   0.053  -2.596
  259    HE2  PHE  27           HE2      PHE  27  50.299  -2.561  -1.645
  260    HZ   PHE  27           HZ       PHE  27  52.496  -2.179  -2.730
  261    H    LEU  28           HN       LEU  28  50.065   5.239   0.221
  262    HA   LEU  28           HA       LEU  28  47.255   5.320   1.108
  263   1HB   LEU  28           HB2      LEU  28  49.648   7.044   1.763
  264   2HB   LEU  28           HB1      LEU  28  48.030   7.356   2.389
  265    HG   LEU  28           HG       LEU  28  49.627   4.803   2.790
  266   1HD1  LEU  28          HD11      LEU  28  50.342   6.873   4.070
  267   2HD1  LEU  28          HD13      LEU  28  48.753   6.857   4.834
  268   3HD1  LEU  28          HD12      LEU  28  49.861   5.504   5.072
  269   1HD2  LEU  28          HD22      LEU  28  46.784   5.540   3.273
  270   2HD2  LEU  28          HD21      LEU  28  47.500   3.956   2.980
  271   3HD2  LEU  28          HD23      LEU  28  47.593   4.682   4.585
  272    H    LYS  29           HN       LYS  29  48.660   6.227  -1.711
  273    HA   LYS  29           HA       LYS  29  47.148   8.786  -1.914
  274   1HB   LYS  29           HB2      LYS  29  48.360   9.160  -4.003
  275   2HB   LYS  29           HB1      LYS  29  49.518   8.749  -2.741
  276   1HG   LYS  29           HG2      LYS  29  49.289   6.312  -3.587
  277   2HG   LYS  29           HG1      LYS  29  48.529   7.018  -5.013
  278   1HD   LYS  29           HD2      LYS  29  51.249   7.854  -3.966
  279   2HD   LYS  29           HD1      LYS  29  51.012   6.673  -5.255
  280   1HE   LYS  29           HE2      LYS  29  49.879   8.336  -6.631
  281   2HE   LYS  29           HE1      LYS  29  49.963   9.518  -5.324
  282   1HZ   LYS  29           HZ2      LYS  29  52.408   8.253  -6.388
  283   2HZ   LYS  29           HZ1      LYS  29  51.727   9.608  -7.153
  284   3HZ   LYS  29           HZ3      LYS  29  52.248   9.718  -5.542
  285    H    CYS  30           HN       CYS  30  47.433   5.556  -3.245
  286    HA   CYS  30           HA       CYS  30  44.654   5.742  -4.238
  287   1HB   CYS  30           HB2      CYS  30  47.111   5.213  -5.851
  288   2HB   CYS  30           HB1      CYS  30  45.688   4.235  -6.208
  289    HG   CYS  30           HG       CYS  30  45.784   6.635  -7.532
  290    HA   PRO  31           HA       PRO  31  45.032   1.783  -2.093
  291   1HB   PRO  31           HB2      PRO  31  42.359   1.216  -1.981
  292   2HB   PRO  31           HB1      PRO  31  43.132   2.394  -0.905
  293   1HG   PRO  31           HG2      PRO  31  41.324   2.872  -3.211
  294   2HG   PRO  31           HG1      PRO  31  41.668   3.916  -1.823
  295   1HD   PRO  31           HD2      PRO  31  42.756   4.138  -4.467
  296   2HD   PRO  31           HD1      PRO  31  43.202   5.101  -3.042
  297    H    LYS  32           HN       LYS  32  45.173   1.949  -5.134
  298    HA   LYS  32           HA       LYS  32  43.792  -0.611  -5.717
  299   1HB   LYS  32           HB2      LYS  32  43.694   0.221  -8.104
  300   2HB   LYS  32           HB1      LYS  32  42.695   1.116  -6.960
  301   1HG   LYS  32           HG2      LYS  32  44.374   2.871  -6.789
  302   2HG   LYS  32           HG1      LYS  32  45.486   1.955  -7.806
  303   1HD   LYS  32           HD2      LYS  32  44.566   3.337  -9.411
  304   2HD   LYS  32           HD1      LYS  32  43.407   2.009  -9.483
  305   1HE   LYS  32           HE2      LYS  32  41.931   3.196  -7.911
  306   2HE   LYS  32           HE1      LYS  32  43.095   4.516  -7.804
  307   1HZ   LYS  32           HZ2      LYS  32  42.840   4.527 -10.369
  308   2HZ   LYS  32           HZ1      LYS  32  41.367   3.742 -10.051
  309   3HZ   LYS  32           HZ3      LYS  32  41.664   5.280  -9.403
  310    HA   PRO  33           HA       PRO  33  48.396  -0.839  -6.866
  311   1HB   PRO  33           HB2      PRO  33  49.390  -2.301  -4.768
  312   2HB   PRO  33           HB1      PRO  33  49.416  -0.530  -4.816
  313   1HG   PRO  33           HG2      PRO  33  47.642  -2.342  -3.245
  314   2HG   PRO  33           HG1      PRO  33  48.182  -0.696  -2.872
  315   1HD   PRO  33           HD2      PRO  33  45.639  -1.383  -3.884
  316   2HD   PRO  33           HD1      PRO  33  46.360   0.241  -3.877
  317    H    SER  34           HN       SER  34  49.143  -2.725  -7.919
  318    HA   SER  34           HA       SER  34  47.299  -5.022  -7.912
  319   1HB   SER  34           HB2      SER  34  49.720  -4.513  -9.641
  320   2HB   SER  34           HB1      SER  34  48.467  -5.719  -9.916
  321    HG   SER  34           HG       SER  34  48.103  -3.843 -11.153
  322    H    LEU  35           HN       LEU  35  47.987  -7.173  -7.455
  323    HA   LEU  35           HA       LEU  35  49.989  -7.428  -5.419
  324   1HB   LEU  35           HB2      LEU  35  49.572  -9.767  -5.463
  325   2HB   LEU  35           HB1      LEU  35  48.032  -9.042  -5.901
  326    HG   LEU  35           HG       LEU  35  50.039 -10.018  -7.948
  327   1HD1  LEU  35          HD12      LEU  35  47.952 -11.456  -6.378
  328   2HD1  LEU  35          HD11      LEU  35  48.096 -11.854  -8.090
  329   3HD1  LEU  35          HD13      LEU  35  49.484 -12.051  -7.019
  330   1HD2  LEU  35          HD21      LEU  35  47.154  -9.120  -8.008
  331   2HD2  LEU  35          HD23      LEU  35  48.508  -8.500  -8.952
  332   3HD2  LEU  35          HD22      LEU  35  47.845 -10.095  -9.306
  333    H    GLN  36           HN       GLN  36  50.124  -7.286  -8.879
  334    HA   GLN  36           HA       GLN  36  52.708  -8.571  -9.230
  335   1HB   GLN  36           HB2      GLN  36  51.061  -8.086 -11.101
  336   2HB   GLN  36           HB1      GLN  36  51.461  -6.377 -10.925
  337   1HG   GLN  36           HG2      GLN  36  52.820  -7.326 -12.710
  338   2HG   GLN  36           HG1      GLN  36  53.862  -6.941 -11.339
  339   1HE2  GLN  36          HE22      GLN  36  54.968 -10.261 -11.031
  340   2HE2  GLN  36          HE21      GLN  36  55.235  -8.613 -10.721
  341    H    GLN  37           HN       GLN  37  51.534  -5.278  -8.679
  342    HA   GLN  37           HA       GLN  37  54.120  -4.019  -8.648
  343   1HB   GLN  37           HB2      GLN  37  51.920  -2.783  -8.817
  344   2HB   GLN  37           HB1      GLN  37  51.654  -3.148  -7.112
  345   1HG   GLN  37           HG2      GLN  37  52.781  -1.220  -6.691
  346   2HG   GLN  37           HG1      GLN  37  54.233  -2.130  -7.105
  347   1HE2  GLN  37          HE22      GLN  37  53.233   0.950  -9.415
  348   2HE2  GLN  37          HE21      GLN  37  52.646   0.705  -7.841
  349    H    ILE  38           HN       ILE  38  52.358  -6.004  -6.349
  350    HA   ILE  38           HA       ILE  38  53.829  -5.141  -4.021
  351    HB   ILE  38           HB       ILE  38  52.185  -7.622  -4.609
  352   1HG1  ILE  38          HG12      ILE  38  50.970  -5.525  -4.176
  353   2HG1  ILE  38          HG11      ILE  38  50.749  -6.638  -2.827
  354   1HG2  ILE  38          HG23      ILE  38  54.131  -7.151  -2.400
  355   2HG2  ILE  38          HG22      ILE  38  52.543  -7.731  -1.901
  356   3HG2  ILE  38          HG21      ILE  38  53.506  -8.672  -3.039
  357   1HD1  ILE  38          HD12      ILE  38  52.804  -5.417  -1.777
  358   2HD1  ILE  38          HD11      ILE  38  52.464  -4.156  -2.960
  359   3HD1  ILE  38          HD13      ILE  38  51.248  -4.588  -1.759
  360    H    THR  39           HN       THR  39  54.301  -7.505  -6.565
  361    HA   THR  39           HA       THR  39  56.606  -8.824  -5.444
  362    HB   THR  39           HB       THR  39  55.977  -8.354  -8.379
  363    HG1  THR  39           HG1      THR  39  54.623  -9.998  -8.246
  364   1HG2  THR  39          HG22      THR  39  58.270  -9.296  -7.469
  365   2HG2  THR  39          HG21      THR  39  57.334 -10.775  -7.251
  366   3HG2  THR  39          HG23      THR  39  57.485 -10.055  -8.854
  367    H    HIS  40           HN       HIS  40  56.203  -6.097  -7.677
  368    HA   HIS  40           HA       HIS  40  59.016  -5.419  -7.795
  369   1HB   HIS  40           HB2      HIS  40  56.453  -4.165  -8.658
  370   2HB   HIS  40           HB1      HIS  40  57.836  -3.091  -8.443
  371    HD1  HIS  40           HD1      HIS  40  57.901  -6.668  -9.727
  372    HD2  HIS  40           HD2      HIS  40  58.677  -2.803 -11.086
  373    HE1  HIS  40           HE1      HIS  40  58.921  -6.911 -12.031
  374    H    ILE  41           HN       ILE  41  56.591  -4.978  -5.400
  375    HA   ILE  41           HA       ILE  41  57.656  -2.587  -4.172
  376    HB   ILE  41           HB       ILE  41  55.470  -4.407  -3.770
  377   1HG1  ILE  41          HG12      ILE  41  54.889  -2.400  -2.085
  378   2HG1  ILE  41          HG11      ILE  41  56.218  -1.640  -2.963
  379   1HG2  ILE  41          HG21      ILE  41  57.065  -3.887  -1.262
  380   2HG2  ILE  41          HG23      ILE  41  55.368  -4.367  -1.266
  381   3HG2  ILE  41          HG22      ILE  41  56.593  -5.453  -1.921
  382   1HD1  ILE  41          HD13      ILE  41  55.082  -2.154  -5.108
  383   2HD1  ILE  41          HD12      ILE  41  53.747  -2.883  -4.215
  384   3HD1  ILE  41          HD11      ILE  41  54.070  -1.157  -4.066
  385    H    ALA  42           HN       ALA  42  58.010  -6.071  -3.770
  386    HA   ALA  42           HA       ALA  42  59.820  -6.081  -1.590
  387   1HB   ALA  42           HB1      ALA  42  58.585  -8.071  -2.550
  388   2HB   ALA  42           HB3      ALA  42  59.754  -8.068  -3.871
  389   3HB   ALA  42           HB2      ALA  42  60.293  -8.362  -2.216
  390    H    ASN  43           HN       ASN  43  60.491  -6.283  -5.089
  391    HA   ASN  43           HA       ASN  43  63.335  -6.029  -4.824
  392   1HB   ASN  43           HB2      ASN  43  61.920  -6.670  -6.917
  393   2HB   ASN  43           HB1      ASN  43  61.790  -4.930  -7.169
  394   1HD2  ASN  43          HD22      ASN  43  64.956  -4.803  -8.680
  395   2HD2  ASN  43          HD21      ASN  43  63.375  -4.193  -8.580
  396    H    GLN  44           HN       GLN  44  60.718  -3.789  -4.518
  397    HA   GLN  44           HA       GLN  44  62.163  -1.361  -5.057
  398   1HB   GLN  44           HB2      GLN  44  59.501  -2.160  -4.349
  399   2HB   GLN  44           HB1      GLN  44  59.993  -0.825  -3.326
  400   1HG   GLN  44           HG2      GLN  44  58.870  -0.061  -5.405
  401   2HG   GLN  44           HG1      GLN  44  60.529   0.519  -5.305
  402   1HE2  GLN  44          HE22      GLN  44  59.419  -1.782  -8.418
  403   2HE2  GLN  44          HE21      GLN  44  58.310  -1.177  -7.285
  404    H    LEU  45           HN       LEU  45  61.631  -3.289  -2.137
  405    HA   LEU  45           HA       LEU  45  63.528  -1.438  -0.776
  406   1HB   LEU  45           HB2      LEU  45  62.271  -1.384   1.224
  407   2HB   LEU  45           HB1      LEU  45  61.094  -1.155  -0.053
  408    HG   LEU  45           HG       LEU  45  61.645  -3.894   1.084
  409   1HD1  LEU  45          HD11      LEU  45  60.650  -1.747   2.583
  410   2HD1  LEU  45          HD13      LEU  45  59.209  -2.616   2.054
  411   3HD1  LEU  45          HD12      LEU  45  60.466  -3.459   2.957
  412   1HD2  LEU  45          HD23      LEU  45  59.675  -2.576  -0.716
  413   2HD2  LEU  45          HD22      LEU  45  60.363  -4.198  -0.791
  414   3HD2  LEU  45          HD21      LEU  45  59.069  -3.842   0.352
  415    H    GLY  46           HN       GLY  46  63.764  -4.154  -2.106
  416   1HA   GLY  46           HA2      GLY  46  64.834  -6.205  -1.731
  417   2HA   GLY  46           HA1      GLY  46  65.872  -5.229  -0.707
  418    H    LEU  47           HN       LEU  47  62.472  -5.783   0.118
  419    HA   LEU  47           HA       LEU  47  63.446  -7.305   2.490
  420   1HB   LEU  47           HB2      LEU  47  61.698  -6.490   3.741
  421   2HB   LEU  47           HB1      LEU  47  61.772  -5.201   2.559
  422    HG   LEU  47           HG       LEU  47  59.874  -7.547   2.556
  423   1HD1  LEU  47          HD12      LEU  47  59.678  -5.254   3.990
  424   2HD1  LEU  47          HD11      LEU  47  58.911  -4.749   2.485
  425   3HD1  LEU  47          HD13      LEU  47  58.278  -6.133   3.374
  426   1HD2  LEU  47          HD23      LEU  47  60.682  -5.700   0.434
  427   2HD2  LEU  47          HD22      LEU  47  59.911  -7.270   0.315
  428   3HD2  LEU  47          HD21      LEU  47  58.945  -5.834   0.648
  429    H    GLU  48           HN       GLU  48  61.587  -8.917   3.268
  430    HA   GLU  48           HA       GLU  48  61.282 -10.860   1.068
  431   1HB   GLU  48           HB2      GLU  48  62.133 -11.415   3.453
  432   2HB   GLU  48           HB1      GLU  48  60.445 -11.265   3.943
  433   1HG   GLU  48           HG2      GLU  48  59.771 -13.096   2.649
  434   2HG   GLU  48           HG1      GLU  48  61.179 -12.990   1.592
  435    H    LYS  49           HN       LYS  49  59.243 -11.545   0.355
  436    HA   LYS  49           HA       LYS  49  57.097  -9.708   0.347
  437   1HB   LYS  49           HB2      LYS  49  57.609 -11.898  -1.078
  438   2HB   LYS  49           HB1      LYS  49  56.487 -12.618   0.077
  439   1HG   LYS  49           HG2      LYS  49  55.661 -10.013  -1.084
  440   2HG   LYS  49           HG1      LYS  49  55.677 -11.383  -2.194
  441   1HD   LYS  49           HD2      LYS  49  54.486 -12.459   0.061
  442   2HD   LYS  49           HD1      LYS  49  53.860 -10.810   0.047
  443   1HE   LYS  49           HE2      LYS  49  53.270 -11.157  -2.391
  444   2HE   LYS  49           HE1      LYS  49  53.682 -12.859  -2.177
  445   1HZ   LYS  49           HZ3      LYS  49  51.804 -11.563  -0.319
  446   2HZ   LYS  49           HZ2      LYS  49  51.255 -12.084  -1.841
  447   3HZ   LYS  49           HZ1      LYS  49  51.929 -13.198  -0.750
  448    H    ASP  50           HN       ASP  50  57.984 -12.023   2.786
  449    HA   ASP  50           HA       ASP  50  55.358 -12.250   3.986
  450   1HB   ASP  50           HB2      ASP  50  58.098 -13.180   4.567
  451   2HB   ASP  50           HB1      ASP  50  57.127 -12.860   6.004
  452    H    VAL  51           HN       VAL  51  58.189 -10.118   4.559
  453    HA   VAL  51           HA       VAL  51  56.865  -8.910   6.885
  454    HB   VAL  51           HB       VAL  51  59.336  -9.043   6.766
  455   1HG1  VAL  51          HG12      VAL  51  58.850  -7.873   4.153
  456   2HG1  VAL  51          HG11      VAL  51  60.013  -6.913   5.063
  457   3HG1  VAL  51          HG13      VAL  51  60.313  -8.627   4.779
  458   1HG2  VAL  51          HG22      VAL  51  58.067  -6.295   6.810
  459   2HG2  VAL  51          HG21      VAL  51  58.480  -7.320   8.184
  460   3HG2  VAL  51          HG23      VAL  51  59.758  -6.563   7.234
  461    H    VAL  52           HN       VAL  52  56.982  -8.397   3.444
  462    HA   VAL  52           HA       VAL  52  56.081  -5.652   3.533
  463    HB   VAL  52           HB       VAL  52  57.233  -7.127   1.591
  464   1HG1  VAL  52          HG12      VAL  52  55.020  -8.455   1.378
  465   2HG1  VAL  52          HG11      VAL  52  54.410  -7.015   0.565
  466   3HG1  VAL  52          HG13      VAL  52  55.797  -7.880  -0.097
  467   1HG2  VAL  52          HG21      VAL  52  56.424  -4.574   1.873
  468   2HG2  VAL  52          HG23      VAL  52  57.093  -5.209   0.373
  469   3HG2  VAL  52          HG22      VAL  52  55.346  -5.079   0.573
  470    NH1  ARG  53           NH2      ARG  53  49.707 -13.603   2.027
  471    NH2  ARG  53           NH1      ARG  53  48.379 -13.379   3.841
  472    H    ARG  53           HN       ARG  53  54.524  -8.813   3.417
  473    HA   ARG  53           HA       ARG  53  51.865  -7.746   2.916
  474   1HB   ARG  53           HB2      ARG  53  52.672 -10.119   2.422
  475   2HB   ARG  53           HB1      ARG  53  52.521 -10.425   4.151
  476   1HG   ARG  53           HG2      ARG  53  50.122  -9.120   3.237
  477   2HG   ARG  53           HG1      ARG  53  50.461 -10.487   2.179
  478   1HD   ARG  53           HD2      ARG  53  50.637 -10.813   5.164
  479   2HD   ARG  53           HD1      ARG  53  49.074 -10.896   4.353
  480    HE   ARG  53           HE       ARG  53  51.312 -12.811   3.982
  481   1HH1  ARG  53          HH21      ARG  53  50.570 -13.417   1.557
  482   2HH1  ARG  53          HH22      ARG  53  49.000 -14.148   1.577
  483   1HH2  ARG  53          HH11      ARG  53  48.223 -13.021   4.762
  484   2HH2  ARG  53          HH12      ARG  53  47.671 -13.924   3.391
  485    H    VAL  54           HN       VAL  54  53.563  -8.938   5.831
  486    HA   VAL  54           HA       VAL  54  51.398  -8.600   7.654
  487    HB   VAL  54           HB       VAL  54  54.332  -8.175   8.290
  488   1HG1  VAL  54          HG11      VAL  54  51.923  -9.057   9.903
  489   2HG1  VAL  54          HG13      VAL  54  53.584  -9.188  10.483
  490   3HG1  VAL  54          HG12      VAL  54  52.894  -7.603  10.136
  491   1HG2  VAL  54          HG22      VAL  54  53.189 -10.457   7.103
  492   2HG2  VAL  54          HG21      VAL  54  54.742 -10.368   7.930
  493   3HG2  VAL  54          HG23      VAL  54  53.298 -10.851   8.817
  494    CH2  TRP  55           CH2      TRP  55  54.047   1.034   4.394
  495    H    TRP  55           HN       TRP  55  53.979  -6.286   6.733
  496    HA   TRP  55           HA       TRP  55  52.936  -4.200   8.432
  497   1HB   TRP  55           HB2      TRP  55  55.249  -4.073   7.649
  498   2HB   TRP  55           HB1      TRP  55  54.708  -4.017   5.972
  499    HD1  TRP  55           HD1      TRP  55  54.243  -1.933   9.236
  500    HE1  TRP  55           HE1      TRP  55  53.989   0.518   8.573
  501    HE3  TRP  55           HE3      TRP  55  54.368  -2.338   4.110
  502    HZ2  TRP  55           HZ2      TRP  55  53.914   2.127   6.240
  503    HZ3  TRP  55           HZ3      TRP  55  54.195  -0.315   2.733
  504    HH2  TRP  55           HH2      TRP  55  53.970   1.908   3.779
  505    H    PHE  56           HN       PHE  56  52.306  -5.178   5.064
  506    HA   PHE  56           HA       PHE  56  50.608  -2.840   4.645
  507   1HB   PHE  56           HB2      PHE  56  51.572  -5.044   2.945
  508   2HB   PHE  56           HB1      PHE  56  49.934  -4.510   2.577
  509    HD1  PHE  56           HD1      PHE  56  49.788  -1.735   2.981
  510    HD2  PHE  56           HD2      PHE  56  53.167  -3.995   1.584
  511    HE1  PHE  56           HE1      PHE  56  50.707   0.299   1.917
  512    HE2  PHE  56           HE2      PHE  56  54.080  -1.953   0.514
  513    HZ   PHE  56           HZ       PHE  56  52.856   0.192   0.705
  514    H    CYS  57           HN       CYS  57  50.127  -5.651   6.364
  515    HA   CYS  57           HA       CYS  57  47.300  -5.998   5.650
  516   1HB   CYS  57           HB2      CYS  57  48.990  -7.731   6.790
  517   2HB   CYS  57           HB1      CYS  57  48.443  -6.938   8.266
  518    HG   CYS  57           HG       CYS  57  45.923  -7.521   7.175
  519    H    ASN  58           HN       ASN  58  49.309  -4.457   8.087
  520    HA   ASN  58           HA       ASN  58  46.978  -3.235   9.424
  521   1HB   ASN  58           HB2      ASN  58  49.773  -3.706  10.059
  522   2HB   ASN  58           HB1      ASN  58  49.370  -2.010  10.320
  523   1HD2  ASN  58          HD22      ASN  58  47.060  -4.706  12.412
  524   2HD2  ASN  58          HD21      ASN  58  47.434  -5.028  10.788
  525    NH1  ARG  59           NH1      ARG  59  51.587   3.358   7.815
  526    NH2  ARG  59           NH2      ARG  59  49.718   4.366   8.588
  527    H    ARG  59           HN       ARG  59  49.180  -2.503   6.819
  528    HA   ARG  59           HA       ARG  59  48.698   0.394   7.005
  529   1HB   ARG  59           HB2      ARG  59  50.701  -1.197   5.702
  530   2HB   ARG  59           HB1      ARG  59  49.854  -0.298   4.447
  531   1HG   ARG  59           HG2      ARG  59  51.234   0.832   6.907
  532   2HG   ARG  59           HG1      ARG  59  51.683   1.052   5.220
  533   1HD   ARG  59           HD2      ARG  59  50.492   2.976   5.325
  534   2HD   ARG  59           HD1      ARG  59  49.073   1.937   5.229
  535    HE   ARG  59           HE       ARG  59  48.713   2.267   7.569
  536   1HH1  ARG  59          HH11      ARG  59  52.025   2.651   7.262
  537   2HH1  ARG  59          HH12      ARG  59  52.146   4.002   8.336
  538   1HH2  ARG  59          HH21      ARG  59  48.720   4.430   8.626
  539   2HH2  ARG  59          HH22      ARG  59  50.281   5.007   9.108
  540    NH1  ARG  60           NH1      ARG  60  43.179  -6.745   3.223
  541    NH2  ARG  60           NH2      ARG  60  44.198  -7.263   1.272
  542    H    ARG  60           HN       ARG  60  47.278  -2.379   5.490
  543    HA   ARG  60           HA       ARG  60  45.836  -0.733   3.502
  544   1HB   ARG  60           HB2      ARG  60  44.872  -2.848   2.731
  545   2HB   ARG  60           HB1      ARG  60  46.618  -3.026   2.888
  546   1HG   ARG  60           HG2      ARG  60  46.162  -3.966   5.231
  547   2HG   ARG  60           HG1      ARG  60  44.471  -4.057   4.753
  548   1HD   ARG  60           HD2      ARG  60  46.799  -5.411   3.360
  549   2HD   ARG  60           HD1      ARG  60  45.556  -6.206   4.327
  550    HE   ARG  60           HE       ARG  60  44.914  -4.770   1.782
  551   1HH1  ARG  60          HH11      ARG  60  43.095  -6.154   4.026
  552   2HH1  ARG  60          HH12      ARG  60  42.566  -7.527   3.113
  553   1HH2  ARG  60          HH21      ARG  60  44.895  -7.070   0.581
  554   2HH2  ARG  60          HH22      ARG  60  43.587  -8.046   1.160
  555    H    GLN  61           HN       GLN  61  45.373  -2.232   6.625
  556    HA   GLN  61           HA       GLN  61  42.701  -0.936   6.809
  557   1HB   GLN  61           HB2      GLN  61  42.340  -3.335   6.324
  558   2HB   GLN  61           HB1      GLN  61  43.369  -3.769   7.686
  559   1HG   GLN  61           HG2      GLN  61  41.642  -3.576   9.109
  560   2HG   GLN  61           HG1      GLN  61  41.349  -1.918   8.587
  561   1HE2  GLN  61          HE22      GLN  61  39.418  -4.775   6.340
  562   2HE2  GLN  61          HE21      GLN  61  41.056  -4.992   6.728
  563    H    LYS  62           HN       LYS  62  44.438   0.546   7.875
  564    HA   LYS  62           HA       LYS  62  45.422  -0.302  10.493
  565   1HB   LYS  62           HB2      LYS  62  46.161   2.077  10.677
  566   2HB   LYS  62           HB1      LYS  62  46.727   1.296   9.201
  567   1HG   LYS  62           HG2      LYS  62  45.354   2.552   7.845
  568   2HG   LYS  62           HG1      LYS  62  44.097   2.693   9.075
  569   1HD   LYS  62           HD2      LYS  62  45.287   4.391  10.247
  570   2HD   LYS  62           HD1      LYS  62  46.773   4.071   9.352
  571   1HE   LYS  62           HE2      LYS  62  44.268   4.954   7.925
  572   2HE   LYS  62           HE1      LYS  62  45.358   6.132   8.655
  573   1HZ   LYS  62           HZ1      LYS  62  47.179   5.115   7.367
  574   2HZ   LYS  62           HZ3      LYS  62  46.049   4.115   6.590
  575   3HZ   LYS  62           HZ2      LYS  62  45.974   5.800   6.384
  576    H    GLY  63           HN       GLY  63  42.478   1.063   9.309
  577   1HA   GLY  63           HA2      GLY  63  41.722   2.519  11.685
  578   2HA   GLY  63           HA1      GLY  63  40.631   2.006  10.401
  579    H    LYS  64           HN       LYS  64  42.057  -0.824  11.182
  580    HA   LYS  64           HA       LYS  64  39.860  -1.517  13.046
  581   1HB   LYS  64           HB2      LYS  64  41.088  -2.822  10.847
  582   2HB   LYS  64           HB1      LYS  64  41.492  -3.775  12.271
  583   1HG   LYS  64           HG2      LYS  64  38.797  -3.149  12.639
  584   2HG   LYS  64           HG1      LYS  64  38.920  -3.465  10.910
  585   1HD   LYS  64           HD2      LYS  64  39.957  -5.314  13.081
  586   2HD   LYS  64           HD1      LYS  64  38.434  -5.530  12.219
  587   1HE   LYS  64           HE2      LYS  64  39.523  -5.947  10.160
  588   2HE   LYS  64           HE1      LYS  64  41.048  -5.271  10.734
  589   1HZ   LYS  64           HZ1      LYS  64  41.014  -7.133  12.424
  590   2HZ   LYS  64           HZ3      LYS  64  39.786  -7.839  11.490
  591   3HZ   LYS  64           HZ2      LYS  64  41.323  -7.578  10.814
  592    NH1  ARG  65           NH2      ARG  65  48.137  -4.299  16.477
  593    NH2  ARG  65           NH1      ARG  65  46.945  -6.183  16.850
  594    H    ARG  65           HN       ARG  65  42.212  -0.022  13.999
  595    HA   ARG  65           HA       ARG  65  43.105  -1.986  16.059
  596   1HB   ARG  65           HB2      ARG  65  44.803  -0.285  14.273
  597   2HB   ARG  65           HB1      ARG  65  45.333  -0.541  15.936
  598   1HG   ARG  65           HG2      ARG  65  44.498  -2.837  14.159
  599   2HG   ARG  65           HG1      ARG  65  46.158  -2.242  14.196
  600   1HD   ARG  65           HD2      ARG  65  46.230  -2.619  16.642
  601   2HD   ARG  65           HD1      ARG  65  44.585  -3.249  16.586
  602    HE   ARG  65           HE       ARG  65  45.627  -4.988  14.936
  603   1HH1  ARG  65          HH21      ARG  65  48.208  -3.383  16.082
  604   2HH1  ARG  65          HH22      ARG  65  48.907  -4.686  16.984
  605   1HH2  ARG  65          HH11      ARG  65  46.104  -6.711  16.740
  606   2HH2  ARG  65          HH12      ARG  65  47.716  -6.570  17.357
  607    H    SER  66           HN       SER  66  42.924   1.457  15.136
  608    HA   SER  66           HA       SER  66  42.814   2.186  18.018
  609   1HB   SER  66           HB2      SER  66  43.262   3.763  15.483
  610   2HB   SER  66           HB1      SER  66  42.875   4.562  17.003
  611    HG   SER  66           HG       SER  66  45.138   3.084  16.257
  612    H    SER  67           HN       SER  67  40.608   1.118  18.039
  613    HA   SER  67           HA       SER  67  38.525   3.019  17.032
  614   1HB   SER  67           HB2      SER  67  38.683   0.047  17.001
  615   2HB   SER  67           HB1      SER  67  37.109   0.753  17.362
  616    HG   SER  67           HG       SER  67  37.288   0.568  15.151
   
  Start of MODEL           4
 Raw file had  616 H/Q atoms
  Start of MODEL    4
    1   1H    MET   1           HT1      MET   1  31.650   9.019  15.181
    2   2H    MET   1           HT3      MET   1  31.347   9.950  16.566
    3   3H    MET   1           HT2      MET   1  31.219  10.656  15.026
    4    HA   MET   1           HA       MET   1  33.259  11.421  15.775
    5   1HB   MET   1           HB2      MET   1  34.913   9.850  16.821
    6   2HB   MET   1           HB1      MET   1  33.438  10.042  17.769
    7   1HG   MET   1           HG2      MET   1  32.607   7.931  17.128
    8   2HG   MET   1           HG1      MET   1  33.695   7.823  15.745
    9   1HE   MET   1           HE2      MET   1  32.753   6.157  18.250
   10   2HE   MET   1           HE1      MET   1  33.913   5.090  17.464
   11   3HE   MET   1           HE3      MET   1  34.084   5.475  19.182
   12    H    GLU   2           HN       GLU   2  35.529  10.914  14.851
   13    HA   GLU   2           HA       GLU   2  36.821  10.454  12.954
   14   1HB   GLU   2           HB2      GLU   2  35.075   7.976  13.006
   15   2HB   GLU   2           HB1      GLU   2  36.451   8.183  11.924
   16   1HG   GLU   2           HG2      GLU   2  36.881   8.689  14.838
   17   2HG   GLU   2           HG1      GLU   2  36.732   7.014  14.304
   18    H    THR   3           HN       THR   3  34.692  12.214  12.536
   19    HA   THR   3           HA       THR   3  33.450  11.378   9.966
   20    HB   THR   3           HB       THR   3  32.474  13.874  10.400
   21    HG1  THR   3           HG1      THR   3  32.132  14.037  12.656
   22   1HG2  THR   3          HG21      THR   3  31.177  11.789  10.077
   23   2HG2  THR   3          HG23      THR   3  31.489  11.349  11.757
   24   3HG2  THR   3          HG22      THR   3  30.517  12.773  11.384
   25    H    LEU   4           HN       LEU   4  34.747  14.504  11.110
   26    HA   LEU   4           HA       LEU   4  36.362  14.632   8.597
   27   1HB   LEU   4           HB2      LEU   4  34.166  16.196   9.070
   28   2HB   LEU   4           HB1      LEU   4  35.447  17.206   9.741
   29    HG   LEU   4           HG       LEU   4  35.786  15.926   7.037
   30   1HD1  LEU   4          HD11      LEU   4  33.603  17.448   7.469
   31   2HD1  LEU   4          HD13      LEU   4  34.787  18.726   7.188
   32   3HD1  LEU   4          HD12      LEU   4  34.508  17.496   5.955
   33   1HD2  LEU   4          HD23      LEU   4  37.726  16.986   8.145
   34   2HD2  LEU   4          HD22      LEU   4  37.253  17.887   6.706
   35   3HD2  LEU   4          HD21      LEU   4  36.813  18.487   8.306
   36    H    VAL   5           HN       VAL   5  37.284  13.702  11.146
   37    HA   VAL   5           HA       VAL   5  39.368  15.754  11.651
   38    HB   VAL   5           HB       VAL   5  37.642  16.113  13.375
   39   1HG1  VAL   5          HG11      VAL   5  37.988  13.150  13.749
   40   2HG1  VAL   5          HG13      VAL   5  37.495  14.156  15.110
   41   3HG1  VAL   5          HG12      VAL   5  36.504  14.096  13.654
   42   1HG2  VAL   5          HG23      VAL   5  40.289  15.996  13.791
   43   2HG2  VAL   5          HG22      VAL   5  39.155  16.344  15.096
   44   3HG2  VAL   5          HG21      VAL   5  39.794  14.713  14.895
   45    H    GLN   6           HN       GLN   6  39.799  13.541  10.128
   46    HA   GLN   6           HA       GLN   6  41.241  11.657  11.955
   47   1HB   GLN   6           HB2      GLN   6  39.295  10.869  10.347
   48   2HB   GLN   6           HB1      GLN   6  40.558  10.942   9.120
   49   1HG   GLN   6           HG2      GLN   6  41.386   9.613  11.623
   50   2HG   GLN   6           HG1      GLN   6  40.099   8.780  10.753
   51   1HE2  GLN   6          HE22      GLN   6  43.824   8.402   9.405
   52   2HE2  GLN   6          HE21      GLN   6  43.422   8.929  10.967
   53    H    ALA   7           HN       ALA   7  41.449  12.608   8.501
   54    HA   ALA   7           HA       ALA   7  44.337  12.354   8.520
   55   1HB   ALA   7           HB1      ALA   7  42.290  13.249   6.506
   56   2HB   ALA   7           HB3      ALA   7  44.005  13.532   6.206
   57   3HB   ALA   7           HB2      ALA   7  43.407  11.886   6.418
   58    NH1  ARG   8           NH2      ARG   8  45.116  13.415  14.423
   59    NH2  ARG   8           NH1      ARG   8  43.046  12.919  15.184
   60    H    ARG   8           HN       ARG   8  44.934  13.876  10.196
   61    HA   ARG   8           HA       ARG   8  44.320  16.712   9.719
   62   1HB   ARG   8           HB2      ARG   8  45.427  15.129  12.000
   63   2HB   ARG   8           HB1      ARG   8  45.797  16.852  11.910
   64   1HG   ARG   8           HG2      ARG   8  43.582  17.485  12.179
   65   2HG   ARG   8           HG1      ARG   8  42.962  15.980  11.500
   66   1HD   ARG   8           HD2      ARG   8  44.462  16.014  14.117
   67   2HD   ARG   8           HD1      ARG   8  42.726  16.316  14.051
   68    HE   ARG   8           HE       ARG   8  42.752  14.009  12.744
   69   1HH1  ARG   8          HH21      ARG   8  45.710  13.911  13.791
   70   2HH1  ARG   8          HH22      ARG   8  45.514  12.801  15.105
   71   1HH2  ARG   8          HH11      ARG   8  42.054  13.036  15.134
   72   2HH2  ARG   8          HH12      ARG   8  43.443  12.305  15.866
   73    H    LYS   9           HN       LYS   9  47.245  14.702  10.211
   74    HA   LYS   9           HA       LYS   9  48.672  16.387   8.277
   75   1HB   LYS   9           HB2      LYS   9  50.575  16.744   9.850
   76   2HB   LYS   9           HB1      LYS   9  49.100  17.552  10.378
   77   1HG   LYS   9           HG2      LYS   9  48.901  15.009  11.512
   78   2HG   LYS   9           HG1      LYS   9  50.610  15.409  11.675
   79   1HD   LYS   9           HD2      LYS   9  49.284  17.778  12.368
   80   2HD   LYS   9           HD1      LYS   9  48.309  16.506  13.100
   81   1HE   LYS   9           HE2      LYS   9  49.892  16.045  14.650
   82   2HE   LYS   9           HE1      LYS   9  51.186  16.061  13.453
   83   1HZ   LYS   9           HZ2      LYS   9  49.917  18.470  14.639
   84   2HZ   LYS   9           HZ1      LYS   9  51.430  17.838  15.084
   85   3HZ   LYS   9           HZ3      LYS   9  51.198  18.462  13.524
   86    NH1  ARG  10           NH2      ARG  10  49.407  10.751  13.750
   87    NH2  ARG  10           NH1      ARG  10  50.867   9.035  13.573
   88    H    ARG  10           HN       ARG  10  47.815  13.672   8.154
   89    HA   ARG  10           HA       ARG  10  50.386  12.398   7.626
   90   1HB   ARG  10           HB2      ARG  10  48.511  11.431   9.777
   91   2HB   ARG  10           HB1      ARG  10  49.565  10.303   8.924
   92   1HG   ARG  10           HG2      ARG  10  51.408  12.136   9.502
   93   2HG   ARG  10           HG1      ARG  10  50.282  12.514  10.806
   94   1HD   ARG  10           HD2      ARG  10  51.474   9.788  10.218
   95   2HD   ARG  10           HD1      ARG  10  51.911  10.841  11.563
   96    HE   ARG  10           HE       ARG  10  49.186   9.636  11.265
   97   1HH1  ARG  10          HH21      ARG  10  48.811  11.429  13.320
   98   2HH1  ARG  10          HH22      ARG  10  49.480  10.710  14.746
   99   1HH2  ARG  10          HH11      ARG  10  51.391   8.399  13.007
  100   2HH2  ARG  10          HH12      ARG  10  50.940   8.995  14.569
  101    H    LYS  11           HN       LYS  11  49.339  12.703   5.480
  102    HA   LYS  11           HA       LYS  11  47.016  11.000   4.920
  103   1HB   LYS  11           HB2      LYS  11  47.514  13.368   3.923
  104   2HB   LYS  11           HB1      LYS  11  48.568  12.484   2.818
  105   1HG   LYS  11           HG2      LYS  11  46.801  11.328   1.837
  106   2HG   LYS  11           HG1      LYS  11  45.770  11.497   3.258
  107   1HD   LYS  11           HD2      LYS  11  44.767  13.114   1.987
  108   2HD   LYS  11           HD1      LYS  11  46.085  14.108   2.608
  109   1HE   LYS  11           HE2      LYS  11  47.436  13.558   0.612
  110   2HE   LYS  11           HE1      LYS  11  46.107  12.583  -0.015
  111   1HZ   LYS  11           HZ3      LYS  11  45.664  15.398   0.730
  112   2HZ   LYS  11           HZ2      LYS  11  46.341  15.012  -0.780
  113   3HZ   LYS  11           HZ1      LYS  11  44.798  14.434  -0.363
  114    NH1  ARG  12           NH2      ARG  12  53.160  11.541   2.695
  115    NH2  ARG  12           NH1      ARG  12  53.609  12.856   4.480
  116    H    ARG  12           HN       ARG  12  48.645   9.191   5.676
  117    HA   ARG  12           HA       ARG  12  49.891   8.067   3.206
  118   1HB   ARG  12           HB2      ARG  12  50.994   8.071   6.029
  119   2HB   ARG  12           HB1      ARG  12  51.615   7.029   4.749
  120   1HG   ARG  12           HG2      ARG  12  53.024   8.829   4.455
  121   2HG   ARG  12           HG1      ARG  12  51.693   9.351   3.422
  122   1HD   ARG  12           HD2      ARG  12  50.848  10.268   5.854
  123   2HD   ARG  12           HD1      ARG  12  52.597  10.431   6.022
  124    HE   ARG  12           HE       ARG  12  50.910  12.063   4.336
  125   1HH1  ARG  12          HH21      ARG  12  52.569  10.879   2.235
  126   2HH1  ARG  12          HH22      ARG  12  53.997  11.859   2.249
  127   1HH2  ARG  12          HH11      ARG  12  53.361  13.199   5.386
  128   2HH2  ARG  12          HH12      ARG  12  54.446  13.175   4.036
  129    H    THR  13           HN       THR  13  47.272   7.518   3.986
  130    HA   THR  13           HA       THR  13  47.176   5.088   5.596
  131    HB   THR  13           HB       THR  13  44.788   5.048   4.790
  132    HG1  THR  13           HG1      THR  13  45.155   6.078   2.804
  133   1HG2  THR  13          HG22      THR  13  46.061   7.348   6.197
  134   2HG2  THR  13          HG21      THR  13  44.357   7.491   5.767
  135   3HG2  THR  13          HG23      THR  13  44.897   6.168   6.801
  136    H    SER  14           HN       SER  14  47.331   5.944   2.190
  137    HA   SER  14           HA       SER  14  47.318   3.035   1.503
  138   1HB   SER  14           HB2      SER  14  46.069   5.377   0.259
  139   2HB   SER  14           HB1      SER  14  46.997   4.412  -0.885
  140    HG   SER  14           HG       SER  14  44.717   3.798  -0.455
  141    H    ILE  15           HN       ILE  15  48.525   2.981  -0.875
  142    HA   ILE  15           HA       ILE  15  51.311   3.612  -0.234
  143    HB   ILE  15           HB       ILE  15  49.982   2.271  -2.601
  144   1HG1  ILE  15          HG12      ILE  15  49.939   1.018  -0.475
  145   2HG1  ILE  15          HG11      ILE  15  51.016   0.241  -1.636
  146   1HG2  ILE  15          HG22      ILE  15  52.887   2.893  -2.066
  147   2HG2  ILE  15          HG21      ILE  15  52.415   1.510  -3.053
  148   3HG2  ILE  15          HG23      ILE  15  51.966   3.142  -3.550
  149   1HD1  ILE  15          HD11      ILE  15  52.928   1.527  -0.547
  150   2HD1  ILE  15          HD13      ILE  15  51.798   1.980   0.725
  151   3HD1  ILE  15          HD12      ILE  15  52.195   0.288   0.464
  152    H    GLU  16           HN       GLU  16  51.269   5.881  -0.191
  153    HA   GLU  16           HA       GLU  16  50.415   7.481  -2.404
  154   1HB   GLU  16           HB2      GLU  16  51.350   7.944   0.206
  155   2HB   GLU  16           HB1      GLU  16  52.559   8.684  -0.841
  156   1HG   GLU  16           HG2      GLU  16  50.815  10.318  -0.330
  157   2HG   GLU  16           HG1      GLU  16  50.739   9.893  -2.039
  158    H    ASN  17           HN       ASN  17  51.822   8.532  -3.955
  159    HA   ASN  17           HA       ASN  17  53.801   6.816  -5.085
  160   1HB   ASN  17           HB2      ASN  17  52.832   9.581  -5.586
  161   2HB   ASN  17           HB1      ASN  17  54.455   9.214  -6.174
  162   1HD2  ASN  17          HD22      ASN  17  53.229   7.424  -8.935
  163   2HD2  ASN  17          HD21      ASN  17  54.500   8.299  -8.228
  164    NH1  ARG  18           NH2      ARG  18  58.049  13.426   0.524
  165    NH2  ARG  18           NH1      ARG  18  56.588  15.152   0.567
  166    H    ARG  18           HN       ARG  18  53.970   9.113  -2.508
  167    HA   ARG  18           HA       ARG  18  56.884   9.413  -2.703
  168   1HB   ARG  18           HB2      ARG  18  54.712  10.513  -0.967
  169   2HB   ARG  18           HB1      ARG  18  56.345  10.453  -0.300
  170   1HG   ARG  18           HG2      ARG  18  57.219  11.837  -2.013
  171   2HG   ARG  18           HG1      ARG  18  55.807  11.594  -3.041
  172   1HD   ARG  18           HD2      ARG  18  55.816  13.836  -1.953
  173   2HD   ARG  18           HD1      ARG  18  54.413  12.870  -1.496
  174    HE   ARG  18           HE       ARG  18  55.401  12.553   0.698
  175   1HH1  ARG  18          HH21      ARG  18  58.240  12.456   0.373
  176   2HH1  ARG  18          HH22      ARG  18  58.788  14.045   0.792
  177   1HH2  ARG  18          HH11      ARG  18  55.660  15.504   0.451
  178   2HH2  ARG  18          HH12      ARG  18  57.327  15.771   0.836
  179    H    VAL  19           HN       VAL  19  54.500   7.476  -0.976
  180    HA   VAL  19           HA       VAL  19  56.318   6.470   1.011
  181    HB   VAL  19           HB       VAL  19  53.627   6.249   0.768
  182   1HG1  VAL  19          HG11      VAL  19  54.703   3.568  -0.197
  183   2HG1  VAL  19          HG13      VAL  19  53.082   3.828   0.428
  184   3HG1  VAL  19          HG12      VAL  19  53.587   4.624  -1.060
  185   1HG2  VAL  19          HG21      VAL  19  55.317   5.723   2.672
  186   2HG2  VAL  19          HG23      VAL  19  53.759   4.896   2.701
  187   3HG2  VAL  19          HG22      VAL  19  55.195   4.053   2.120
  188    NH1  ARG  20           NH2      ARG  20  51.946   2.304  -6.848
  189    NH2  ARG  20           NH1      ARG  20  53.573   1.021  -7.755
  190    H    ARG  20           HN       ARG  20  55.293   5.252  -2.163
  191    HA   ARG  20           HA       ARG  20  56.838   2.869  -2.190
  192   1HB   ARG  20           HB2      ARG  20  55.854   4.725  -4.339
  193   2HB   ARG  20           HB1      ARG  20  56.949   3.409  -4.760
  194   1HG   ARG  20           HG2      ARG  20  55.153   2.082  -3.200
  195   2HG   ARG  20           HG1      ARG  20  54.115   3.315  -3.916
  196   1HD   ARG  20           HD2      ARG  20  56.000   1.919  -5.751
  197   2HD   ARG  20           HD1      ARG  20  54.626   0.986  -5.158
  198    HE   ARG  20           HE       ARG  20  54.201   3.643  -6.457
  199   1HH1  ARG  20          HH21      ARG  20  51.668   3.054  -6.248
  200   2HH1  ARG  20          HH22      ARG  20  51.255   1.785  -7.352
  201   1HH2  ARG  20          HH11      ARG  20  54.541   0.789  -7.849
  202   2HH2  ARG  20          HH12      ARG  20  52.883   0.502  -8.259
  203    CH2  TRP  21           CH2      TRP  21  59.828   3.423  -8.221
  204    H    TRP  21           HN       TRP  21  57.784   6.076  -3.468
  205    HA   TRP  21           HA       TRP  21  60.459   5.112  -3.932
  206   1HB   TRP  21           HB2      TRP  21  59.045   7.662  -4.307
  207   2HB   TRP  21           HB1      TRP  21  60.741   7.861  -3.847
  208    HD1  TRP  21           HD1      TRP  21  61.703   8.447  -6.236
  209    HE1  TRP  21           HE1      TRP  21  62.016   7.063  -8.395
  210    HE3  TRP  21           HE3      TRP  21  58.784   4.398  -5.162
  211    HZ2  TRP  21           HZ2      TRP  21  61.141   4.542  -9.495
  212    HZ3  TRP  21           HZ3      TRP  21  58.546   2.538  -6.727
  213    HH2  TRP  21           HH2      TRP  21  59.733   2.597  -8.909
  214    H    SER  22           HN       SER  22  58.810   6.022  -1.097
  215    HA   SER  22           HA       SER  22  61.076   6.890   0.470
  216   1HB   SER  22           HB2      SER  22  58.415   6.844   0.992
  217   2HB   SER  22           HB1      SER  22  58.880   5.332   1.765
  218    HG   SER  22           HG       SER  22  60.035   7.893   2.206
  219    H    LEU  23           HN       LEU  23  59.509   3.832  -0.372
  220    HA   LEU  23           HA       LEU  23  61.070   2.003   1.168
  221   1HB   LEU  23           HB2      LEU  23  59.998   1.666  -1.662
  222   2HB   LEU  23           HB1      LEU  23  60.548   0.365  -0.641
  223    HG   LEU  23           HG       LEU  23  58.395   2.124   0.436
  224   1HD1  LEU  23          HD13      LEU  23  58.062   1.305  -2.102
  225   2HD1  LEU  23          HD12      LEU  23  57.607  -0.192  -1.289
  226   3HD1  LEU  23          HD11      LEU  23  56.729   1.299  -0.948
  227   1HD2  LEU  23          HD21      LEU  23  59.362  -0.710   0.670
  228   2HD2  LEU  23          HD23      LEU  23  58.915   0.423   1.946
  229   3HD2  LEU  23          HD22      LEU  23  57.662  -0.381   1.001
  230    H    GLU  24           HN       GLU  24  61.488   3.434  -2.028
  231    HA   GLU  24           HA       GLU  24  63.916   2.230  -2.833
  232   1HB   GLU  24           HB2      GLU  24  62.279   4.007  -3.976
  233   2HB   GLU  24           HB1      GLU  24  63.491   5.141  -3.382
  234   1HG   GLU  24           HG2      GLU  24  65.124   3.284  -4.473
  235   2HG   GLU  24           HG1      GLU  24  63.715   3.075  -5.511
  236    H    THR  25           HN       THR  25  63.372   5.003  -0.698
  237    HA   THR  25           HA       THR  25  66.127   5.804  -0.510
  238    HB   THR  25           HB       THR  25  64.063   6.252   1.641
  239    HG1  THR  25           HG1      THR  25  62.995   7.522   0.350
  240   1HG2  THR  25          HG23      THR  25  66.519   7.662   0.619
  241   2HG2  THR  25          HG22      THR  25  65.281   8.548   1.509
  242   3HG2  THR  25          HG21      THR  25  66.119   7.196   2.272
  243    H    MET  26           HN       MET  26  64.099   3.755   1.585
  244    HA   MET  26           HA       MET  26  66.261   3.285   3.469
  245   1HB   MET  26           HB2      MET  26  63.516   2.109   3.080
  246   2HB   MET  26           HB1      MET  26  64.637   1.439   4.266
  247   1HG   MET  26           HG2      MET  26  64.906   3.886   5.084
  248   2HG   MET  26           HG1      MET  26  63.425   4.198   4.178
  249   1HE   MET  26           HE2      MET  26  65.243   3.022   6.920
  250   2HE   MET  26           HE1      MET  26  64.102   2.573   8.186
  251   3HE   MET  26           HE3      MET  26  64.692   1.353   7.048
  252    H    PHE  27           HN       PHE  27  65.431   1.858   0.431
  253    HA   PHE  27           HA       PHE  27  66.775  -0.687   1.089
  254   1HB   PHE  27           HB2      PHE  27  65.186   0.314  -1.253
  255   2HB   PHE  27           HB1      PHE  27  66.311  -1.017  -1.487
  256    HD1  PHE  27           HD2      PHE  27  66.228  -2.851   0.498
  257    HD2  PHE  27           HD1      PHE  27  63.008  -0.251  -0.637
  258    HE1  PHE  27           HE2      PHE  27  64.596  -4.423   1.510
  259    HE2  PHE  27           HE1      PHE  27  61.381  -1.816   0.372
  260    HZ   PHE  27           HZ       PHE  27  62.172  -3.901   1.441
  261    H    LEU  28           HN       LEU  28  67.475   2.338  -0.511
  262    HA   LEU  28           HA       LEU  28  69.786   1.306  -1.950
  263   1HB   LEU  28           HB2      LEU  28  68.879   4.132  -1.359
  264   2HB   LEU  28           HB1      LEU  28  70.230   3.716  -2.418
  265    HG   LEU  28           HG       LEU  28  67.503   2.505  -2.832
  266   1HD1  LEU  28          HD11      LEU  28  67.816   5.204  -2.878
  267   2HD1  LEU  28          HD13      LEU  28  68.298   4.804  -4.526
  268   3HD1  LEU  28          HD12      LEU  28  66.705   4.336  -3.935
  269   1HD2  LEU  28          HD22      LEU  28  70.076   2.764  -4.339
  270   2HD2  LEU  28          HD21      LEU  28  69.011   1.367  -4.169
  271   3HD2  LEU  28          HD23      LEU  28  68.571   2.684  -5.257
  272    H    LYS  29           HN       LYS  29  69.392   1.692   1.297
  273    HA   LYS  29           HA       LYS  29  72.134   2.742   1.754
  274   1HB   LYS  29           HB2      LYS  29  70.910   3.800   3.392
  275   2HB   LYS  29           HB1      LYS  29  69.619   2.611   3.328
  276   1HG   LYS  29           HG2      LYS  29  70.628   1.225   4.924
  277   2HG   LYS  29           HG1      LYS  29  72.251   1.815   4.566
  278   1HD   LYS  29           HD2      LYS  29  71.511   2.676   6.740
  279   2HD   LYS  29           HD1      LYS  29  71.668   4.003   5.587
  280   1HE   LYS  29           HE2      LYS  29  69.267   4.007   5.192
  281   2HE   LYS  29           HE1      LYS  29  69.062   2.587   6.220
  282   1HZ   LYS  29           HZ1      LYS  29  70.172   4.029   7.999
  283   2HZ   LYS  29           HZ3      LYS  29  69.785   5.340   6.994
  284   3HZ   LYS  29           HZ2      LYS  29  68.550   4.349   7.609
  285    H    CYS  30           HN       CYS  30  70.031  -0.013   2.417
  286    HA   CYS  30           HA       CYS  30  72.454  -1.621   3.058
  287   1HB   CYS  30           HB2      CYS  30  69.601  -1.768   4.001
  288   2HB   CYS  30           HB1      CYS  30  70.672  -3.163   4.131
  289    HG   CYS  30           HG       CYS  30  71.324  -2.031   6.264
  290    HA   PRO  31           HA       PRO  31  71.041  -3.758  -0.698
  291   1HB   PRO  31           HB2      PRO  31  73.476  -4.833  -1.331
  292   2HB   PRO  31           HB1      PRO  31  73.040  -3.165  -1.741
  293   1HG   PRO  31           HG2      PRO  31  74.907  -4.152   0.349
  294   2HG   PRO  31           HG1      PRO  31  74.856  -2.573  -0.453
  295   1HD   PRO  31           HD2      PRO  31  73.869  -3.213   2.156
  296   2HD   PRO  31           HD1      PRO  31  73.676  -1.674   1.290
  297    H    LYS  32           HN       LYS  32  71.432  -4.750   2.308
  298    HA   LYS  32           HA       LYS  32  71.641  -7.624   1.667
  299   1HB   LYS  32           HB2      LYS  32  72.517  -7.803   4.065
  300   2HB   LYS  32           HB1      LYS  32  73.597  -7.021   2.912
  301   1HG   LYS  32           HG2      LYS  32  73.200  -4.870   3.792
  302   2HG   LYS  32           HG1      LYS  32  71.656  -5.341   4.504
  303   1HD   LYS  32           HD2      LYS  32  72.899  -6.804   6.114
  304   2HD   LYS  32           HD1      LYS  32  74.412  -6.181   5.454
  305   1HE   LYS  32           HE2      LYS  32  73.184  -3.841   5.945
  306   2HE   LYS  32           HE1      LYS  32  72.398  -4.825   7.180
  307   1HZ   LYS  32           HZ3      LYS  32  75.316  -4.964   6.861
  308   2HZ   LYS  32           HZ2      LYS  32  74.633  -3.650   7.693
  309   3HZ   LYS  32           HZ1      LYS  32  74.373  -5.236   8.243
  310    HA   PRO  33           HA       PRO  33  67.691  -6.460   4.049
  311   1HB   PRO  33           HB2      PRO  33  65.828  -6.873   2.075
  312   2HB   PRO  33           HB1      PRO  33  66.553  -5.293   2.424
  313   1HG   PRO  33           HG2      PRO  33  67.123  -7.176   0.178
  314   2HG   PRO  33           HG1      PRO  33  67.235  -5.407   0.219
  315   1HD   PRO  33           HD2      PRO  33  69.429  -7.152   0.400
  316   2HD   PRO  33           HD1      PRO  33  69.421  -5.448   0.905
  317    H    SER  34           HN       SER  34  66.750  -8.138   5.135
  318    HA   SER  34           HA       SER  34  67.102 -10.880   4.125
  319   1HB   SER  34           HB2      SER  34  67.691 -10.401   6.468
  320   2HB   SER  34           HB1      SER  34  66.043  -9.853   6.762
  321    HG   SER  34           HG       SER  34  66.863 -12.238   7.087
  322    H    LEU  35           HN       LEU  35  65.301 -12.356   3.978
  323    HA   LEU  35           HA       LEU  35  62.951 -11.256   2.766
  324   1HB   LEU  35           HB2      LEU  35  63.626 -13.944   3.966
  325   2HB   LEU  35           HB1      LEU  35  61.995 -13.604   3.384
  326    HG   LEU  35           HG       LEU  35  64.199 -12.827   1.568
  327   1HD1  LEU  35          HD11      LEU  35  64.319 -15.381   2.746
  328   2HD1  LEU  35          HD13      LEU  35  63.567 -15.645   1.171
  329   3HD1  LEU  35          HD12      LEU  35  65.142 -14.861   1.277
  330   1HD2  LEU  35          HD23      LEU  35  61.384 -13.746   1.475
  331   2HD2  LEU  35          HD22      LEU  35  62.221 -12.575   0.455
  332   3HD2  LEU  35          HD21      LEU  35  62.397 -14.302   0.143
  333    H    GLN  36           HN       GLN  36  63.918 -11.751   6.057
  334    HA   GLN  36           HA       GLN  36  61.246 -11.618   7.228
  335   1HB   GLN  36           HB2      GLN  36  64.043 -11.670   8.193
  336   2HB   GLN  36           HB1      GLN  36  62.950 -10.715   9.196
  337   1HG   GLN  36           HG2      GLN  36  62.067 -13.430   8.275
  338   2HG   GLN  36           HG1      GLN  36  63.209 -13.313   9.613
  339   1HE2  GLN  36          HE22      GLN  36  59.832 -13.219  11.140
  340   2HE2  GLN  36          HE21      GLN  36  60.773 -14.354  10.299
  341    H    GLN  37           HN       GLN  37  63.844  -9.356   6.469
  342    HA   GLN  37           HA       GLN  37  62.576  -7.026   7.579
  343   1HB   GLN  37           HB2      GLN  37  65.028  -7.235   6.948
  344   2HB   GLN  37           HB1      GLN  37  64.526  -7.075   5.264
  345   1HG   GLN  37           HG2      GLN  37  63.860  -4.865   5.525
  346   2HG   GLN  37           HG1      GLN  37  63.537  -5.059   7.249
  347   1HE2  GLN  37          HE22      GLN  37  67.445  -4.500   6.063
  348   2HE2  GLN  37          HE21      GLN  37  66.352  -5.223   4.984
  349    H    ILE  38           HN       ILE  38  62.223  -8.765   4.539
  350    HA   ILE  38           HA       ILE  38  60.826  -6.586   3.225
  351    HB   ILE  38           HB       ILE  38  61.211  -9.505   2.523
  352   1HG1  ILE  38          HG12      ILE  38  63.090  -7.972   2.117
  353   2HG1  ILE  38          HG11      ILE  38  62.395  -8.489   0.583
  354   1HG2  ILE  38          HG23      ILE  38  59.152  -7.625   1.510
  355   2HG2  ILE  38          HG22      ILE  38  60.125  -8.379   0.248
  356   3HG2  ILE  38          HG21      ILE  38  59.224  -9.383   1.384
  357   1HD1  ILE  38          HD11      ILE  38  60.909  -6.229   1.173
  358   2HD1  ILE  38          HD13      ILE  38  62.510  -5.802   1.777
  359   3HD1  ILE  38          HD12      ILE  38  62.300  -6.266   0.089
  360    H    THR  39           HN       THR  39  60.002  -9.250   5.300
  361    HA   THR  39           HA       THR  39  57.138  -9.151   4.898
  362    HB   THR  39           HB       THR  39  58.669  -9.951   7.399
  363    HG1  THR  39           HG1      THR  39  57.794 -11.505   5.195
  364   1HG2  THR  39          HG21      THR  39  56.094  -9.523   7.391
  365   2HG2  THR  39          HG23      THR  39  56.018 -11.036   6.486
  366   3HG2  THR  39          HG22      THR  39  56.708 -11.012   8.110
  367    H    HIS  40           HN       HIS  40  59.464  -7.475   6.937
  368    HA   HIS  40           HA       HIS  40  57.465  -5.913   8.390
  369   1HB   HIS  40           HB2      HIS  40  60.476  -5.740   8.136
  370   2HB   HIS  40           HB1      HIS  40  59.532  -4.592   9.085
  371    HD1  HIS  40           HD1      HIS  40  61.224  -5.905  10.952
  372    HD2  HIS  40           HD2      HIS  40  57.846  -7.925   9.573
  373    HE1  HIS  40           HE1      HIS  40  60.745  -7.733  12.636
  374    H    ILE  41           HN       ILE  41  59.138  -5.657   5.349
  375    HA   ILE  41           HA       ILE  41  58.856  -2.795   5.061
  376    HB   ILE  41           HB       ILE  41  59.764  -5.055   3.408
  377   1HG1  ILE  41          HG12      ILE  41  60.941  -2.713   2.483
  378   2HG1  ILE  41          HG11      ILE  41  60.569  -2.336   4.162
  379   1HG2  ILE  41          HG23      ILE  41  58.296  -2.774   2.067
  380   2HG2  ILE  41          HG22      ILE  41  59.490  -3.768   1.233
  381   3HG2  ILE  41          HG21      ILE  41  58.014  -4.502   1.859
  382   1HD1  ILE  41          HD11      ILE  41  61.863  -4.967   3.521
  383   2HD1  ILE  41          HD13      ILE  41  62.850  -3.509   3.533
  384   3HD1  ILE  41          HD12      ILE  41  61.980  -3.996   4.986
  385    H    ALA  42           HN       ALA  42  56.939  -5.639   4.178
  386    HA   ALA  42           HA       ALA  42  54.846  -4.276   2.819
  387   1HB   ALA  42           HB1      ALA  42  55.316  -6.819   2.943
  388   2HB   ALA  42           HB3      ALA  42  54.416  -6.766   4.459
  389   3HB   ALA  42           HB2      ALA  42  53.629  -6.301   2.951
  390    H    ASN  43           HN       ASN  43  55.060  -5.398   6.186
  391    HA   ASN  43           HA       ASN  43  52.649  -4.131   7.065
  392   1HB   ASN  43           HB2      ASN  43  54.974  -5.437   8.281
  393   2HB   ASN  43           HB1      ASN  43  54.385  -4.091   9.255
  394   1HD2  ASN  43          HD22      ASN  43  51.599  -5.890  10.410
  395   2HD2  ASN  43          HD21      ASN  43  52.631  -4.556  10.591
  396    H    GLN  44           HN       GLN  44  55.776  -2.912   6.217
  397    HA   GLN  44           HA       GLN  44  55.680  -0.478   7.741
  398   1HB   GLN  44           HB2      GLN  44  57.464  -1.803   5.896
  399   2HB   GLN  44           HB1      GLN  44  57.381  -0.082   5.553
  400   1HG   GLN  44           HG2      GLN  44  57.954  -1.303   8.272
  401   2HG   GLN  44           HG1      GLN  44  59.177  -0.650   7.181
  402   1HE2  GLN  44          HE22      GLN  44  58.552   2.705   8.072
  403   2HE2  GLN  44          HE21      GLN  44  59.484   1.617   7.161
  404    H    LEU  45           HN       LEU  45  54.591  -1.380   4.478
  405    HA   LEU  45           HA       LEU  45  53.391   1.351   4.321
  406   1HB   LEU  45           HB2      LEU  45  53.851   1.556   1.999
  407   2HB   LEU  45           HB1      LEU  45  55.349   1.019   2.743
  408    HG   LEU  45           HG       LEU  45  53.406  -0.936   1.517
  409   1HD1  LEU  45          HD11      LEU  45  54.850   1.081   0.124
  410   2HD1  LEU  45          HD13      LEU  45  55.696  -0.442  -0.157
  411   3HD1  LEU  45          HD12      LEU  45  53.986  -0.295  -0.558
  412   1HD2  LEU  45          HD21      LEU  45  56.150  -0.946   2.648
  413   2HD2  LEU  45          HD23      LEU  45  54.918  -2.206   2.662
  414   3HD2  LEU  45          HD22      LEU  45  55.889  -1.941   1.215
  415    H    GLY  46           HN       GLY  46  52.341  -1.410   5.109
  416   1HA   GLY  46           HA2      GLY  46  50.378  -2.655   4.833
  417   2HA   GLY  46           HA1      GLY  46  49.675  -1.097   4.428
  418    H    LEU  47           HN       LEU  47  52.135  -2.573   2.351
  419    HA   LEU  47           HA       LEU  47  50.011  -2.838   0.275
  420   1HB   LEU  47           HB2      LEU  47  51.546  -2.349  -1.363
  421   2HB   LEU  47           HB1      LEU  47  52.361  -1.559  -0.032
  422    HG   LEU  47           HG       LEU  47  52.964  -4.285  -1.174
  423   1HD1  LEU  47          HD11      LEU  47  53.794  -1.843  -2.052
  424   2HD1  LEU  47          HD13      LEU  47  55.062  -2.221  -0.887
  425   3HD1  LEU  47          HD12      LEU  47  54.743  -3.318  -2.226
  426   1HD2  LEU  47          HD21      LEU  47  53.671  -3.059   1.410
  427   2HD2  LEU  47          HD23      LEU  47  53.558  -4.754   0.969
  428   3HD2  LEU  47          HD22      LEU  47  54.996  -3.825   0.545
  429    H    GLU  48           HN       GLU  48  50.682  -4.692  -1.381
  430    HA   GLU  48           HA       GLU  48  50.703  -7.185   0.206
  431   1HB   GLU  48           HB2      GLU  48  49.000  -6.846  -1.602
  432   2HB   GLU  48           HB1      GLU  48  50.310  -6.771  -2.778
  433   1HG   GLU  48           HG2      GLU  48  50.505  -9.017  -2.837
  434   2HG   GLU  48           HG1      GLU  48  50.560  -9.126  -1.078
  435    H    LYS  49           HN       LYS  49  52.371  -8.723  -0.046
  436    HA   LYS  49           HA       LYS  49  54.985  -7.780  -0.603
  437   1HB   LYS  49           HB2      LYS  49  54.258  -9.889   0.692
  438   2HB   LYS  49           HB1      LYS  49  54.223 -10.679  -0.885
  439   1HG   LYS  49           HG2      LYS  49  56.654  -9.289  -0.876
  440   2HG   LYS  49           HG1      LYS  49  56.520  -9.932   0.759
  441   1HD   LYS  49           HD2      LYS  49  55.829 -11.770  -1.483
  442   2HD   LYS  49           HD1      LYS  49  57.535 -11.380  -1.254
  443   1HE   LYS  49           HE2      LYS  49  57.162 -11.941   1.225
  444   2HE   LYS  49           HE1      LYS  49  55.636 -12.664   0.713
  445   1HZ   LYS  49           HZ2      LYS  49  56.991 -13.959  -0.936
  446   2HZ   LYS  49           HZ1      LYS  49  58.377 -13.430  -0.107
  447   3HZ   LYS  49           HZ3      LYS  49  57.224 -14.381   0.693
  448    H    ASP  50           HN       ASP  50  52.520  -8.815  -2.810
  449    HA   ASP  50           HA       ASP  50  54.261  -9.656  -4.950
  450   1HB   ASP  50           HB2      ASP  50  51.707 -10.082  -4.636
  451   2HB   ASP  50           HB1      ASP  50  51.514  -8.492  -5.375
  452    H    VAL  51           HN       VAL  51  52.824  -6.509  -4.033
  453    HA   VAL  51           HA       VAL  51  53.928  -5.261  -6.459
  454    HB   VAL  51           HB       VAL  51  51.790  -4.465  -5.505
  455   1HG1  VAL  51          HG13      VAL  51  53.355  -4.459  -3.068
  456   2HG1  VAL  51          HG12      VAL  51  52.623  -2.878  -3.334
  457   3HG1  VAL  51          HG11      VAL  51  51.611  -4.318  -3.268
  458   1HG2  VAL  51          HG22      VAL  51  54.150  -2.587  -5.603
  459   2HG2  VAL  51          HG21      VAL  51  52.878  -2.820  -6.801
  460   3HG2  VAL  51          HG23      VAL  51  52.523  -1.986  -5.288
  461    H    VAL  52           HN       VAL  52  54.897  -5.808  -3.152
  462    HA   VAL  52           HA       VAL  52  56.980  -3.768  -3.159
  463    HB   VAL  52           HB       VAL  52  55.684  -5.039  -1.151
  464   1HG1  VAL  52          HG12      VAL  52  57.046  -7.181  -1.850
  465   2HG1  VAL  52          HG11      VAL  52  58.337  -6.409  -0.929
  466   3HG1  VAL  52          HG13      VAL  52  56.806  -6.797  -0.145
  467   1HG2  VAL  52          HG22      VAL  52  57.588  -3.123  -1.335
  468   2HG2  VAL  52          HG21      VAL  52  56.980  -3.741   0.199
  469   3HG2  VAL  52          HG23      VAL  52  58.487  -4.368  -0.467
  470    NH1  ARG  53           NH1      ARG  53  62.533  -9.379  -2.032
  471    NH2  ARG  53           NH2      ARG  53  62.723 -11.624  -1.840
  472    H    ARG  53           HN       ARG  53  56.684  -7.110  -4.152
  473    HA   ARG  53           HA       ARG  53  59.585  -7.526  -4.307
  474   1HB   ARG  53           HB2      ARG  53  57.603  -9.273  -3.948
  475   2HB   ARG  53           HB1      ARG  53  57.646  -9.313  -5.712
  476   1HG   ARG  53           HG2      ARG  53  59.160 -11.011  -5.009
  477   2HG   ARG  53           HG1      ARG  53  60.175  -9.653  -5.492
  478   1HD   ARG  53           HD2      ARG  53  60.269  -8.937  -3.097
  479   2HD   ARG  53           HD1      ARG  53  59.381 -10.399  -2.667
  480    HE   ARG  53           HE       ARG  53  61.525 -11.361  -4.113
  481   1HH1  ARG  53          HH11      ARG  53  62.129  -8.580  -2.478
  482   2HH1  ARG  53          HH12      ARG  53  63.194  -9.258  -1.292
  483   1HH2  ARG  53          HH21      ARG  53  62.464 -12.543  -2.138
  484   2HH2  ARG  53          HH22      ARG  53  63.383 -11.506  -1.098
  485    H    VAL  54           HN       VAL  54  56.897  -6.870  -6.547
  486    HA   VAL  54           HA       VAL  54  58.448  -7.101  -8.959
  487    HB   VAL  54           HB       VAL  54  56.007  -5.366  -8.439
  488   1HG1  VAL  54          HG12      VAL  54  57.331  -4.886 -10.535
  489   2HG1  VAL  54          HG11      VAL  54  57.028  -6.549 -11.038
  490   3HG1  VAL  54          HG13      VAL  54  55.680  -5.430 -10.836
  491   1HG2  VAL  54          HG21      VAL  54  56.031  -8.003  -8.037
  492   2HG2  VAL  54          HG23      VAL  54  54.666  -7.214  -8.829
  493   3HG2  VAL  54          HG22      VAL  54  55.895  -8.030  -9.795
  494    CH2  TRP  55           CH2      TRP  55  62.224   0.228  -3.142
  495    H    TRP  55           HN       TRP  55  57.638  -4.271  -6.907
  496    HA   TRP  55           HA       TRP  55  59.165  -2.424  -8.507
  497   1HB   TRP  55           HB2      TRP  55  57.603  -1.416  -6.989
  498   2HB   TRP  55           HB1      TRP  55  58.230  -2.332  -5.621
  499    HD1  TRP  55           HD1      TRP  55  59.285   0.547  -8.004
  500    HE1  TRP  55           HE1      TRP  55  61.111   1.921  -6.816
  501    HE3  TRP  55           HE3      TRP  55  59.960  -2.242  -3.759
  502    HZ2  TRP  55           HZ2      TRP  55  62.613   1.886  -4.435
  503    HZ3  TRP  55           HZ3      TRP  55  61.639  -1.535  -2.079
  504    HH2  TRP  55           HH2      TRP  55  62.945   0.536  -2.402
  505    H    PHE  56           HN       PHE  56  59.970  -4.396  -5.618
  506    HA   PHE  56           HA       PHE  56  62.684  -3.379  -5.679
  507   1HB   PHE  56           HB2      PHE  56  61.302  -4.427  -3.630
  508   2HB   PHE  56           HB1      PHE  56  62.165  -5.877  -4.154
  509    HD1  PHE  56           HD1      PHE  56  63.067  -2.245  -4.082
  510    HD2  PHE  56           HD2      PHE  56  64.099  -6.206  -2.814
  511    HE1  PHE  56           HE1      PHE  56  65.121  -1.362  -3.058
  512    HE2  PHE  56           HE2      PHE  56  66.188  -5.317  -1.802
  513    HZ   PHE  56           HZ       PHE  56  66.686  -2.883  -1.950
  514    H    CYS  57           HN       CYS  57  61.166  -5.501  -7.684
  515    HA   CYS  57           HA       CYS  57  63.380  -7.390  -7.997
  516   1HB   CYS  57           HB2      CYS  57  60.948  -7.881  -8.645
  517   2HB   CYS  57           HB1      CYS  57  61.175  -6.766  -9.993
  518    HG   CYS  57           HG       CYS  57  62.298  -8.599 -11.208
  519    H    ASN  58           HN       ASN  58  62.184  -4.386  -9.367
  520    HA   ASN  58           HA       ASN  58  64.371  -4.209 -11.330
  521   1HB   ASN  58           HB2      ASN  58  61.966  -3.277 -11.602
  522   2HB   ASN  58           HB1      ASN  58  62.498  -1.976 -10.538
  523   1HD2  ASN  58          HD22      ASN  58  63.851  -0.271 -13.296
  524   2HD2  ASN  58          HD21      ASN  58  62.937  -0.207 -11.868
  525    NH1  ARG  59           NH2      ARG  59  65.532   3.434  -7.747
  526    NH2  ARG  59           NH1      ARG  59  67.726   3.008  -7.423
  527    H    ARG  59           HN       ARG  59  63.623  -3.103  -8.068
  528    HA   ARG  59           HA       ARG  59  65.738  -1.087  -8.039
  529   1HB   ARG  59           HB2      ARG  59  63.564  -1.771  -6.296
  530   2HB   ARG  59           HB1      ARG  59  65.041  -1.886  -5.356
  531   1HG   ARG  59           HG2      ARG  59  64.032   0.513  -6.887
  532   2HG   ARG  59           HG1      ARG  59  64.255   0.353  -5.149
  533   1HD   ARG  59           HD2      ARG  59  66.292   1.277  -5.434
  534   2HD   ARG  59           HD1      ARG  59  66.773  -0.238  -6.197
  535    HE   ARG  59           HE       ARG  59  66.166   0.807  -8.387
  536   1HH1  ARG  59          HH21      ARG  59  64.594   3.108  -7.864
  537   2HH1  ARG  59          HH22      ARG  59  65.725   4.415  -7.761
  538   1HH2  ARG  59          HH11      ARG  59  68.471   2.354  -7.293
  539   2HH2  ARG  59          HH12      ARG  59  67.919   3.989  -7.441
  540    NH1  ARG  60           NH1      ARG  60  64.215 -10.896  -6.830
  541    NH2  ARG  60           NH2      ARG  60  66.150 -11.754  -7.624
  542    H    ARG  60           HN       ARG  60  65.544  -4.524  -7.482
  543    HA   ARG  60           HA       ARG  60  68.095  -4.553  -5.998
  544   1HB   ARG  60           HB2      ARG  60  67.797  -6.976  -5.896
  545   2HB   ARG  60           HB1      ARG  60  66.296  -6.181  -5.429
  546   1HG   ARG  60           HG2      ARG  60  65.460  -6.495  -7.772
  547   2HG   ARG  60           HG1      ARG  60  66.924  -7.408  -8.131
  548   1HD   ARG  60           HD2      ARG  60  66.055  -8.635  -5.827
  549   2HD   ARG  60           HD1      ARG  60  64.532  -8.227  -6.616
  550    HE   ARG  60           HE       ARG  60  66.200  -9.372  -8.590
  551   1HH1  ARG  60          HH11      ARG  60  63.625 -10.108  -6.654
  552   2HH1  ARG  60          HH12      ARG  60  63.911 -11.815  -6.577
  553   1HH2  ARG  60          HH21      ARG  60  67.042 -11.623  -8.055
  554   2HH2  ARG  60          HH22      ARG  60  65.847 -12.673  -7.370
  555    H    GLN  61           HN       GLN  61  66.909  -5.000  -9.259
  556    HA   GLN  61           HA       GLN  61  69.703  -5.615 -10.131
  557   1HB   GLN  61           HB2      GLN  61  67.106  -6.326 -11.534
  558   2HB   GLN  61           HB1      GLN  61  68.729  -6.736 -12.089
  559   1HG   GLN  61           HG2      GLN  61  68.496  -7.625  -9.378
  560   2HG   GLN  61           HG1      GLN  61  67.064  -8.175 -10.245
  561   1HE2  GLN  61          HE22      GLN  61  70.734  -9.483 -11.585
  562   2HE2  GLN  61          HE21      GLN  61  70.626  -7.963 -10.838
  563    H    LYS  62           HN       LYS  62  69.440  -3.070  -9.756
  564    HA   LYS  62           HA       LYS  62  68.248  -1.646 -12.010
  565   1HB   LYS  62           HB2      LYS  62  69.324   0.340 -10.979
  566   2HB   LYS  62           HB1      LYS  62  68.377  -0.575  -9.809
  567   1HG   LYS  62           HG2      LYS  62  71.103  -1.576  -9.913
  568   2HG   LYS  62           HG1      LYS  62  71.095   0.155  -9.591
  569   1HD   LYS  62           HD2      LYS  62  69.661  -0.129  -7.680
  570   2HD   LYS  62           HD1      LYS  62  69.373  -1.823  -8.078
  571   1HE   LYS  62           HE2      LYS  62  72.132  -1.708  -7.944
  572   2HE   LYS  62           HE1      LYS  62  71.640  -0.592  -6.670
  573   1HZ   LYS  62           HZ3      LYS  62  70.193  -2.318  -5.779
  574   2HZ   LYS  62           HZ2      LYS  62  70.701  -3.391  -6.994
  575   3HZ   LYS  62           HZ1      LYS  62  71.806  -2.839  -5.828
  576    H    GLY  63           HN       GLY  63  71.349  -3.048 -11.215
  577   1HA   GLY  63           HA2      GLY  63  72.304  -2.823 -13.904
  578   2HA   GLY  63           HA1      GLY  63  73.085  -1.607 -12.892
  579    H    LYS  64           HN       LYS  64  72.154  -5.036 -12.432
  580    HA   LYS  64           HA       LYS  64  74.939  -5.522 -11.449
  581   1HB   LYS  64           HB2      LYS  64  72.976  -5.714  -9.785
  582   2HB   LYS  64           HB1      LYS  64  72.534  -7.172 -10.674
  583   1HG   LYS  64           HG2      LYS  64  75.132  -7.705 -10.346
  584   2HG   LYS  64           HG1      LYS  64  74.911  -6.656  -8.945
  585   1HD   LYS  64           HD2      LYS  64  72.989  -8.909  -9.510
  586   2HD   LYS  64           HD1      LYS  64  74.492  -9.196  -8.632
  587   1HE   LYS  64           HE2      LYS  64  73.053  -8.712  -6.872
  588   2HE   LYS  64           HE1      LYS  64  73.699  -7.108  -7.216
  589   1HZ   LYS  64           HZ2      LYS  64  71.243  -8.123  -8.517
  590   2HZ   LYS  64           HZ1      LYS  64  71.199  -7.321  -7.019
  591   3HZ   LYS  64           HZ3      LYS  64  71.784  -6.517  -8.393
  592    NH1  ARG  65           NH1      ARG  65  73.016 -14.007 -15.099
  593    NH2  ARG  65           NH2      ARG  65  71.117 -13.516 -13.977
  594    H    ARG  65           HN       ARG  65  73.802  -5.770 -14.231
  595    HA   ARG  65           HA       ARG  65  74.910  -8.419 -14.800
  596   1HB   ARG  65           HB2      ARG  65  72.379  -8.665 -14.187
  597   2HB   ARG  65           HB1      ARG  65  72.102  -7.961 -15.780
  598   1HG   ARG  65           HG2      ARG  65  73.041  -9.774 -16.897
  599   2HG   ARG  65           HG1      ARG  65  74.039 -10.236 -15.519
  600   1HD   ARG  65           HD2      ARG  65  71.191 -10.368 -14.882
  601   2HD   ARG  65           HD1      ARG  65  71.609 -11.398 -16.250
  602    HE   ARG  65           HE       ARG  65  73.271 -11.591 -13.794
  603   1HH1  ARG  65          HH11      ARG  65  73.881 -13.715 -15.507
  604   2HH1  ARG  65          HH12      ARG  65  72.741 -14.967 -15.143
  605   1HH2  ARG  65          HH21      ARG  65  70.526 -12.849 -13.523
  606   2HH2  ARG  65          HH22      ARG  65  70.844 -14.477 -14.021
  607    H    SER  66           HN       SER  66  75.377  -5.562 -15.508
  608    HA   SER  66           HA       SER  66  75.660  -5.967 -18.402
  609   1HB   SER  66           HB2      SER  66  73.455  -5.039 -18.452
  610   2HB   SER  66           HB1      SER  66  73.865  -3.824 -17.244
  611    HG   SER  66           HG       SER  66  73.869  -3.042 -19.436
  612    H    SER  67           HN       SER  67  75.561  -2.978 -16.454
  613    HA   SER  67           HA       SER  67  78.508  -2.848 -16.413
  614   1HB   SER  67           HB2      SER  67  77.737  -1.879 -18.632
  615   2HB   SER  67           HB1      SER  67  76.912  -0.625 -17.712
  616    HG   SER  67           HG       SER  67  79.520  -0.856 -18.347
   
  Start of MODEL           5
 Raw file had  616 H/Q atoms
  Start of MODEL    5
    1   1H    MET   1           HT1      MET   1  38.816  -1.612  14.264
    2   2H    MET   1           HT3      MET   1  37.949  -2.995  14.724
    3   3H    MET   1           HT2      MET   1  37.732  -1.538  15.571
    4    HA   MET   1           HA       MET   1  39.805  -1.655  16.589
    5   1HB   MET   1           HB2      MET   1  38.033  -3.409  17.269
    6   2HB   MET   1           HB1      MET   1  39.037  -4.569  16.400
    7   1HG   MET   1           HG2      MET   1  40.834  -4.323  17.878
    8   2HG   MET   1           HG1      MET   1  40.284  -2.743  18.436
    9   1HE   MET   1           HE2      MET   1  38.283  -2.271  19.360
   10   2HE   MET   1           HE1      MET   1  37.176  -3.296  20.268
   11   3HE   MET   1           HE3      MET   1  38.664  -2.709  21.023
   12    H    GLU   2           HN       GLU   2  39.550  -3.896  13.869
   13    HA   GLU   2           HA       GLU   2  42.478  -3.619  13.457
   14   1HB   GLU   2           HB2      GLU   2  42.610  -6.083  12.953
   15   2HB   GLU   2           HB1      GLU   2  42.298  -5.720  14.649
   16   1HG   GLU   2           HG2      GLU   2  40.503  -7.081  14.505
   17   2HG   GLU   2           HG1      GLU   2  39.746  -5.845  13.503
   18    H    THR   3           HN       THR   3  40.069  -2.528  12.144
   19    HA   THR   3           HA       THR   3  40.180  -3.915   9.503
   20    HB   THR   3           HB       THR   3  38.274  -1.674   9.985
   21    HG1  THR   3           HG1      THR   3  36.890  -3.123  11.089
   22   1HG2  THR   3          HG23      THR   3  38.381  -2.972   7.861
   23   2HG2  THR   3          HG22      THR   3  37.973  -4.431   8.765
   24   3HG2  THR   3          HG21      THR   3  36.812  -3.107   8.656
   25    H    LEU   4           HN       LEU   4  42.299  -2.967   9.034
   26    HA   LEU   4           HA       LEU   4  42.258  -0.024   8.552
   27   1HB   LEU   4           HB2      LEU   4  44.153  -1.426   9.831
   28   2HB   LEU   4           HB1      LEU   4  44.745  -1.629   8.182
   29    HG   LEU   4           HG       LEU   4  43.927   1.102   9.117
   30   1HD1  LEU   4          HD13      LEU   4  46.438  -0.401   9.845
   31   2HD1  LEU   4          HD12      LEU   4  46.442   1.356   9.698
   32   3HD1  LEU   4          HD11      LEU   4  45.399   0.572  10.885
   33   1HD2  LEU   4          HD23      LEU   4  45.769  -0.112   7.065
   34   2HD2  LEU   4          HD22      LEU   4  44.463   1.049   6.827
   35   3HD2  LEU   4          HD21      LEU   4  45.977   1.565   7.571
   36    H    VAL   5           HN       VAL   5  42.651  -3.148   6.987
   37    HA   VAL   5           HA       VAL   5  42.287  -1.812   4.360
   38    HB   VAL   5           HB       VAL   5  44.714  -2.111   4.590
   39   1HG1  VAL   5          HG12      VAL   5  44.142  -4.247   6.149
   40   2HG1  VAL   5          HG11      VAL   5  44.526  -5.072   4.639
   41   3HG1  VAL   5          HG13      VAL   5  45.714  -4.004   5.386
   42   1HG2  VAL   5          HG21      VAL   5  43.387  -2.682   2.407
   43   2HG2  VAL   5          HG23      VAL   5  45.086  -3.146   2.515
   44   3HG2  VAL   5          HG22      VAL   5  43.824  -4.349   2.780
   45    H    GLN   6           HN       GLN   6  40.118  -2.766   4.886
   46    HA   GLN   6           HA       GLN   6  39.886  -5.692   4.822
   47   1HB   GLN   6           HB2      GLN   6  38.316  -3.695   5.863
   48   2HB   GLN   6           HB1      GLN   6  37.455  -4.069   4.371
   49   1HG   GLN   6           HG2      GLN   6  38.384  -6.402   5.960
   50   2HG   GLN   6           HG1      GLN   6  37.082  -5.448   6.671
   51   1HE2  GLN   6          HE22      GLN   6  34.816  -6.153   3.908
   52   2HE2  GLN   6          HE21      GLN   6  35.277  -4.868   4.918
   53    H    ALA   7           HN       ALA   7  39.440  -2.972   2.611
   54    HA   ALA   7           HA       ALA   7  38.164  -4.432   0.508
   55   1HB   ALA   7           HB2      ALA   7  39.797  -1.888   0.541
   56   2HB   ALA   7           HB1      ALA   7  39.061  -2.524  -0.930
   57   3HB   ALA   7           HB3      ALA   7  38.044  -2.046   0.430
   58    NH1  ARG   8           NH2      ARG   8  38.963  -9.889   0.805
   59    NH2  ARG   8           NH1      ARG   8  36.800  -9.627   0.207
   60    H    ARG   8           HN       ARG   8  39.512  -4.296  -1.749
   61    HA   ARG   8           HA       ARG   8  42.283  -5.136  -1.522
   62   1HB   ARG   8           HB2      ARG   8  41.892  -7.389  -2.530
   63   2HB   ARG   8           HB1      ARG   8  41.216  -7.243  -0.908
   64   1HG   ARG   8           HG2      ARG   8  39.051  -6.474  -2.216
   65   2HG   ARG   8           HG1      ARG   8  39.799  -7.355  -3.549
   66   1HD   ARG   8           HD2      ARG   8  38.739  -9.146  -2.608
   67   2HD   ARG   8           HD1      ARG   8  40.139  -9.149  -1.536
   68    HE   ARG   8           HE       ARG   8  38.062  -7.396  -0.542
   69   1HH1  ARG   8          HH21      ARG   8  39.922  -9.617   0.727
   70   2HH1  ARG   8          HH22      ARG   8  38.703 -10.632   1.420
   71   1HH2  ARG   8          HH11      ARG   8  36.101  -9.154  -0.328
   72   2HH2  ARG   8          HH12      ARG   8  36.541 -10.371   0.823
   73    H    LYS   9           HN       LYS   9  40.790  -3.088  -2.914
   74    HA   LYS   9           HA       LYS   9  41.795  -3.573  -5.612
   75   1HB   LYS   9           HB2      LYS   9  39.308  -4.417  -5.353
   76   2HB   LYS   9           HB1      LYS   9  38.931  -2.695  -5.439
   77   1HG   LYS   9           HG2      LYS   9  40.165  -2.527  -7.569
   78   2HG   LYS   9           HG1      LYS   9  40.544  -4.248  -7.486
   79   1HD   LYS   9           HD2      LYS   9  37.680  -3.367  -7.304
   80   2HD   LYS   9           HD1      LYS   9  38.464  -3.437  -8.883
   81   1HE   LYS   9           HE2      LYS   9  38.737  -5.740  -8.801
   82   2HE   LYS   9           HE1      LYS   9  38.751  -5.780  -7.038
   83   1HZ   LYS   9           HZ3      LYS   9  36.325  -4.973  -8.506
   84   2HZ   LYS   9           HZ2      LYS   9  36.681  -6.616  -8.265
   85   3HZ   LYS   9           HZ1      LYS   9  36.462  -5.587  -6.931
   86    NH1  ARG  10           NH2      ARG  10  38.657   4.779  -4.214
   87    NH2  ARG  10           NH1      ARG  10  39.303   5.646  -6.200
   88    H    ARG  10           HN       ARG  10  42.613  -1.784  -3.621
   89    HA   ARG  10           HA       ARG  10  42.333   0.746  -5.022
   90   1HB   ARG  10           HB2      ARG  10  40.779   0.168  -2.594
   91   2HB   ARG  10           HB1      ARG  10  41.773   1.616  -2.446
   92   1HG   ARG  10           HG2      ARG  10  40.042   1.145  -4.873
   93   2HG   ARG  10           HG1      ARG  10  39.399   1.905  -3.419
   94   1HD   ARG  10           HD2      ARG  10  40.906   3.734  -3.579
   95   2HD   ARG  10           HD1      ARG  10  41.920   2.896  -4.754
   96    HE   ARG  10           HE       ARG  10  40.133   3.236  -6.423
   97   1HH1  ARG  10          HH21      ARG  10  38.695   4.045  -3.536
   98   2HH1  ARG  10          HH22      ARG  10  38.084   5.582  -4.050
   99   1HH2  ARG  10          HH11      ARG  10  39.836   5.576  -7.043
  100   2HH2  ARG  10          HH12      ARG  10  38.730   6.448  -6.036
  101    H    LYS  11           HN       LYS  11  44.589   0.692  -5.214
  102    HA   LYS  11           HA       LYS  11  46.225   0.355  -2.800
  103   1HB   LYS  11           HB2      LYS  11  48.140   0.535  -4.405
  104   2HB   LYS  11           HB1      LYS  11  47.013  -0.762  -4.802
  105   1HG   LYS  11           HG2      LYS  11  46.181   1.735  -6.043
  106   2HG   LYS  11           HG1      LYS  11  47.837   1.334  -6.494
  107   1HD   LYS  11           HD2      LYS  11  47.160  -0.857  -7.275
  108   2HD   LYS  11           HD1      LYS  11  45.523  -0.615  -6.665
  109   1HE   LYS  11           HE2      LYS  11  45.530   1.493  -8.212
  110   2HE   LYS  11           HE1      LYS  11  46.868   0.679  -9.023
  111   1HZ   LYS  11           HZ3      LYS  11  45.353  -1.321  -9.106
  112   2HZ   LYS  11           HZ2      LYS  11  44.087  -0.272  -8.677
  113   3HZ   LYS  11           HZ1      LYS  11  44.944  -0.028 -10.124
  114    NH1  ARG  12           NH2      ARG  12  43.242   4.190  -8.342
  115    NH2  ARG  12           NH1      ARG  12  42.082   6.096  -7.982
  116    H    ARG  12           HN       ARG  12  44.609   2.682  -2.743
  117    HA   ARG  12           HA       ARG  12  46.736   4.755  -2.644
  118   1HB   ARG  12           HB2      ARG  12  45.089   6.420  -3.601
  119   2HB   ARG  12           HB1      ARG  12  45.692   5.233  -4.756
  120   1HG   ARG  12           HG2      ARG  12  43.658   3.891  -4.478
  121   2HG   ARG  12           HG1      ARG  12  43.058   5.024  -3.266
  122   1HD   ARG  12           HD2      ARG  12  42.000   5.595  -5.355
  123   2HD   ARG  12           HD1      ARG  12  43.205   6.839  -5.023
  124    HE   ARG  12           HE       ARG  12  44.709   5.462  -6.608
  125   1HH1  ARG  12          HH21      ARG  12  43.960   3.549  -8.070
  126   2HH1  ARG  12          HH22      ARG  12  42.696   4.013  -9.161
  127   1HH2  ARG  12          HH11      ARG  12  41.911   6.915  -7.435
  128   2HH2  ARG  12          HH12      ARG  12  41.536   5.918  -8.801
  129    H    THR  13           HN       THR  13  44.740   3.072  -0.821
  130    HA   THR  13           HA       THR  13  43.298   5.196   0.588
  131    HB   THR  13           HB       THR  13  43.877   2.516   1.814
  132    HG1  THR  13           HG1      THR  13  42.896   1.499   0.281
  133   1HG2  THR  13          HG21      THR  13  42.340   4.596   2.594
  134   2HG2  THR  13          HG23      THR  13  41.162   3.703   1.631
  135   3HG2  THR  13          HG22      THR  13  41.960   2.921   2.995
  136    H    SER  14           HN       SER  14  46.358   3.510   0.774
  137    HA   SER  14           HA       SER  14  47.316   5.486   2.736
  138   1HB   SER  14           HB2      SER  14  46.569   3.557   4.118
  139   2HB   SER  14           HB1      SER  14  47.604   2.494   3.169
  140    HG   SER  14           HG       SER  14  48.657   3.177   5.063
  141    H    ILE  15           HN       ILE  15  47.714   4.960  -0.096
  142    HA   ILE  15           HA       ILE  15  50.652   4.753  -0.057
  143    HB   ILE  15           HB       ILE  15  48.862   2.976  -1.726
  144   1HG1  ILE  15          HG12      ILE  15  49.510   2.179   0.531
  145   2HG1  ILE  15          HG11      ILE  15  50.238   1.192  -0.734
  146   1HG2  ILE  15          HG21      ILE  15  51.477   4.110  -2.410
  147   2HG2  ILE  15          HG23      ILE  15  51.506   2.346  -2.385
  148   3HG2  ILE  15          HG22      ILE  15  50.359   3.195  -3.420
  149   1HD1  ILE  15          HD13      ILE  15  52.175   3.099  -0.396
  150   2HD1  ILE  15          HD12      ILE  15  51.534   2.983   1.236
  151   3HD1  ILE  15          HD11      ILE  15  52.164   1.549   0.436
  152    H    GLU  16           HN       GLU  16  49.935   7.092  -0.256
  153    HA   GLU  16           HA       GLU  16  48.926   7.997  -2.798
  154   1HB   GLU  16           HB2      GLU  16  49.217   9.172  -0.342
  155   2HB   GLU  16           HB1      GLU  16  50.580   9.870  -1.217
  156   1HG   GLU  16           HG2      GLU  16  48.846  11.366  -1.717
  157   2HG   GLU  16           HG1      GLU  16  48.825  10.286  -3.111
  158    H    ASN  17           HN       ASN  17  50.342   9.411  -4.225
  159    HA   ASN  17           HA       ASN  17  52.634   7.936  -5.086
  160   1HB   ASN  17           HB2      ASN  17  53.087   9.987  -6.515
  161   2HB   ASN  17           HB1      ASN  17  51.477   9.294  -6.707
  162   1HD2  ASN  17          HD22      ASN  17  50.096  12.467  -6.053
  163   2HD2  ASN  17          HD21      ASN  17  50.161  11.113  -7.074
  164    NH1  ARG  18           NH2      ARG  18  57.278  15.876  -0.022
  165    NH2  ARG  18           NH1      ARG  18  55.476  17.040   0.690
  166    H    ARG  18           HN       ARG  18  52.232  10.483  -2.747
  167    HA   ARG  18           HA       ARG  18  55.068  11.183  -2.685
  168   1HB   ARG  18           HB2      ARG  18  52.596  12.128  -1.453
  169   2HB   ARG  18           HB1      ARG  18  53.899  12.019  -0.272
  170   1HG   ARG  18           HG2      ARG  18  54.761  13.179  -2.833
  171   2HG   ARG  18           HG1      ARG  18  53.504  14.122  -2.034
  172   1HD   ARG  18           HD2      ARG  18  55.126  13.554   0.083
  173   2HD   ARG  18           HD1      ARG  18  56.309  13.646  -1.221
  174    HE   ARG  18           HE       ARG  18  54.604  15.896  -1.469
  175   1HH1  ARG  18          HH21      ARG  18  57.677  15.168  -0.605
  176   2HH1  ARG  18          HH22      ARG  18  57.862  16.400   0.598
  177   1HH2  ARG  18          HH11      ARG  18  54.494  17.225   0.653
  178   2HH2  ARG  18          HH12      ARG  18  56.060  17.565   1.310
  179    H    VAL  19           HN       VAL  19  52.975   8.830  -1.141
  180    HA   VAL  19           HA       VAL  19  54.716   8.302   1.086
  181    HB   VAL  19           HB       VAL  19  52.161   7.530   0.536
  182   1HG1  VAL  19          HG12      VAL  19  53.893   5.182  -0.269
  183   2HG1  VAL  19          HG11      VAL  19  52.382   4.920   0.564
  184   3HG1  VAL  19          HG13      VAL  19  52.389   5.757  -0.984
  185   1HG2  VAL  19          HG22      VAL  19  54.285   6.517   2.395
  186   2HG2  VAL  19          HG21      VAL  19  52.856   7.485   2.754
  187   3HG2  VAL  19          HG23      VAL  19  52.693   5.760   2.425
  188    NH1  ARG  20           NH2      ARG  20  52.729   3.693  -7.495
  189    NH2  ARG  20           NH1      ARG  20  51.450   2.248  -6.317
  190    H    ARG  20           HN       ARG  20  54.352   6.806  -2.111
  191    HA   ARG  20           HA       ARG  20  56.334   4.785  -1.733
  192   1HB   ARG  20           HB2      ARG  20  55.421   6.216  -4.242
  193   2HB   ARG  20           HB1      ARG  20  56.505   4.823  -4.255
  194   1HG   ARG  20           HG2      ARG  20  54.856   3.358  -3.525
  195   2HG   ARG  20           HG1      ARG  20  53.926   4.634  -2.740
  196   1HD   ARG  20           HD2      ARG  20  52.726   5.041  -4.610
  197   2HD   ARG  20           HD1      ARG  20  54.168   5.061  -5.625
  198    HE   ARG  20           HE       ARG  20  53.669   2.361  -4.944
  199   1HH1  ARG  20          HH21      ARG  20  53.525   4.295  -7.553
  200   2HH1  ARG  20          HH22      ARG  20  52.116   3.597  -8.279
  201   1HH2  ARG  20          HH11      ARG  20  51.265   1.744  -5.474
  202   2HH2  ARG  20          HH12      ARG  20  50.836   2.153  -7.101
  203    CH2  TRP  21           CH2      TRP  21  59.447   4.746  -6.897
  204    H    TRP  21           HN       TRP  21  56.678   8.065  -3.096
  205    HA   TRP  21           HA       TRP  21  59.560   7.651  -3.136
  206   1HB   TRP  21           HB2      TRP  21  58.006  10.124  -3.878
  207   2HB   TRP  21           HB1      TRP  21  59.731   9.849  -4.180
  208    HD1  TRP  21           HD1      TRP  21  57.027   9.899  -6.301
  209    HE1  TRP  21           HE1      TRP  21  56.912   7.974  -8.018
  210    HE3  TRP  21           HE3      TRP  21  60.334   6.584  -4.203
  211    HZ2  TRP  21           HZ2      TRP  21  58.049   5.339  -8.410
  212    HZ3  TRP  21           HZ3      TRP  21  60.750   4.413  -5.230
  213    HH2  TRP  21           HH2      TRP  21  59.661   3.790  -7.353
  214    H    SER  22           HN       SER  22  57.522   8.221  -0.711
  215    HA   SER  22           HA       SER  22  59.269   9.984   0.840
  216   1HB   SER  22           HB2      SER  22  56.883  10.042   1.412
  217   2HB   SER  22           HB1      SER  22  56.854   8.291   1.590
  218    HG   SER  22           HG       SER  22  57.297   9.993   3.469
  219    H    LEU  23           HN       LEU  23  58.458   6.581   0.292
  220    HA   LEU  23           HA       LEU  23  60.102   5.297   2.245
  221   1HB   LEU  23           HB2      LEU  23  59.554   4.464  -0.627
  222   2HB   LEU  23           HB1      LEU  23  60.228   3.424   0.593
  223    HG   LEU  23           HG       LEU  23  57.573   4.677   1.125
  224   1HD1  LEU  23          HD13      LEU  23  57.881   3.619  -1.302
  225   2HD1  LEU  23          HD12      LEU  23  57.780   2.097  -0.419
  226   3HD1  LEU  23          HD11      LEU  23  56.443   3.245  -0.353
  227   1HD2  LEU  23          HD21      LEU  23  59.213   2.331   1.974
  228   2HD2  LEU  23          HD23      LEU  23  58.084   3.304   2.917
  229   3HD2  LEU  23          HD22      LEU  23  57.478   2.043   1.843
  230    H    GLU  24           HN       GLU  24  60.653   6.397  -1.065
  231    HA   GLU  24           HA       GLU  24  63.363   5.611  -1.342
  232   1HB   GLU  24           HB2      GLU  24  61.488   7.345  -2.742
  233   2HB   GLU  24           HB1      GLU  24  63.116   8.017  -2.778
  234   1HG   GLU  24           HG2      GLU  24  63.700   5.443  -3.329
  235   2HG   GLU  24           HG1      GLU  24  62.071   5.515  -4.002
  236    H    THR  25           HN       THR  25  61.993   8.629  -0.042
  237    HA   THR  25           HA       THR  25  64.476   9.986   0.348
  238    HB   THR  25           HB       THR  25  62.024  10.254   2.105
  239    HG1  THR  25           HG1      THR  25  61.071  10.754   0.310
  240   1HG2  THR  25          HG22      THR  25  64.413  11.939   1.428
  241   2HG2  THR  25          HG21      THR  25  62.896  12.722   1.871
  242   3HG2  THR  25          HG23      THR  25  63.684  11.623   3.002
  243    H    MET  26           HN       MET  26  62.831   7.500   2.195
  244    HA   MET  26           HA       MET  26  64.597   7.830   4.525
  245   1HB   MET  26           HB2      MET  26  62.083   6.997   4.405
  246   2HB   MET  26           HB1      MET  26  62.849   5.430   4.141
  247   1HG   MET  26           HG2      MET  26  62.713   5.487   6.467
  248   2HG   MET  26           HG1      MET  26  64.332   6.129   6.196
  249   1HE   MET  26           HE3      MET  26  64.781   7.097   8.001
  250   2HE   MET  26           HE2      MET  26  65.001   8.701   7.308
  251   3HE   MET  26           HE1      MET  26  64.076   8.512   8.795
  252    H    PHE  27           HN       PHE  27  64.547   5.912   1.603
  253    HA   PHE  27           HA       PHE  27  66.481   3.961   2.691
  254   1HB   PHE  27           HB2      PHE  27  65.037   4.215   0.049
  255   2HB   PHE  27           HB1      PHE  27  66.396   3.112   0.250
  256    HD1  PHE  27           HD2      PHE  27  66.289   1.643   2.486
  257    HD2  PHE  27           HD1      PHE  27  62.907   3.389   0.495
  258    HE1  PHE  27           HE2      PHE  27  64.798  -0.025   3.556
  259    HE2  PHE  27           HE1      PHE  27  61.416   1.721   1.564
  260    HZ   PHE  27           HZ       PHE  27  62.361   0.016   3.092
  261    H    LEU  28           HN       LEU  28  66.570   6.974   1.022
  262    HA   LEU  28           HA       LEU  28  69.196   6.417  -0.191
  263   1HB   LEU  28           HB2      LEU  28  67.477   8.909  -0.182
  264   2HB   LEU  28           HB1      LEU  28  68.996   8.735  -1.065
  265    HG   LEU  28           HG       LEU  28  66.636   6.870  -1.412
  266   1HD1  LEU  28          HD11      LEU  28  66.705   9.519  -2.211
  267   2HD1  LEU  28          HD13      LEU  28  67.295   8.668  -3.638
  268   3HD1  LEU  28          HD12      LEU  28  65.725   8.255  -2.951
  269   1HD2  LEU  28          HD22      LEU  28  69.390   7.052  -2.484
  270   2HD2  LEU  28          HD21      LEU  28  68.331   5.650  -2.328
  271   3HD2  LEU  28          HD23      LEU  28  68.139   6.754  -3.690
  272    H    LYS  29           HN       LYS  29  68.711   6.627   2.850
  273    HA   LYS  29           HA       LYS  29  70.530   8.910   3.430
  274   1HB   LYS  29           HB2      LYS  29  69.874   8.695   5.743
  275   2HB   LYS  29           HB1      LYS  29  68.399   8.609   4.789
  276   1HG   LYS  29           HG2      LYS  29  68.559   6.084   4.916
  277   2HG   LYS  29           HG1      LYS  29  69.902   6.285   6.043
  278   1HD   LYS  29           HD2      LYS  29  68.537   7.267   7.691
  279   2HD   LYS  29           HD1      LYS  29  67.268   7.667   6.534
  280   1HE   LYS  29           HE2      LYS  29  66.334   5.804   7.556
  281   2HE   LYS  29           HE1      LYS  29  67.178   5.042   6.209
  282   1HZ   LYS  29           HZ3      LYS  29  68.458   5.435   8.847
  283   2HZ   LYS  29           HZ2      LYS  29  67.542   4.050   8.488
  284   3HZ   LYS  29           HZ1      LYS  29  68.940   4.405   7.589
  285    H    CYS  30           HN       CYS  30  70.157   5.438   3.901
  286    HA   CYS  30           HA       CYS  30  73.084   5.144   3.936
  287   1HB   CYS  30           HB2      CYS  30  71.185   4.013   6.017
  288   2HB   CYS  30           HB1      CYS  30  72.851   3.472   5.815
  289    HG   CYS  30           HG       CYS  30  72.180   5.753   7.480
  290    HA   PRO  31           HA       PRO  31  71.659   1.821   1.290
  291   1HB   PRO  31           HB2      PRO  31  74.087   0.657   0.803
  292   2HB   PRO  31           HB1      PRO  31  73.588   2.184   0.050
  293   1HG   PRO  31           HG2      PRO  31  75.563   1.725   2.227
  294   2HG   PRO  31           HG1      PRO  31  75.451   3.070   1.081
  295   1HD   PRO  31           HD2      PRO  31  74.585   3.070   3.805
  296   2HD   PRO  31           HD1      PRO  31  74.296   4.341   2.598
  297    H    LYS  32           HN       LYS  32  72.464   1.470   4.454
  298    HA   LYS  32           HA       LYS  32  72.474  -1.488   4.309
  299   1HB   LYS  32           HB2      LYS  32  73.734  -1.389   6.486
  300   2HB   LYS  32           HB1      LYS  32  74.618  -0.724   5.112
  301   1HG   LYS  32           HG2      LYS  32  74.330   1.489   5.824
  302   2HG   LYS  32           HG1      LYS  32  72.908   1.100   6.792
  303   1HD   LYS  32           HD2      LYS  32  74.156   0.335   8.575
  304   2HD   LYS  32           HD1      LYS  32  75.481  -0.211   7.548
  305   1HE   LYS  32           HE2      LYS  32  76.108   1.774   8.912
  306   2HE   LYS  32           HE1      LYS  32  76.197   2.096   7.181
  307   1HZ   LYS  32           HZ3      LYS  32  73.642   2.643   8.471
  308   2HZ   LYS  32           HZ2      LYS  32  74.927   3.677   8.880
  309   3HZ   LYS  32           HZ1      LYS  32  74.455   3.505   7.257
  310    HA   PRO  33           HA       PRO  33  68.868   0.041   6.890
  311   1HB   PRO  33           HB2      PRO  33  66.844  -1.085   5.408
  312   2HB   PRO  33           HB1      PRO  33  67.439   0.566   5.160
  313   1HG   PRO  33           HG2      PRO  33  67.917  -1.871   3.509
  314   2HG   PRO  33           HG1      PRO  33  67.908  -0.168   3.022
  315   1HD   PRO  33           HD2      PRO  33  70.219  -1.734   3.462
  316   2HD   PRO  33           HD1      PRO  33  70.168   0.038   3.349
  317    H    SER  34           HN       SER  34  67.654  -1.348   8.328
  318    HA   SER  34           HA       SER  34  68.682  -4.102   8.451
  319   1HB   SER  34           HB2      SER  34  68.181  -2.247  10.390
  320   2HB   SER  34           HB1      SER  34  66.723  -3.231  10.466
  321    HG   SER  34           HG       SER  34  69.218  -3.794  11.305
  322    H    LEU  35           HN       LEU  35  67.323  -5.947   8.522
  323    HA   LEU  35           HA       LEU  35  65.038  -5.884   6.781
  324   1HB   LEU  35           HB2      LEU  35  66.110  -7.896   8.761
  325   2HB   LEU  35           HB1      LEU  35  64.584  -8.178   7.919
  326    HG   LEU  35           HG       LEU  35  66.696  -7.249   6.120
  327   1HD1  LEU  35          HD13      LEU  35  67.097  -9.808   7.693
  328   2HD1  LEU  35          HD12      LEU  35  67.888  -9.489   6.149
  329   3HD1  LEU  35          HD11      LEU  35  68.219  -8.457   7.540
  330   1HD2  LEU  35          HD23      LEU  35  64.763  -9.569   6.260
  331   2HD2  LEU  35          HD22      LEU  35  64.719  -8.175   5.180
  332   3HD2  LEU  35          HD21      LEU  35  65.945  -9.423   4.959
  333    H    GLN  36           HN       GLN  36  65.525  -5.286  10.159
  334    HA   GLN  36           HA       GLN  36  62.734  -5.577  10.961
  335   1HB   GLN  36           HB2      GLN  36  64.863  -5.544  12.480
  336   2HB   GLN  36           HB1      GLN  36  64.726  -3.789  12.354
  337   1HG   GLN  36           HG2      GLN  36  62.774  -3.711  13.567
  338   2HG   GLN  36           HG1      GLN  36  62.240  -5.295  13.007
  339   1HE2  GLN  36          HE22      GLN  36  63.133  -6.487  16.220
  340   2HE2  GLN  36          HE21      GLN  36  61.873  -6.201  15.119
  341    H    GLN  37           HN       GLN  37  64.845  -3.000   9.805
  342    HA   GLN  37           HA       GLN  37  62.975  -0.843  10.135
  343   1HB   GLN  37           HB2      GLN  37  65.415  -0.503   9.730
  344   2HB   GLN  37           HB1      GLN  37  65.202  -1.114   8.089
  345   1HG   GLN  37           HG2      GLN  37  63.477   0.703   7.731
  346   2HG   GLN  37           HG1      GLN  37  63.958   1.374   9.291
  347   1HE2  GLN  37          HE22      GLN  37  66.105   2.384   6.112
  348   2HE2  GLN  37          HE21      GLN  37  64.513   1.796   6.060
  349    H    ILE  38           HN       ILE  38  63.426  -3.336   7.677
  350    HA   ILE  38           HA       ILE  38  61.725  -2.065   5.717
  351    HB   ILE  38           HB       ILE  38  62.777  -4.889   6.026
  352   1HG1  ILE  38          HG12      ILE  38  64.302  -3.162   5.157
  353   2HG1  ILE  38          HG11      ILE  38  63.891  -4.308   3.883
  354   1HG2  ILE  38          HG23      ILE  38  60.844  -3.883   3.896
  355   2HG2  ILE  38          HG22      ILE  38  61.716  -5.414   3.819
  356   3HG2  ILE  38          HG21      ILE  38  60.515  -5.147   5.082
  357   1HD1  ILE  38          HD12      ILE  38  61.979  -2.611   3.305
  358   2HD1  ILE  38          HD11      ILE  38  62.936  -1.471   4.248
  359   3HD1  ILE  38          HD13      ILE  38  63.626  -2.223   2.810
  360    H    THR  39           HN       THR  39  61.253  -4.192   8.456
  361    HA   THR  39           HA       THR  39  58.510  -4.882   7.953
  362    HB   THR  39           HB       THR  39  59.664  -4.462  10.713
  363    HG1  THR  39           HG1      THR  39  60.053  -6.653   8.954
  364   1HG2  THR  39          HG22      THR  39  57.254  -5.077  10.407
  365   2HG2  THR  39          HG21      THR  39  57.778  -6.552   9.595
  366   3HG2  THR  39          HG23      THR  39  58.178  -6.291  11.292
  367    H    HIS  40           HN       HIS  40  59.953  -2.323   9.971
  368    HA   HIS  40           HA       HIS  40  57.473  -0.978  10.528
  369   1HB   HIS  40           HB2      HIS  40  59.676  -0.684  11.785
  370   2HB   HIS  40           HB1      HIS  40  60.203   0.324  10.436
  371    HD1  HIS  40           HD1      HIS  40  58.719   2.495   9.947
  372    HD2  HIS  40           HD2      HIS  40  57.937   0.587  13.570
  373    HE1  HIS  40           HE1      HIS  40  57.382   4.131  11.343
  374    H    ILE  41           HN       ILE  41  59.492  -1.106   7.729
  375    HA   ILE  41           HA       ILE  41  58.756   1.428   6.561
  376    HB   ILE  41           HB       ILE  41  60.360  -0.846   5.899
  377   1HG1  ILE  41          HG12      ILE  41  60.829   0.997   3.896
  378   2HG1  ILE  41          HG11      ILE  41  60.119   1.989   5.169
  379   1HG2  ILE  41          HG21      ILE  41  58.488  -0.090   3.651
  380   2HG2  ILE  41          HG23      ILE  41  59.947  -1.065   3.466
  381   3HG2  ILE  41          HG22      ILE  41  58.599  -1.667   4.432
  382   1HD1  ILE  41          HD12      ILE  41  62.359   0.026   5.694
  383   2HD1  ILE  41          HD11      ILE  41  62.652   1.712   5.268
  384   3HD1  ILE  41          HD13      ILE  41  61.784   1.315   6.751
  385    H    ALA  42           HN       ALA  42  57.542  -1.868   6.427
  386    HA   ALA  42           HA       ALA  42  55.417  -1.446   4.604
  387   1HB   ALA  42           HB1      ALA  42  56.419  -3.657   5.551
  388   2HB   ALA  42           HB3      ALA  42  55.252  -3.430   6.853
  389   3HB   ALA  42           HB2      ALA  42  54.694  -3.604   5.189
  390    H    ASN  43           HN       ASN  43  55.367  -1.544   8.161
  391    HA   ASN  43           HA       ASN  43  52.655  -0.656   8.408
  392   1HB   ASN  43           HB2      ASN  43  54.977  -0.265  10.324
  393   2HB   ASN  43           HB1      ASN  43  53.270  -0.094  10.732
  394   1HD2  ASN  43          HD22      ASN  43  52.764  -3.564  11.125
  395   2HD2  ASN  43          HD21      ASN  43  52.105  -2.003  11.231
  396    H    GLN  44           HN       GLN  44  55.587   0.942   7.520
  397    HA   GLN  44           HA       GLN  44  54.896   3.615   8.288
  398   1HB   GLN  44           HB2      GLN  44  57.079   2.265   7.047
  399   2HB   GLN  44           HB1      GLN  44  56.626   3.609   6.012
  400   1HG   GLN  44           HG2      GLN  44  57.260   3.774   8.977
  401   2HG   GLN  44           HG1      GLN  44  58.324   4.291   7.669
  402   1HE2  GLN  44          HE22      GLN  44  56.509   7.329   8.831
  403   2HE2  GLN  44          HE21      GLN  44  57.627   6.245   9.508
  404    H    LEU  45           HN       LEU  45  54.370   1.676   5.357
  405    HA   LEU  45           HA       LEU  45  52.568   3.864   4.421
  406   1HB   LEU  45           HB2      LEU  45  53.202   3.546   2.151
  407   2HB   LEU  45           HB1      LEU  45  54.699   3.617   3.065
  408    HG   LEU  45           HG       LEU  45  53.396   0.982   2.397
  409   1HD1  LEU  45          HD13      LEU  45  54.328   2.812   0.486
  410   2HD1  LEU  45          HD12      LEU  45  55.670   1.693   0.718
  411   3HD1  LEU  45          HD11      LEU  45  54.085   1.085   0.251
  412   1HD2  LEU  45          HD21      LEU  45  55.950   1.979   3.540
  413   2HD2  LEU  45          HD23      LEU  45  55.055   0.501   3.891
  414   3HD2  LEU  45          HD22      LEU  45  56.064   0.598   2.448
  415    H    GLY  46           HN       GLY  46  52.112   1.288   5.962
  416   1HA   GLY  46           HA2      GLY  46  50.577  -0.484   6.008
  417   2HA   GLY  46           HA1      GLY  46  49.538   0.681   5.204
  418    H    LEU  47           HN       LEU  47  52.432  -0.642   3.645
  419    HA   LEU  47           HA       LEU  47  50.605  -1.922   1.668
  420   1HB   LEU  47           HB2      LEU  47  52.140  -1.546   0.000
  421   2HB   LEU  47           HB1      LEU  47  52.628  -0.254   1.079
  422    HG   LEU  47           HG       LEU  47  53.916  -2.977   0.829
  423   1HD1  LEU  47          HD11      LEU  47  54.274  -0.812  -0.780
  424   2HD1  LEU  47          HD13      LEU  47  55.464  -0.475   0.477
  425   3HD1  LEU  47          HD12      LEU  47  55.546  -1.982  -0.432
  426   1HD2  LEU  47          HD23      LEU  47  54.093  -0.890   2.890
  427   2HD2  LEU  47          HD22      LEU  47  54.396  -2.615   3.012
  428   3HD2  LEU  47          HD21      LEU  47  55.626  -1.546   2.342
  429    H    GLU  48           HN       GLU  48  51.795  -3.948   0.602
  430    HA   GLU  48           HA       GLU  48  52.216  -5.853   2.820
  431   1HB   GLU  48           HB2      GLU  48  50.662  -6.243   0.774
  432   2HB   GLU  48           HB1      GLU  48  52.153  -6.553  -0.116
  433   1HG   GLU  48           HG2      GLU  48  52.767  -8.310   1.489
  434   2HG   GLU  48           HG1      GLU  48  51.303  -7.986   2.419
  435    H    LYS  49           HN       LYS  49  54.121  -7.097   2.979
  436    HA   LYS  49           HA       LYS  49  56.583  -5.842   2.390
  437   1HB   LYS  49           HB2      LYS  49  55.924  -7.890   3.960
  438   2HB   LYS  49           HB1      LYS  49  56.500  -8.821   2.578
  439   1HG   LYS  49           HG2      LYS  49  58.248  -6.565   3.344
  440   2HG   LYS  49           HG1      LYS  49  58.120  -7.836   4.559
  441   1HD   LYS  49           HD2      LYS  49  58.500  -9.453   2.535
  442   2HD   LYS  49           HD1      LYS  49  59.147  -8.019   1.739
  443   1HE   LYS  49           HE2      LYS  49  60.300  -8.022   4.314
  444   2HE   LYS  49           HE1      LYS  49  60.381  -9.693   3.758
  445   1HZ   LYS  49           HZ1      LYS  49  61.127  -7.537   1.911
  446   2HZ   LYS  49           HZ3      LYS  49  62.229  -8.002   3.114
  447   3HZ   LYS  49           HZ2      LYS  49  61.682  -9.142   1.979
  448    H    ASP  50           HN       ASP  50  54.565  -7.790   0.328
  449    HA   ASP  50           HA       ASP  50  56.665  -8.613  -1.487
  450   1HB   ASP  50           HB2      ASP  50  53.677  -8.397  -1.958
  451   2HB   ASP  50           HB1      ASP  50  54.824  -9.279  -2.968
  452    H    VAL  51           HN       VAL  51  54.400  -5.837  -1.400
  453    HA   VAL  51           HA       VAL  51  55.402  -4.893  -4.002
  454    HB   VAL  51           HB       VAL  51  53.055  -4.470  -3.342
  455   1HG1  VAL  51          HG11      VAL  51  54.372  -3.508  -0.926
  456   2HG1  VAL  51          HG13      VAL  51  53.216  -2.334  -1.552
  457   3HG1  VAL  51          HG12      VAL  51  52.692  -3.974  -1.171
  458   1HG2  VAL  51          HG23      VAL  51  54.723  -2.758  -4.628
  459   2HG2  VAL  51          HG22      VAL  51  53.004  -2.438  -4.397
  460   3HG2  VAL  51          HG21      VAL  51  54.189  -1.724  -3.303
  461    H    VAL  52           HN       VAL  52  56.237  -4.548  -0.650
  462    HA   VAL  52           HA       VAL  52  57.705  -2.056  -1.001
  463    HB   VAL  52           HB       VAL  52  56.638  -3.243   1.182
  464   1HG1  VAL  52          HG12      VAL  52  59.570  -3.986   1.334
  465   2HG1  VAL  52          HG11      VAL  52  58.411  -4.088   2.659
  466   3HG1  VAL  52          HG13      VAL  52  58.223  -5.118   1.241
  467   1HG2  VAL  52          HG23      VAL  52  57.775  -0.924   0.731
  468   2HG2  VAL  52          HG22      VAL  52  57.586  -1.501   2.384
  469   3HG2  VAL  52          HG21      VAL  52  59.145  -1.647   1.575
  470    NH1  ARG  53           NH1      ARG  53  59.922 -10.402  -3.874
  471    NH2  ARG  53           NH2      ARG  53  61.989 -11.269  -4.164
  472    H    ARG  53           HN       ARG  53  58.373  -5.495  -1.199
  473    HA   ARG  53           HA       ARG  53  61.273  -5.189  -1.258
  474   1HB   ARG  53           HB2      ARG  53  59.733  -7.295  -0.714
  475   2HB   ARG  53           HB1      ARG  53  59.904  -7.571  -2.446
  476   1HG   ARG  53           HG2      ARG  53  62.459  -6.870  -1.215
  477   2HG   ARG  53           HG1      ARG  53  61.743  -8.294  -0.463
  478   1HD   ARG  53           HD2      ARG  53  61.823  -8.063  -3.460
  479   2HD   ARG  53           HD1      ARG  53  63.249  -8.607  -2.577
  480    HE   ARG  53           HE       ARG  53  61.494 -10.305  -1.543
  481   1HH1  ARG  53          HH11      ARG  53  59.289  -9.826  -3.356
  482   2HH1  ARG  53          HH12      ARG  53  59.603 -10.889  -4.687
  483   1HH2  ARG  53          HH21      ARG  53  62.940 -11.358  -3.868
  484   2HH2  ARG  53          HH22      ARG  53  61.671 -11.756  -4.978
  485    H    VAL  54           HN       VAL  54  58.737  -5.782  -3.711
  486    HA   VAL  54           HA       VAL  54  60.540  -5.748  -5.958
  487    HB   VAL  54           HB       VAL  54  57.586  -5.046  -5.898
  488   1HG1  VAL  54          HG12      VAL  54  59.559  -5.733  -8.072
  489   2HG1  VAL  54          HG11      VAL  54  57.840  -6.068  -8.283
  490   3HG1  VAL  54          HG13      VAL  54  58.390  -4.414  -8.019
  491   1HG2  VAL  54          HG21      VAL  54  58.199  -7.288  -4.894
  492   2HG2  VAL  54          HG23      VAL  54  57.165  -7.387  -6.319
  493   3HG2  VAL  54          HG22      VAL  54  58.890  -7.726  -6.456
  494    CH2  TRP  55           CH2      TRP  55  61.268   3.431  -1.912
  495    H    TRP  55           HN       TRP  55  58.821  -3.252  -4.175
  496    HA   TRP  55           HA       TRP  55  59.382  -1.119  -6.066
  497   1HB   TRP  55           HB2      TRP  55  57.515  -0.887  -4.508
  498   2HB   TRP  55           HB1      TRP  55  58.588  -1.100  -3.130
  499    HD1  TRP  55           HD1      TRP  55  57.369   1.515  -5.616
  500    HE1  TRP  55           HE1      TRP  55  58.291   3.791  -4.923
  501    HE3  TRP  55           HE3      TRP  55  60.705   0.098  -2.002
  502    HZ2  TRP  55           HZ2      TRP  55  60.259   4.890  -3.133
  503    HZ3  TRP  55           HZ3      TRP  55  62.090   1.765  -0.836
  504    HH2  TRP  55           HH2      TRP  55  61.879   4.155  -1.402
  505    H    PHE  56           HN       PHE  56  61.042  -2.515  -3.268
  506    HA   PHE  56           HA       PHE  56  63.139  -0.455  -3.507
  507   1HB   PHE  56           HB2      PHE  56  62.278  -1.501  -1.256
  508   2HB   PHE  56           HB1      PHE  56  63.405  -2.800  -1.656
  509    HD1  PHE  56           HD2      PHE  56  63.500   0.931  -2.097
  510    HD2  PHE  56           HD1      PHE  56  65.421  -2.547  -0.469
  511    HE1  PHE  56           HE2      PHE  56  65.386   2.333  -1.345
  512    HE2  PHE  56           HE1      PHE  56  67.319  -1.136   0.283
  513    HZ   PHE  56           HZ       PHE  56  67.296   1.309  -0.162
  514    H    CYS  57           HN       CYS  57  62.438  -3.300  -5.098
  515    HA   CYS  57           HA       CYS  57  65.145  -4.380  -5.260
  516   1HB   CYS  57           HB2      CYS  57  62.849  -5.582  -5.748
  517   2HB   CYS  57           HB1      CYS  57  63.024  -4.859  -7.347
  518    HG   CYS  57           HG       CYS  57  65.185  -6.214  -7.722
  519    H    ASN  58           HN       ASN  58  63.095  -2.177  -7.079
  520    HA   ASN  58           HA       ASN  58  65.119  -1.748  -9.167
  521   1HB   ASN  58           HB2      ASN  58  62.500  -1.518  -9.347
  522   2HB   ASN  58           HB1      ASN  58  62.780   0.081  -8.659
  523   1HD2  ASN  58          HD22      ASN  58  63.063   0.873 -12.170
  524   2HD2  ASN  58          HD21      ASN  58  61.925   0.745 -10.918
  525    NH1  ARG  59           NH1      ARG  59  64.991   4.427  -7.691
  526    NH2  ARG  59           NH2      ARG  59  63.051   4.282  -8.842
  527    H    ARG  59           HN       ARG  59  63.957  -0.247  -6.192
  528    HA   ARG  59           HA       ARG  59  65.465   2.206  -6.468
  529   1HB   ARG  59           HB2      ARG  59  63.614   1.091  -4.614
  530   2HB   ARG  59           HB1      ARG  59  65.056   1.524  -3.696
  531   1HG   ARG  59           HG2      ARG  59  63.771   3.485  -3.675
  532   2HG   ARG  59           HG1      ARG  59  64.940   3.770  -4.963
  533   1HD   ARG  59           HD2      ARG  59  62.107   2.766  -5.356
  534   2HD   ARG  59           HD1      ARG  59  62.657   4.413  -5.653
  535    HE   ARG  59           HE       ARG  59  63.342   2.047  -7.302
  536   1HH1  ARG  59          HH11      ARG  59  65.570   4.136  -6.929
  537   2HH1  ARG  59          HH12      ARG  59  65.318   5.124  -8.329
  538   1HH2  ARG  59          HH21      ARG  59  62.144   3.880  -8.963
  539   2HH2  ARG  59          HH22      ARG  59  63.378   4.981  -9.479
  540    NH1  ARG  60           NH2      ARG  60  70.957  -4.435  -4.040
  541    NH2  ARG  60           NH1      ARG  60  70.000  -5.477  -2.277
  542    H    ARG  60           HN       ARG  60  66.344  -1.022  -5.438
  543    HA   ARG  60           HA       ARG  60  68.805  -0.027  -4.139
  544   1HB   ARG  60           HB2      ARG  60  69.275  -2.376  -3.632
  545   2HB   ARG  60           HB1      ARG  60  67.629  -1.973  -3.157
  546   1HG   ARG  60           HG2      ARG  60  66.788  -2.964  -5.266
  547   2HG   ARG  60           HG1      ARG  60  68.439  -3.392  -5.713
  548   1HD   ARG  60           HD2      ARG  60  67.535  -4.274  -3.020
  549   2HD   ARG  60           HD1      ARG  60  66.799  -5.091  -4.398
  550    HE   ARG  60           HE       ARG  60  68.910  -6.058  -4.905
  551   1HH1  ARG  60          HH21      ARG  60  70.920  -4.132  -4.992
  552   2HH1  ARG  60          HH22      ARG  60  71.767  -4.243  -3.485
  553   1HH2  ARG  60          HH11      ARG  60  69.229  -5.972  -1.878
  554   2HH2  ARG  60          HH12      ARG  60  70.811  -5.284  -1.724
  555    H    GLN  61           HN       GLN  61  67.772  -1.260  -7.227
  556    HA   GLN  61           HA       GLN  61  70.626  -1.385  -8.090
  557   1HB   GLN  61           HB2      GLN  61  69.886  -2.798  -9.951
  558   2HB   GLN  61           HB1      GLN  61  69.337  -3.492  -8.427
  559   1HG   GLN  61           HG2      GLN  61  67.179  -2.013  -8.934
  560   2HG   GLN  61           HG1      GLN  61  67.748  -2.172 -10.594
  561   1HE2  GLN  61          HE22      GLN  61  65.823  -5.182 -10.511
  562   2HE2  GLN  61          HE21      GLN  61  65.816  -3.560 -11.011
  563    H    LYS  62           HN       LYS  62  69.644   1.107  -7.799
  564    HA   LYS  62           HA       LYS  62  68.482   2.083 -10.297
  565   1HB   LYS  62           HB2      LYS  62  68.787   4.311  -9.243
  566   2HB   LYS  62           HB1      LYS  62  67.936   3.184  -8.189
  567   1HG   LYS  62           HG2      LYS  62  69.712   2.992  -6.723
  568   2HG   LYS  62           HG1      LYS  62  70.913   3.330  -7.967
  569   1HD   LYS  62           HD2      LYS  62  70.113   5.702  -8.028
  570   2HD   LYS  62           HD1      LYS  62  69.048   5.334  -6.670
  571   1HE   LYS  62           HE2      LYS  62  71.909   4.571  -6.365
  572   2HE   LYS  62           HE1      LYS  62  71.539   6.295  -6.324
  573   1HZ   LYS  62           HZ1      LYS  62  69.745   5.678  -4.679
  574   2HZ   LYS  62           HZ3      LYS  62  70.490   4.159  -4.568
  575   3HZ   LYS  62           HZ2      LYS  62  71.347   5.558  -4.127
  576    H    GLY  63           HN       GLY  63  71.682   1.630  -8.979
  577   1HA   GLY  63           HA2      GLY  63  73.348   1.565 -10.986
  578   2HA   GLY  63           HA1      GLY  63  72.867   3.252 -11.180
  579    H    LYS  64           HN       LYS  64  73.955   1.080  -8.547
  580    HA   LYS  64           HA       LYS  64  75.324   3.366  -7.260
  581   1HB   LYS  64           HB2      LYS  64  73.919   1.582  -6.018
  582   2HB   LYS  64           HB1      LYS  64  75.305   0.521  -6.264
  583   1HG   LYS  64           HG2      LYS  64  76.092   1.411  -4.332
  584   2HG   LYS  64           HG1      LYS  64  76.513   2.807  -5.322
  585   1HD   LYS  64           HD2      LYS  64  75.202   3.962  -3.863
  586   2HD   LYS  64           HD1      LYS  64  73.867   3.303  -4.808
  587   1HE   LYS  64           HE2      LYS  64  74.031   1.255  -3.225
  588   2HE   LYS  64           HE1      LYS  64  74.973   2.319  -2.181
  589   1HZ   LYS  64           HZ1      LYS  64  72.406   3.267  -3.248
  590   2HZ   LYS  64           HZ3      LYS  64  72.401   2.184  -1.942
  591   3HZ   LYS  64           HZ2      LYS  64  73.193   3.680  -1.800
  592    NH1  ARG  65           NH2      ARG  65  78.863  -1.201  -2.268
  593    NH2  ARG  65           NH1      ARG  65  79.462  -3.243  -3.028
  594    H    ARG  65           HN       ARG  65  76.226  -0.003  -7.993
  595    HA   ARG  65           HA       ARG  65  79.009   0.966  -8.445
  596   1HB   ARG  65           HB2      ARG  65  77.839  -1.569  -7.390
  597   2HB   ARG  65           HB1      ARG  65  79.336  -1.691  -8.314
  598   1HG   ARG  65           HG2      ARG  65  80.468  -0.167  -6.829
  599   2HG   ARG  65           HG1      ARG  65  78.961   0.228  -6.001
  600   1HD   ARG  65           HD2      ARG  65  79.654  -2.654  -6.082
  601   2HD   ARG  65           HD1      ARG  65  80.713  -1.642  -5.099
  602    HE   ARG  65           HE       ARG  65  77.787  -1.385  -4.677
  603   1HH1  ARG  65          HH21      ARG  65  78.515  -0.280  -2.443
  604   2HH1  ARG  65          HH22      ARG  65  79.100  -1.477  -1.336
  605   1HH2  ARG  65          HH11      ARG  65  79.574  -3.887  -3.786
  606   2HH2  ARG  65          HH12      ARG  65  79.700  -3.521  -2.098
  607    H    SER  66           HN       SER  66  79.963   0.645 -10.426
  608    HA   SER  66           HA       SER  66  78.846  -1.236 -12.375
  609   1HB   SER  66           HB2      SER  66  78.531   1.750 -12.666
  610   2HB   SER  66           HB1      SER  66  78.620   0.705 -14.081
  611    HG   SER  66           HG       SER  66  76.761  -0.245 -13.510
  612    H    SER  67           HN       SER  67  81.175  -1.819 -11.767
  613    HA   SER  67           HA       SER  67  83.166  -0.163 -13.243
  614   1HB   SER  67           HB2      SER  67  83.302  -2.051 -10.941
  615   2HB   SER  67           HB1      SER  67  84.695  -1.997 -12.015
  616    HG   SER  67           HG       SER  67  84.338  -0.398 -10.103
   
  Start of MODEL           6
 Raw file had  616 H/Q atoms
  Start of MODEL    6
    1   1H    MET   1           HT3      MET   1  85.283  12.954  -6.260
    2   2H    MET   1           HT2      MET   1  86.438  13.650  -7.294
    3   3H    MET   1           HT1      MET   1  86.580  13.833  -5.611
    4    HA   MET   1           HA       MET   1  85.731  15.868  -6.263
    5   1HB   MET   1           HB2      MET   1  85.093  14.602  -8.579
    6   2HB   MET   1           HB1      MET   1  83.487  14.774  -7.872
    7   1HG   MET   1           HG2      MET   1  85.329  17.137  -7.846
    8   2HG   MET   1           HG1      MET   1  84.510  16.716  -9.350
    9   1HE   MET   1           HE1      MET   1  84.407  19.203  -8.290
   10   2HE   MET   1           HE3      MET   1  82.776  19.780  -7.917
   11   3HE   MET   1           HE2      MET   1  83.881  19.350  -6.615
   12    H    GLU   2           HN       GLU   2  83.075  13.472  -6.408
   13    HA   GLU   2           HA       GLU   2  81.832  14.841  -4.075
   14   1HB   GLU   2           HB2      GLU   2  80.801  13.090  -6.291
   15   2HB   GLU   2           HB1      GLU   2  79.894  13.202  -4.782
   16   1HG   GLU   2           HG2      GLU   2  80.836  15.734  -6.076
   17   2HG   GLU   2           HG1      GLU   2  79.432  14.909  -6.756
   18    H    THR   3           HN       THR   3  83.817  13.619  -2.993
   19    HA   THR   3           HA       THR   3  83.115  10.806  -2.360
   20    HB   THR   3           HB       THR   3  85.384  11.136  -1.017
   21    HG1  THR   3           HG1      THR   3  86.511  12.823  -1.618
   22   1HG2  THR   3          HG21      THR   3  85.147  10.911  -4.027
   23   2HG2  THR   3          HG23      THR   3  86.602  10.513  -3.113
   24   3HG2  THR   3          HG22      THR   3  85.123   9.584  -2.866
   25    H    LEU   4           HN       LEU   4  82.102  10.316  -0.482
   26    HA   LEU   4           HA       LEU   4  82.045  12.398   1.669
   27   1HB   LEU   4           HB2      LEU   4  79.947  10.722   0.443
   28   2HB   LEU   4           HB1      LEU   4  79.916  10.732   2.206
   29    HG   LEU   4           HG       LEU   4  80.293  13.366   0.878
   30   1HD1  LEU   4          HD12      LEU   4  78.406  11.846  -0.279
   31   2HD1  LEU   4          HD11      LEU   4  77.478  12.411   1.111
   32   3HD1  LEU   4          HD13      LEU   4  78.180  13.575  -0.012
   33   1HD2  LEU   4          HD21      LEU   4  79.989  12.667   3.422
   34   2HD2  LEU   4          HD23      LEU   4  79.270  14.156   2.810
   35   3HD2  LEU   4          HD22      LEU   4  78.277  12.710   2.999
   36    H    VAL   5           HN       VAL   5  81.360  11.128   3.856
   37    HA   VAL   5           HA       VAL   5  82.996   8.642   4.048
   38    HB   VAL   5           HB       VAL   5  83.090  10.892   6.076
   39   1HG1  VAL   5          HG13      VAL   5  83.579   8.306   6.541
   40   2HG1  VAL   5          HG12      VAL   5  85.135   8.727   5.825
   41   3HG1  VAL   5          HG11      VAL   5  84.568   9.573   7.265
   42   1HG2  VAL   5          HG22      VAL   5  84.141  11.566   3.932
   43   2HG2  VAL   5          HG21      VAL   5  85.349  11.345   5.197
   44   3HG2  VAL   5          HG23      VAL   5  85.126  10.103   3.964
   45    H    GLN   6           HN       GLN   6  80.673  10.769   5.701
   46    HA   GLN   6           HA       GLN   6  79.545   8.350   7.048
   47   1HB   GLN   6           HB2      GLN   6  80.401  10.402   8.396
   48   2HB   GLN   6           HB1      GLN   6  78.932  11.197   7.829
   49   1HG   GLN   6           HG2      GLN   6  78.304  10.234   9.898
   50   2HG   GLN   6           HG1      GLN   6  77.691   9.103   8.691
   51   1HE2  GLN   6          HE22      GLN   6  79.366   6.641  10.643
   52   2HE2  GLN   6          HE21      GLN   6  77.856   7.300  10.236
   53    H    ALA   7           HN       ALA   7  77.968   7.611   5.654
   54    HA   ALA   7           HA       ALA   7  76.361   9.280   3.979
   55   1HB   ALA   7           HB1      ALA   7  76.745   6.824   3.627
   56   2HB   ALA   7           HB3      ALA   7  75.698   6.507   5.010
   57   3HB   ALA   7           HB2      ALA   7  75.043   7.281   3.566
   58    NH1  ARG   8           NH2      ARG   8  71.761  12.411   9.523
   59    NH2  ARG   8           NH1      ARG   8  70.472  14.266   9.451
   60    H    ARG   8           HN       ARG   8  73.777   8.819   4.322
   61    HA   ARG   8           HA       ARG   8  73.165  10.130   6.886
   62   1HB   ARG   8           HB2      ARG   8  72.277  11.004   4.675
   63   2HB   ARG   8           HB1      ARG   8  71.270   9.558   4.598
   64   1HG   ARG   8           HG2      ARG   8  69.839  11.111   5.618
   65   2HG   ARG   8           HG1      ARG   8  70.519  10.253   7.002
   66   1HD   ARG   8           HD2      ARG   8  72.285  12.044   7.148
   67   2HD   ARG   8           HD1      ARG   8  71.406  12.935   5.906
   68    HE   ARG   8           HE       ARG   8  69.440  12.851   7.573
   69   1HH1  ARG   8          HH21      ARG   8  72.071  11.556   9.108
   70   2HH1  ARG   8          HH22      ARG   8  72.127  12.700  10.407
   71   1HH2  ARG   8          HH11      ARG   8  69.795  14.832   8.981
   72   2HH2  ARG   8          HH12      ARG   8  70.839  14.556  10.335
   73    H    LYS   9           HN       LYS   9  72.113   7.318   4.973
   74    HA   LYS   9           HA       LYS   9  71.685   5.767   7.392
   75   1HB   LYS   9           HB2      LYS   9  69.461   7.162   6.126
   76   2HB   LYS   9           HB1      LYS   9  69.203   5.418   6.120
   77   1HG   LYS   9           HG2      LYS   9  69.060   5.292   8.403
   78   2HG   LYS   9           HG1      LYS   9  70.229   6.589   8.653
   79   1HD   LYS   9           HD2      LYS   9  68.503   8.231   7.886
   80   2HD   LYS   9           HD1      LYS   9  67.339   6.910   7.792
   81   1HE   LYS   9           HE2      LYS   9  66.877   7.276   9.968
   82   2HE   LYS   9           HE1      LYS   9  68.490   6.674  10.348
   83   1HZ   LYS   9           HZ2      LYS   9  69.179   9.083   9.722
   84   2HZ   LYS   9           HZ1      LYS   9  67.555   9.445  10.068
   85   3HZ   LYS   9           HZ3      LYS   9  68.543   8.758  11.263
   86    NH1  ARG  10           NH2      ARG  10  71.982  -2.175   4.138
   87    NH2  ARG  10           NH1      ARG  10  73.509  -1.261   2.744
   88    H    ARG  10           HN       ARG  10  70.486   5.764   4.013
   89    HA   ARG  10           HA       ARG  10  72.245   3.565   3.303
   90   1HB   ARG  10           HB2      ARG  10  69.671   2.964   4.391
   91   2HB   ARG  10           HB1      ARG  10  69.624   2.575   2.673
   92   1HG   ARG  10           HG2      ARG  10  71.973   1.704   4.339
   93   2HG   ARG  10           HG1      ARG  10  70.479   0.767   4.366
   94   1HD   ARG  10           HD2      ARG  10  70.800   1.158   1.677
   95   2HD   ARG  10           HD1      ARG  10  72.478   1.058   2.211
   96    HE   ARG  10           HE       ARG  10  70.538  -1.130   2.220
   97   1HH1  ARG  10          HH21      ARG  10  71.035  -2.260   4.450
   98   2HH1  ARG  10          HH22      ARG  10  72.704  -2.705   4.581
   99   1HH2  ARG  10          HH11      ARG  10  73.733  -0.645   1.988
  100   2HH2  ARG  10          HH12      ARG  10  74.231  -1.792   3.188
  101    H    LYS  11           HN       LYS  11  69.108   4.978   2.304
  102    HA   LYS  11           HA       LYS  11  70.299   6.071  -0.120
  103   1HB   LYS  11           HB2      LYS  11  69.622   3.499  -0.409
  104   2HB   LYS  11           HB1      LYS  11  68.027   4.208  -0.652
  105   1HG   LYS  11           HG2      LYS  11  68.590   5.098  -2.667
  106   2HG   LYS  11           HG1      LYS  11  70.191   5.585  -2.110
  107   1HD   LYS  11           HD2      LYS  11  71.163   3.591  -2.721
  108   2HD   LYS  11           HD1      LYS  11  69.696   2.662  -2.414
  109   1HE   LYS  11           HE2      LYS  11  69.941   4.608  -4.717
  110   2HE   LYS  11           HE1      LYS  11  70.349   2.899  -4.865
  111   1HZ   LYS  11           HZ3      LYS  11  68.022   2.558  -3.835
  112   2HZ   LYS  11           HZ2      LYS  11  67.731   4.146  -4.367
  113   3HZ   LYS  11           HZ1      LYS  11  68.149   2.936  -5.483
  114    NH1  ARG  12           NH2      ARG  12  68.632  12.855  -1.851
  115    NH2  ARG  12           NH1      ARG  12  68.113  14.253  -0.154
  116    H    ARG  12           HN       ARG  12  68.922   7.661  -1.063
  117    HA   ARG  12           HA       ARG  12  66.153   7.931  -0.160
  118   1HB   ARG  12           HB2      ARG  12  66.537  10.196   0.855
  119   2HB   ARG  12           HB1      ARG  12  67.250   8.879   1.786
  120   1HG   ARG  12           HG2      ARG  12  69.391   9.542   1.337
  121   2HG   ARG  12           HG1      ARG  12  68.996  10.058  -0.302
  122   1HD   ARG  12           HD2      ARG  12  67.580  11.859   1.251
  123   2HD   ARG  12           HD1      ARG  12  69.059  11.621   2.182
  124    HE   ARG  12           HE       ARG  12  70.334  12.400   0.238
  125   1HH1  ARG  12          HH21      ARG  12  69.081  12.025  -2.184
  126   2HH1  ARG  12          HH22      ARG  12  68.132  13.442  -2.487
  127   1HH2  ARG  12          HH11      ARG  12  68.163  14.496   0.815
  128   2HH2  ARG  12          HH12      ARG  12  67.614  14.840  -0.791
  129    H    THR  13           HN       THR  13  67.386   7.697  -2.737
  130    HA   THR  13           HA       THR  13  67.540  10.353  -3.948
  131    HB   THR  13           HB       THR  13  67.102   7.793  -5.482
  132    HG1  THR  13           HG1      THR  13  68.733   7.159  -4.231
  133   1HG2  THR  13          HG21      THR  13  68.577  10.392  -5.953
  134   2HG2  THR  13          HG23      THR  13  68.760   8.985  -7.000
  135   3HG2  THR  13          HG22      THR  13  67.187   9.764  -6.837
  136    H    SER  14           HN       SER  14  65.147   7.797  -3.593
  137    HA   SER  14           HA       SER  14  63.001   9.698  -4.119
  138   1HB   SER  14           HB2      SER  14  63.627   8.967  -6.423
  139   2HB   SER  14           HB1      SER  14  63.305   7.300  -5.952
  140    HG   SER  14           HG       SER  14  61.590   9.196  -6.742
  141    H    ILE  15           HN       ILE  15  63.966   7.891  -2.010
  142    HA   ILE  15           HA       ILE  15  61.383   6.689  -1.305
  143    HB   ILE  15           HB       ILE  15  63.886   5.008  -1.669
  144   1HG1  ILE  15          HG12      ILE  15  62.478   5.275  -3.688
  145   2HG1  ILE  15          HG11      ILE  15  62.421   3.623  -3.088
  146   1HG2  ILE  15          HG22      ILE  15  61.431   4.566  -0.002
  147   2HG2  ILE  15          HG21      ILE  15  62.157   3.182  -0.817
  148   3HG2  ILE  15          HG23      ILE  15  63.104   4.124   0.335
  149   1HD1  ILE  15          HD13      ILE  15  60.342   5.071  -1.763
  150   2HD1  ILE  15          HD12      ILE  15  60.228   5.431  -3.486
  151   3HD1  ILE  15          HD11      ILE  15  60.183   3.760  -2.930
  152    H    GLU  16           HN       GLU  16  61.704   8.479   0.253
  153    HA   GLU  16           HA       GLU  16  63.864   8.559   2.109
  154   1HB   GLU  16           HB2      GLU  16  61.068   9.639   2.052
  155   2HB   GLU  16           HB1      GLU  16  61.951   9.661   3.579
  156   1HG   GLU  16           HG2      GLU  16  63.885  10.653   2.054
  157   2HG   GLU  16           HG1      GLU  16  62.526  11.128   1.035
  158    H    ASN  17           HN       ASN  17  63.955   7.686   4.245
  159    HA   ASN  17           HA       ASN  17  62.977   5.032   4.527
  160   1HB   ASN  17           HB2      ASN  17  64.172   7.023   6.446
  161   2HB   ASN  17           HB1      ASN  17  63.542   5.490   7.049
  162   1HD2  ASN  17          HD22      ASN  17  67.155   5.542   5.328
  163   2HD2  ASN  17          HD21      ASN  17  66.328   6.945   5.807
  164    NH1  ARG  18           NH2      ARG  18  61.210   9.590  11.500
  165    NH2  ARG  18           NH1      ARG  18  63.129  10.506  10.732
  166    H    ARG  18           HN       ARG  18  61.490   8.089   5.240
  167    HA   ARG  18           HA       ARG  18  59.431   6.886   6.955
  168   1HB   ARG  18           HB2      ARG  18  60.206   9.614   6.103
  169   2HB   ARG  18           HB1      ARG  18  58.470   9.366   6.296
  170   1HG   ARG  18           HG2      ARG  18  59.118   9.986   8.459
  171   2HG   ARG  18           HG1      ARG  18  59.143   8.226   8.555
  172   1HD   ARG  18           HD2      ARG  18  61.351   8.223   9.000
  173   2HD   ARG  18           HD1      ARG  18  61.691   9.214   7.582
  174    HE   ARG  18           HE       ARG  18  61.101  11.204   9.059
  175   1HH1  ARG  18          HH21      ARG  18  60.264   9.305  11.345
  176   2HH1  ARG  18          HH22      ARG  18  61.631   9.459  12.397
  177   1HH2  ARG  18          HH11      ARG  18  63.653  10.922   9.989
  178   2HH2  ARG  18          HH12      ARG  18  63.551  10.375  11.629
  179    H    VAL  19           HN       VAL  19  59.899   7.763   3.582
  180    HA   VAL  19           HA       VAL  19  57.131   7.644   2.846
  181    HB   VAL  19           HB       VAL  19  59.332   8.451   1.484
  182   1HG1  VAL  19          HG12      VAL  19  58.678   5.729   0.308
  183   2HG1  VAL  19          HG11      VAL  19  59.683   6.957  -0.451
  184   3HG1  VAL  19          HG13      VAL  19  60.211   6.193   1.046
  185   1HG2  VAL  19          HG23      VAL  19  56.670   7.444   0.464
  186   2HG2  VAL  19          HG22      VAL  19  57.114   9.100   0.875
  187   3HG2  VAL  19          HG21      VAL  19  57.799   8.333  -0.558
  188    NH1  ARG  20           NH1      ARG  20  64.323   1.552   0.215
  189    NH2  ARG  20           NH2      ARG  20  64.732   1.592   2.437
  190    H    ARG  20           HN       ARG  20  59.727   5.206   2.773
  191    HA   ARG  20           HA       ARG  20  58.113   3.092   1.738
  192   1HB   ARG  20           HB2      ARG  20  60.758   3.385   2.859
  193   2HB   ARG  20           HB1      ARG  20  59.992   1.949   3.532
  194   1HG   ARG  20           HG2      ARG  20  59.439   1.190   1.230
  195   2HG   ARG  20           HG1      ARG  20  60.284   2.598   0.584
  196   1HD   ARG  20           HD2      ARG  20  61.549   0.488   2.358
  197   2HD   ARG  20           HD1      ARG  20  61.723   0.566   0.604
  198    HE   ARG  20           HE       ARG  20  62.486   3.050   1.919
  199   1HH1  ARG  20          HH11      ARG  20  63.694   1.679  -0.552
  200   2HH1  ARG  20          HH12      ARG  20  65.267   1.269   0.046
  201   1HH2  ARG  20          HH21      ARG  20  64.416   1.749   3.373
  202   2HH2  ARG  20          HH22      ARG  20  65.676   1.308   2.269
  203    CH2  TRP  21           CH2      TRP  21  59.788  -1.868   6.052
  204    H    TRP  21           HN       TRP  21  58.861   3.862   5.159
  205    HA   TRP  21           HA       TRP  21  56.991   1.821   5.989
  206   1HB   TRP  21           HB2      TRP  21  58.810   3.657   7.365
  207   2HB   TRP  21           HB1      TRP  21  57.265   3.485   8.211
  208    HD1  TRP  21           HD1      TRP  21  57.892   1.732  10.069
  209    HE1  TRP  21           HE1      TRP  21  58.671  -0.733   9.995
  210    HE3  TRP  21           HE3      TRP  21  59.027   1.292   5.118
  211    HZ2  TRP  21           HZ2      TRP  21  59.626  -2.640   8.045
  212    HZ3  TRP  21           HZ3      TRP  21  59.840  -0.815   4.170
  213    HH2  TRP  21           HH2      TRP  21  60.132  -2.802   5.634
  214    H    SER  22           HN       SER  22  56.550   4.897   4.675
  215    HA   SER  22           HA       SER  22  54.023   5.526   5.954
  216   1HB   SER  22           HB2      SER  22  55.731   6.688   3.903
  217   2HB   SER  22           HB1      SER  22  54.062   6.625   3.344
  218    HG   SER  22           HG       SER  22  53.659   8.203   4.655
  219    H    LEU  23           HN       LEU  23  55.213   3.785   3.101
  220    HA   LEU  23           HA       LEU  23  52.761   3.054   1.851
  221   1HB   LEU  23           HB2      LEU  23  55.240   1.332   2.253
  222   2HB   LEU  23           HB1      LEU  23  53.969   1.005   1.102
  223    HG   LEU  23           HG       LEU  23  55.394   3.632   0.952
  224   1HD1  LEU  23          HD11      LEU  23  56.916   1.418   1.110
  225   2HD1  LEU  23          HD13      LEU  23  56.453   1.295  -0.587
  226   3HD1  LEU  23          HD12      LEU  23  57.302   2.725  -0.006
  227   1HD2  LEU  23          HD21      LEU  23  53.766   1.824  -0.783
  228   2HD2  LEU  23          HD23      LEU  23  53.775   3.586  -0.703
  229   3HD2  LEU  23          HD22      LEU  23  55.049   2.737  -1.576
  230    H    GLU  24           HN       GLU  24  54.605   1.650   4.500
  231    HA   GLU  24           HA       GLU  24  53.009  -0.616   5.081
  232   1HB   GLU  24           HB2      GLU  24  55.255   0.205   6.130
  233   2HB   GLU  24           HB1      GLU  24  54.216   1.054   7.275
  234   1HG   GLU  24           HG2      GLU  24  53.013  -1.228   7.550
  235   2HG   GLU  24           HG1      GLU  24  54.454  -1.912   6.796
  236    H    THR  25           HN       THR  25  52.783   2.626   6.566
  237    HA   THR  25           HA       THR  25  50.558   2.162   8.219
  238    HB   THR  25           HB       THR  25  51.114   4.743   6.739
  239    HG1  THR  25           HG1      THR  25  52.232   3.761   9.152
  240   1HG2  THR  25          HG23      THR  25  49.001   4.567   8.074
  241   2HG2  THR  25          HG22      THR  25  49.980   4.221   9.499
  242   3HG2  THR  25          HG21      THR  25  50.119   5.783   8.693
  243    H    MET  26           HN       MET  26  50.664   2.676   4.741
  244    HA   MET  26           HA       MET  26  47.746   3.119   4.608
  245   1HB   MET  26           HB2      MET  26  49.964   3.012   2.575
  246   2HB   MET  26           HB1      MET  26  48.272   3.000   2.076
  247   1HG   MET  26           HG2      MET  26  47.874   5.146   2.892
  248   2HG   MET  26           HG1      MET  26  49.207   5.064   4.045
  249   1HE   MET  26           HE1      MET  26  48.715   7.566   2.429
  250   2HE   MET  26           HE3      MET  26  50.149   7.385   3.450
  251   3HE   MET  26           HE2      MET  26  50.306   7.989   1.802
  252    H    PHE  27           HN       PHE  27  49.967   0.423   4.216
  253    HA   PHE  27           HA       PHE  27  47.892  -1.212   2.904
  254   1HB   PHE  27           HB2      PHE  27  50.804  -1.671   3.550
  255   2HB   PHE  27           HB1      PHE  27  49.745  -2.996   3.085
  256    HD1  PHE  27           HD1      PHE  27  48.241  -2.588   0.965
  257    HD2  PHE  27           HD2      PHE  27  51.828  -0.402   1.852
  258    HE1  PHE  27           HE1      PHE  27  48.435  -1.931  -1.418
  259    HE2  PHE  27           HE2      PHE  27  52.024   0.250  -0.526
  260    HZ   PHE  27           HZ       PHE  27  50.328  -0.513  -2.159
  261    H    LEU  28           HN       LEU  28  48.847  -0.554   6.115
  262    HA   LEU  28           HA       LEU  28  48.237  -3.189   7.189
  263   1HB   LEU  28           HB2      LEU  28  48.577  -0.484   8.506
  264   2HB   LEU  28           HB1      LEU  28  48.341  -1.995   9.392
  265    HG   LEU  28           HG       LEU  28  50.515  -1.701   7.319
  266   1HD1  LEU  28          HD11      LEU  28  50.596  -1.005  10.261
  267   2HD1  LEU  28          HD13      LEU  28  52.044  -1.344   9.314
  268   3HD1  LEU  28          HD12      LEU  28  51.019   0.029   8.896
  269   1HD2  LEU  28          HD22      LEU  28  49.535  -3.906   8.571
  270   2HD2  LEU  28          HD21      LEU  28  51.208  -3.755   8.035
  271   3HD2  LEU  28          HD23      LEU  28  50.788  -3.425   9.715
  272    H    LYS  29           HN       LYS  29  46.378  -0.402   6.288
  273    HA   LYS  29           HA       LYS  29  44.019  -1.399   7.806
  274   1HB   LYS  29           HB2      LYS  29  44.109   0.935   8.096
  275   2HB   LYS  29           HB1      LYS  29  44.717   1.212   6.468
  276   1HG   LYS  29           HG2      LYS  29  42.579   0.969   5.489
  277   2HG   LYS  29           HG1      LYS  29  41.938   0.096   6.880
  278   1HD   LYS  29           HD2      LYS  29  42.485   2.358   8.151
  279   2HD   LYS  29           HD1      LYS  29  42.376   3.044   6.530
  280   1HE   LYS  29           HE2      LYS  29  40.160   1.437   6.567
  281   2HE   LYS  29           HE1      LYS  29  40.245   1.938   8.254
  282   1HZ   LYS  29           HZ2      LYS  29  40.680   4.071   6.347
  283   2HZ   LYS  29           HZ1      LYS  29  39.128   3.382   6.288
  284   3HZ   LYS  29           HZ3      LYS  29  39.709   4.034   7.741
  285    H    CYS  30           HN       CYS  30  45.354  -1.038   4.581
  286    HA   CYS  30           HA       CYS  30  42.825  -2.153   3.469
  287   1HB   CYS  30           HB2      CYS  30  44.938  -0.341   2.341
  288   2HB   CYS  30           HB1      CYS  30  43.940  -1.311   1.258
  289    HG   CYS  30           HG       CYS  30  42.993   1.217   2.248
  290    HA   PRO  31           HA       PRO  31  45.760  -5.604   2.776
  291   1HB   PRO  31           HB2      PRO  31  44.024  -7.582   3.538
  292   2HB   PRO  31           HB1      PRO  31  45.061  -6.729   4.695
  293   1HG   PRO  31           HG2      PRO  31  42.129  -6.465   4.256
  294   2HG   PRO  31           HG1      PRO  31  43.079  -6.129   5.712
  295   1HD   PRO  31           HD2      PRO  31  42.090  -4.208   3.860
  296   2HD   PRO  31           HD1      PRO  31  43.248  -3.915   5.173
  297    H    LYS  32           HN       LYS  32  42.933  -4.350   1.504
  298    HA   LYS  32           HA       LYS  32  42.711  -6.440  -0.575
  299   1HB   LYS  32           HB2      LYS  32  40.348  -5.474  -0.838
  300   2HB   LYS  32           HB1      LYS  32  40.654  -6.384   0.639
  301   1HG   LYS  32           HG2      LYS  32  40.730  -4.442   1.980
  302   2HG   LYS  32           HG1      LYS  32  41.080  -3.391   0.607
  303   1HD   LYS  32           HD2      LYS  32  38.842  -3.511  -0.194
  304   2HD   LYS  32           HD1      LYS  32  38.466  -4.892   0.838
  305   1HE   LYS  32           HE2      LYS  32  38.468  -3.562   2.806
  306   2HE   LYS  32           HE1      LYS  32  39.276  -2.222   1.993
  307   1HZ   LYS  32           HZ1      LYS  32  37.182  -2.298   0.487
  308   2HZ   LYS  32           HZ3      LYS  32  36.476  -3.090   1.809
  309   3HZ   LYS  32           HZ2      LYS  32  37.108  -1.525   1.998
  310    HA   PRO  33           HA       PRO  33  43.702  -2.144  -2.403
  311   1HB   PRO  33           HB2      PRO  33  46.317  -2.518  -3.144
  312   2HB   PRO  33           HB1      PRO  33  45.837  -1.806  -1.592
  313   1HG   PRO  33           HG2      PRO  33  46.851  -4.562  -2.167
  314   2HG   PRO  33           HG1      PRO  33  47.045  -3.575  -0.708
  315   1HD   PRO  33           HD2      PRO  33  45.218  -5.680  -0.969
  316   2HD   PRO  33           HD1      PRO  33  45.124  -4.370   0.225
  317    H    SER  34           HN       SER  34  43.716  -1.818  -4.670
  318    HA   SER  34           HA       SER  34  43.462  -4.255  -6.307
  319   1HB   SER  34           HB2      SER  34  41.988  -1.990  -6.294
  320   2HB   SER  34           HB1      SER  34  43.168  -1.579  -7.535
  321    HG   SER  34           HG       SER  34  41.094  -2.877  -8.018
  322    H    LEU  35           HN       LEU  35  44.686  -4.482  -8.308
  323    HA   LEU  35           HA       LEU  35  47.464  -3.820  -8.058
  324   1HB   LEU  35           HB2      LEU  35  45.730  -4.770 -10.331
  325   2HB   LEU  35           HB1      LEU  35  47.411  -4.318 -10.627
  326    HG   LEU  35           HG       LEU  35  46.963  -6.036  -8.267
  327   1HD1  LEU  35          HD11      LEU  35  45.439  -6.800 -10.316
  328   2HD1  LEU  35          HD13      LEU  35  46.969  -7.454 -10.899
  329   3HD1  LEU  35          HD12      LEU  35  46.321  -7.979  -9.344
  330   1HD2  LEU  35          HD22      LEU  35  48.944  -5.733 -10.507
  331   2HD2  LEU  35          HD21      LEU  35  49.217  -5.677  -8.766
  332   3HD2  LEU  35          HD23      LEU  35  48.926  -7.223  -9.564
  333    H    GLN  36           HN       GLN  36  44.706  -2.077  -9.188
  334    HA   GLN  36           HA       GLN  36  46.151  -0.096 -10.772
  335   1HB   GLN  36           HB2      GLN  36  43.452   0.153  -9.398
  336   2HB   GLN  36           HB1      GLN  36  44.059   1.167 -10.707
  337   1HG   GLN  36           HG2      GLN  36  43.576  -0.382 -12.302
  338   2HG   GLN  36           HG1      GLN  36  44.108  -1.727 -11.294
  339   1HE2  GLN  36          HE22      GLN  36  40.229  -1.315 -11.728
  340   2HE2  GLN  36          HE21      GLN  36  41.424  -0.860 -12.844
  341    H    GLN  37           HN       GLN  37  44.989  -0.387  -7.439
  342    HA   GLN  37           HA       GLN  37  45.798   2.217  -6.555
  343   1HB   GLN  37           HB2      GLN  37  44.266   0.676  -5.282
  344   2HB   GLN  37           HB1      GLN  37  45.671  -0.321  -4.897
  345   1HG   GLN  37           HG2      GLN  37  46.724   1.895  -4.030
  346   2HG   GLN  37           HG1      GLN  37  45.065   2.493  -4.011
  347   1HE2  GLN  37          HE22      GLN  37  44.086  -0.063  -1.538
  348   2HE2  GLN  37          HE21      GLN  37  43.533   0.494  -3.043
  349    H    ILE  38           HN       ILE  38  47.512  -0.852  -6.936
  350    HA   ILE  38           HA       ILE  38  49.878  -0.017  -5.512
  351    HB   ILE  38           HB       ILE  38  49.375  -2.225  -7.538
  352   1HG1  ILE  38          HG12      ILE  38  48.414  -2.550  -5.299
  353   2HG1  ILE  38          HG11      ILE  38  49.762  -3.660  -5.544
  354   1HG2  ILE  38          HG21      ILE  38  51.954  -1.244  -6.348
  355   2HG2  ILE  38          HG23      ILE  38  51.726  -2.984  -6.522
  356   3HG2  ILE  38          HG22      ILE  38  51.652  -1.939  -7.940
  357   1HD1  ILE  38          HD13      ILE  38  50.946  -1.347  -4.480
  358   2HD1  ILE  38          HD12      ILE  38  49.455  -1.548  -3.562
  359   3HD1  ILE  38          HD11      ILE  38  50.637  -2.854  -3.617
  360    H    THR  39           HN       THR  39  48.663   0.325  -8.771
  361    HA   THR  39           HA       THR  39  51.098   1.274  -9.988
  362    HB   THR  39           HB       THR  39  48.521   2.426 -10.924
  363    HG1  THR  39           HG1      THR  39  49.082  -0.353 -10.922
  364   1HG2  THR  39          HG22      THR  39  50.816   0.919 -12.201
  365   2HG2  THR  39          HG21      THR  39  49.433   1.556 -13.091
  366   3HG2  THR  39          HG23      THR  39  50.529   2.658 -12.260
  367    H    HIS  40           HN       HIS  40  48.476   2.778  -8.177
  368    HA   HIS  40           HA       HIS  40  49.503   5.499  -8.456
  369   1HB   HIS  40           HB2      HIS  40  47.288   4.165  -6.966
  370   2HB   HIS  40           HB1      HIS  40  47.892   5.690  -6.315
  371    HD1  HIS  40           HD1      HIS  40  47.326   4.566  -9.923
  372    HD2  HIS  40           HD2      HIS  40  46.213   7.633  -7.328
  373    HE1  HIS  40           HE1      HIS  40  45.933   6.185 -11.284
  374    H    ILE  41           HN       ILE  41  50.183   2.765  -6.432
  375    HA   ILE  41           HA       ILE  41  51.290   4.225  -4.202
  376    HB   ILE  41           HB       ILE  41  51.078   1.419  -5.088
  377   1HG1  ILE  41          HG12      ILE  41  51.171   1.241  -2.450
  378   2HG1  ILE  41          HG11      ILE  41  50.960   2.988  -2.541
  379   1HG2  ILE  41          HG22      ILE  41  53.486   2.198  -3.422
  380   2HG2  ILE  41          HG21      ILE  41  52.931   0.551  -3.722
  381   3HG2  ILE  41          HG23      ILE  41  53.543   1.532  -5.054
  382   1HD1  ILE  41          HD12      ILE  41  49.164   1.028  -3.992
  383   2HD1  ILE  41          HD11      ILE  41  48.803   1.664  -2.388
  384   3HD1  ILE  41          HD13      ILE  41  48.901   2.757  -3.768
  385    H    ALA  42           HN       ALA  42  52.590   2.829  -7.210
  386    HA   ALA  42           HA       ALA  42  55.316   3.529  -6.752
  387   1HB   ALA  42           HB1      ALA  42  54.030   2.106  -8.689
  388   2HB   ALA  42           HB3      ALA  42  54.363   3.606  -9.555
  389   3HB   ALA  42           HB2      ALA  42  55.689   2.684  -8.848
  390    H    ASN  43           HN       ASN  43  52.786   5.190  -8.617
  391    HA   ASN  43           HA       ASN  43  54.341   7.539  -9.139
  392   1HB   ASN  43           HB2      ASN  43  51.979   6.724 -10.060
  393   2HB   ASN  43           HB1      ASN  43  51.380   7.728  -8.738
  394   1HD2  ASN  43          HD22      ASN  43  51.922   9.787 -11.893
  395   2HD2  ASN  43          HD21      ASN  43  51.118   8.315 -11.632
  396    H    GLN  44           HN       GLN  44  52.834   6.304  -6.286
  397    HA   GLN  44           HA       GLN  44  52.498   8.835  -4.937
  398   1HB   GLN  44           HB2      GLN  44  52.060   5.994  -4.364
  399   2HB   GLN  44           HB1      GLN  44  52.519   6.943  -2.957
  400   1HG   GLN  44           HG2      GLN  44  50.246   7.592  -4.861
  401   2HG   GLN  44           HG1      GLN  44  50.059   6.872  -3.263
  402   1HE2  GLN  44          HE22      GLN  44  49.762  10.690  -3.184
  403   2HE2  GLN  44          HE21      GLN  44  49.083   9.550  -4.242
  404    H    LEU  45           HN       LEU  45  55.109   6.452  -5.155
  405    HA   LEU  45           HA       LEU  45  56.747   8.370  -3.577
  406   1HB   LEU  45           HB2      LEU  45  57.753   6.717  -2.236
  407   2HB   LEU  45           HB1      LEU  45  56.043   6.317  -2.227
  408    HG   LEU  45           HG       LEU  45  58.019   5.022  -4.107
  409   1HD1  LEU  45          HD11      LEU  45  58.388   4.719  -1.537
  410   2HD1  LEU  45          HD13      LEU  45  56.906   3.769  -1.608
  411   3HD1  LEU  45          HD12      LEU  45  58.312   3.278  -2.547
  412   1HD2  LEU  45          HD23      LEU  45  55.145   4.687  -3.346
  413   2HD2  LEU  45          HD22      LEU  45  55.886   4.637  -4.944
  414   3HD2  LEU  45          HD21      LEU  45  56.067   3.270  -3.845
  415    H    GLY  46           HN       GLY  46  56.450   7.794  -6.486
  416   1HA   GLY  46           HA2      GLY  46  57.793   7.532  -8.388
  417   2HA   GLY  46           HA1      GLY  46  58.955   8.417  -7.417
  418    H    LEU  47           HN       LEU  47  57.950   5.123  -6.572
  419    HA   LEU  47           HA       LEU  47  60.751   4.287  -7.166
  420   1HB   LEU  47           HB2      LEU  47  60.704   2.831  -5.399
  421   2HB   LEU  47           HB1      LEU  47  59.456   3.916  -4.823
  422    HG   LEU  47           HG       LEU  47  59.048   1.298  -6.272
  423   1HD1  LEU  47          HD12      LEU  47  59.552   1.736  -3.605
  424   2HD1  LEU  47          HD11      LEU  47  57.790   1.744  -3.650
  425   3HD1  LEU  47          HD13      LEU  47  58.680   0.345  -4.243
  426   1HD2  LEU  47          HD23      LEU  47  57.265   3.571  -5.853
  427   2HD2  LEU  47          HD22      LEU  47  57.133   2.237  -6.985
  428   3HD2  LEU  47          HD21      LEU  47  56.592   2.041  -5.322
  429    H    GLU  48           HN       GLU  48  60.815   1.792  -7.735
  430    HA   GLU  48           HA       GLU  48  59.165   1.479 -10.167
  431   1HB   GLU  48           HB2      GLU  48  61.730   1.068 -10.021
  432   2HB   GLU  48           HB1      GLU  48  61.294  -0.442  -9.220
  433   1HG   GLU  48           HG2      GLU  48  59.930  -1.103 -11.146
  434   2HG   GLU  48           HG1      GLU  48  60.282   0.431 -11.944
  435    H    LYS  49           HN       LYS  49  57.802  -0.350 -10.443
  436    HA   LYS  49           HA       LYS  49  56.354  -1.243  -8.178
  437   1HB   LYS  49           HB2      LYS  49  55.823  -1.352 -10.761
  438   2HB   LYS  49           HB1      LYS  49  56.512  -2.970 -10.617
  439   1HG   LYS  49           HG2      LYS  49  54.847  -2.864  -8.424
  440   2HG   LYS  49           HG1      LYS  49  53.945  -1.926  -9.614
  441   1HD   LYS  49           HD2      LYS  49  54.351  -3.838 -11.249
  442   2HD   LYS  49           HD1      LYS  49  54.938  -4.773  -9.872
  443   1HE   LYS  49           HE2      LYS  49  52.290  -3.395  -9.632
  444   2HE   LYS  49           HE1      LYS  49  52.385  -4.877 -10.583
  445   1HZ   LYS  49           HZ2      LYS  49  53.388  -4.611  -7.803
  446   2HZ   LYS  49           HZ1      LYS  49  51.868  -5.250  -8.212
  447   3HZ   LYS  49           HZ3      LYS  49  53.281  -6.039  -8.719
  448    H    ASP  50           HN       ASP  50  59.392  -2.371  -9.422
  449    HA   ASP  50           HA       ASP  50  59.227  -5.056  -8.355
  450   1HB   ASP  50           HB2      ASP  50  60.791  -4.190 -10.202
  451   2HB   ASP  50           HB1      ASP  50  61.774  -3.526  -8.898
  452    H    VAL  51           HN       VAL  51  60.427  -1.947  -7.064
  453    HA   VAL  51           HA       VAL  51  61.484  -3.307  -4.670
  454    HB   VAL  51           HB       VAL  51  62.654  -1.318  -5.501
  455   1HG1  VAL  51          HG11      VAL  51  59.933  -0.284  -5.619
  456   2HG1  VAL  51          HG13      VAL  51  61.024   0.838  -4.810
  457   3HG1  VAL  51          HG12      VAL  51  61.379   0.283  -6.444
  458   1HG2  VAL  51          HG23      VAL  51  62.472  -1.814  -2.995
  459   2HG2  VAL  51          HG22      VAL  51  62.896  -0.156  -3.421
  460   3HG2  VAL  51          HG21      VAL  51  61.247  -0.546  -2.932
  461    H    VAL  52           HN       VAL  52  58.550  -1.724  -5.711
  462    HA   VAL  52           HA       VAL  52  57.499  -1.348  -3.032
  463    HB   VAL  52           HB       VAL  52  56.856  -0.289  -5.469
  464   1HG1  VAL  52          HG12      VAL  52  55.755  -2.452  -6.163
  465   2HG1  VAL  52          HG11      VAL  52  54.559  -2.169  -4.897
  466   3HG1  VAL  52          HG13      VAL  52  54.714  -1.030  -6.235
  467   1HG2  VAL  52          HG21      VAL  52  56.202   0.189  -2.921
  468   2HG2  VAL  52          HG23      VAL  52  55.369   0.973  -4.258
  469   3HG2  VAL  52          HG22      VAL  52  54.645  -0.428  -3.473
  470    NH1  ARG  53           NH2      ARG  53  55.867  -9.816  -8.725
  471    NH2  ARG  53           NH1      ARG  53  55.183 -11.020  -6.936
  472    H    ARG  53           HN       ARG  53  57.484  -3.900  -5.437
  473    HA   ARG  53           HA       ARG  53  55.420  -5.474  -4.104
  474   1HB   ARG  53           HB2      ARG  53  56.273  -5.505  -6.616
  475   2HB   ARG  53           HB1      ARG  53  57.414  -6.690  -5.979
  476   1HG   ARG  53           HG2      ARG  53  54.573  -7.027  -5.166
  477   2HG   ARG  53           HG1      ARG  53  54.951  -7.364  -6.856
  478   1HD   ARG  53           HD2      ARG  53  56.699  -8.498  -4.692
  479   2HD   ARG  53           HD1      ARG  53  55.172  -9.288  -5.086
  480    HE   ARG  53           HE       ARG  53  57.535  -9.115  -6.846
  481   1HH1  ARG  53          HH21      ARG  53  56.400  -9.062  -9.108
  482   2HH1  ARG  53          HH22      ARG  53  55.323 -10.401  -9.327
  483   1HH2  ARG  53          HH11      ARG  53  55.194 -11.187  -5.950
  484   2HH2  ARG  53          HH12      ARG  53  54.639 -11.605  -7.537
  485    H    VAL  54           HN       VAL  54  58.981  -5.460  -4.209
  486    HA   VAL  54           HA       VAL  54  59.383  -7.854  -2.693
  487    HB   VAL  54           HB       VAL  54  61.128  -5.369  -2.767
  488   1HG1  VAL  54          HG11      VAL  54  61.567  -8.228  -1.902
  489   2HG1  VAL  54          HG13      VAL  54  62.915  -7.213  -2.417
  490   3HG1  VAL  54          HG12      VAL  54  61.940  -6.745  -1.023
  491   1HG2  VAL  54          HG23      VAL  54  60.358  -6.813  -4.939
  492   2HG2  VAL  54          HG22      VAL  54  61.941  -6.048  -4.798
  493   3HG2  VAL  54          HG21      VAL  54  61.753  -7.759  -4.418
  494    CH2  TRP  55           CH2      TRP  55  53.967  -1.521   2.852
  495    H    TRP  55           HN       TRP  55  59.123  -4.435  -1.611
  496    HA   TRP  55           HA       TRP  55  59.424  -5.073   1.173
  497   1HB   TRP  55           HB2      TRP  55  59.683  -2.767   0.641
  498   2HB   TRP  55           HB1      TRP  55  58.175  -2.718  -0.264
  499    HD1  TRP  55           HD1      TRP  55  59.495  -2.779   3.376
  500    HE1  TRP  55           HE1      TRP  55  57.589  -1.994   4.923
  501    HE3  TRP  55           HE3      TRP  55  55.616  -2.513   0.052
  502    HZ2  TRP  55           HZ2      TRP  55  54.856  -1.334   4.792
  503    HZ3  TRP  55           HZ3      TRP  55  53.372  -1.825   0.816
  504    HH2  TRP  55           HH2      TRP  55  52.986  -1.219   3.183
  505    H    PHE  56           HN       PHE  56  56.477  -4.688  -0.875
  506    HA   PHE  56           HA       PHE  56  54.848  -5.489   1.388
  507   1HB   PHE  56           HB2      PHE  56  54.132  -3.970  -0.646
  508   2HB   PHE  56           HB1      PHE  56  53.682  -5.524  -1.360
  509    HD1  PHE  56           HD2      PHE  56  53.573  -4.093   2.102
  510    HD2  PHE  56           HD1      PHE  56  51.384  -6.010  -1.048
  511    HE1  PHE  56           HE2      PHE  56  51.594  -4.182   3.553
  512    HE2  PHE  56           HE1      PHE  56  49.386  -6.115   0.427
  513    HZ   PHE  56           HZ       PHE  56  49.516  -5.196   2.739
  514    H    CYS  57           HN       CYS  57  56.827  -7.334  -0.443
  515    HA   CYS  57           HA       CYS  57  55.001  -9.606  -0.803
  516   1HB   CYS  57           HB2      CYS  57  57.056  -9.225  -2.255
  517   2HB   CYS  57           HB1      CYS  57  58.039  -9.622  -0.846
  518    HG   CYS  57           HG       CYS  57  55.942 -11.704  -1.848
  519    H    ASN  58           HN       ASN  58  57.441  -8.455   1.450
  520    HA   ASN  58           HA       ASN  58  57.049 -10.789   3.224
  521   1HB   ASN  58           HB2      ASN  58  58.834  -8.354   3.278
  522   2HB   ASN  58           HB1      ASN  58  58.620  -9.348   4.720
  523   1HD2  ASN  58          HD22      ASN  58  60.621 -12.001   3.511
  524   2HD2  ASN  58          HD21      ASN  58  59.626 -11.433   4.763
  525    NH1  ARG  59           NH2      ARG  59  58.415  -6.777   6.532
  526    NH2  ARG  59           NH1      ARG  59  59.479  -5.584   4.934
  527    H    ARG  59           HN       ARG  59  56.028  -7.443   2.864
  528    HA   ARG  59           HA       ARG  59  54.919  -7.198   5.537
  529   1HB   ARG  59           HB2      ARG  59  55.241  -5.451   3.248
  530   2HB   ARG  59           HB1      ARG  59  53.553  -5.431   3.736
  531   1HG   ARG  59           HG2      ARG  59  55.071  -3.716   4.819
  532   2HG   ARG  59           HG1      ARG  59  54.057  -4.650   5.896
  533   1HD   ARG  59           HD2      ARG  59  56.510  -4.298   6.600
  534   2HD   ARG  59           HD1      ARG  59  55.910  -5.951   6.661
  535    HE   ARG  59           HE       ARG  59  57.063  -5.496   4.096
  536   1HH1  ARG  59          HH21      ARG  59  57.567  -7.073   6.973
  537   2HH1  ARG  59          HH22      ARG  59  59.296  -7.102   6.876
  538   1HH2  ARG  59          HH11      ARG  59  59.446  -4.964   4.150
  539   2HH2  ARG  59          HH12      ARG  59  60.360  -5.909   5.278
  540    NH1  ARG  60           NH1      ARG  60  50.971 -10.865  -3.340
  541    NH2  ARG  60           NH2      ARG  60  51.396 -12.980  -2.664
  542    H    ARG  60           HN       ARG  60  53.851  -8.572   2.495
  543    HA   ARG  60           HA       ARG  60  51.049  -8.713   3.432
  544   1HB   ARG  60           HB2      ARG  60  50.547  -9.679   1.273
  545   2HB   ARG  60           HB1      ARG  60  51.627  -8.316   1.001
  546   1HG   ARG  60           HG2      ARG  60  53.551  -9.907   0.900
  547   2HG   ARG  60           HG1      ARG  60  52.419 -11.245   1.071
  548   1HD   ARG  60           HD2      ARG  60  51.842  -9.256  -1.070
  549   2HD   ARG  60           HD1      ARG  60  53.201 -10.350  -1.334
  550    HE   ARG  60           HE       ARG  60  50.770 -11.713  -0.454
  551   1HH1  ARG  60          HH11      ARG  60  50.845  -9.897  -3.126
  552   2HH1  ARG  60          HH12      ARG  60  50.898 -11.182  -4.285
  553   1HH2  ARG  60          HH21      ARG  60  51.596 -13.632  -1.932
  554   2HH2  ARG  60          HH22      ARG  60  51.324 -13.297  -3.609
  555    H    GLN  61           HN       GLN  61  53.894 -10.741   3.063
  556    HA   GLN  61           HA       GLN  61  52.419 -12.972   4.400
  557   1HB   GLN  61           HB2      GLN  61  54.677 -13.012   2.384
  558   2HB   GLN  61           HB1      GLN  61  54.270 -14.419   3.367
  559   1HG   GLN  61           HG2      GLN  61  52.066 -13.031   1.894
  560   2HG   GLN  61           HG1      GLN  61  53.162 -14.068   0.981
  561   1HE2  GLN  61          HE22      GLN  61  50.225 -15.912   2.764
  562   2HE2  GLN  61          HE21      GLN  61  50.212 -14.355   2.089
  563    H    LYS  62           HN       LYS  62  53.227 -11.211   6.140
  564    HA   LYS  62           HA       LYS  62  56.005 -11.581   6.975
  565   1HB   LYS  62           HB2      LYS  62  55.338 -10.149   8.889
  566   2HB   LYS  62           HB1      LYS  62  54.892  -9.432   7.341
  567   1HG   LYS  62           HG2      LYS  62  52.597 -10.063   7.604
  568   2HG   LYS  62           HG1      LYS  62  52.973 -11.106   8.976
  569   1HD   LYS  62           HD2      LYS  62  52.128  -9.161   9.995
  570   2HD   LYS  62           HD1      LYS  62  53.876  -8.935  10.088
  571   1HE   LYS  62           HE2      LYS  62  53.894  -7.375   8.329
  572   2HE   LYS  62           HE1      LYS  62  52.325  -7.903   7.721
  573   1HZ   LYS  62           HZ3      LYS  62  52.626  -6.693  10.401
  574   2HZ   LYS  62           HZ2      LYS  62  52.404  -5.738   9.014
  575   3HZ   LYS  62           HZ1      LYS  62  51.217  -6.863   9.473
  576    H    GLY  63           HN       GLY  63  52.889 -12.993   7.720
  577   1HA   GLY  63           HA2      GLY  63  53.351 -15.377   8.694
  578   2HA   GLY  63           HA1      GLY  63  54.074 -14.468  10.022
  579    H    LYS  64           HN       LYS  64  51.026 -14.649   8.162
  580    HA   LYS  64           HA       LYS  64  49.562 -13.696  10.571
  581   1HB   LYS  64           HB2      LYS  64  49.255 -12.827   8.090
  582   2HB   LYS  64           HB1      LYS  64  48.230 -14.255   7.945
  583   1HG   LYS  64           HG2      LYS  64  46.649 -12.772   8.716
  584   2HG   LYS  64           HG1      LYS  64  47.276 -13.327  10.268
  585   1HD   LYS  64           HD2      LYS  64  48.150 -11.299  10.757
  586   2HD   LYS  64           HD1      LYS  64  48.869 -11.136   9.156
  587   1HE   LYS  64           HE2      LYS  64  46.280 -10.796   8.495
  588   2HE   LYS  64           HE1      LYS  64  46.228 -10.193  10.151
  589   1HZ   LYS  64           HZ2      LYS  64  48.317  -9.312   8.259
  590   2HZ   LYS  64           HZ1      LYS  64  46.799  -8.552   8.309
  591   3HZ   LYS  64           HZ3      LYS  64  47.790  -8.555   9.686
  592    NH1  ARG  65           NH2      ARG  65  50.476 -21.774   7.370
  593    NH2  ARG  65           NH1      ARG  65  52.454 -21.925   6.286
  594    H    ARG  65           HN       ARG  65  50.714 -16.442  10.280
  595    HA   ARG  65           HA       ARG  65  48.162 -17.998  10.385
  596   1HB   ARG  65           HB2      ARG  65  49.641 -20.001   9.926
  597   2HB   ARG  65           HB1      ARG  65  49.533 -18.847   8.598
  598   1HG   ARG  65           HG2      ARG  65  51.693 -18.023   8.962
  599   2HG   ARG  65           HG1      ARG  65  51.728 -18.578  10.636
  600   1HD   ARG  65           HD2      ARG  65  53.109 -20.133   9.541
  601   2HD   ARG  65           HD1      ARG  65  51.554 -20.963   9.607
  602    HE   ARG  65           HE       ARG  65  52.361 -19.443   7.164
  603   1HH1  ARG  65          HH21      ARG  65  49.873 -21.297   8.010
  604   2HH1  ARG  65          HH22      ARG  65  50.167 -22.613   6.923
  605   1HH2  ARG  65          HH11      ARG  65  53.366 -21.563   6.094
  606   2HH2  ARG  65          HH12      ARG  65  52.145 -22.764   5.838
  607    H    SER  66           HN       SER  66  51.165 -17.225  12.035
  608    HA   SER  66           HA       SER  66  50.041 -18.360  14.521
  609   1HB   SER  66           HB2      SER  66  51.559 -20.075  13.220
  610   2HB   SER  66           HB1      SER  66  52.877 -19.084  13.839
  611    HG   SER  66           HG       SER  66  50.810 -20.307  15.362
  612    H    SER  67           HN       SER  67  51.399 -17.689  16.428
  613    HA   SER  67           HA       SER  67  52.409 -14.939  15.988
  614   1HB   SER  67           HB2      SER  67  51.319 -16.478  18.277
  615   2HB   SER  67           HB1      SER  67  52.590 -15.326  18.676
  616    HG   SER  67           HG       SER  67  50.485 -14.392  18.700
   
  Start of MODEL           7
 Raw file had  616 H/Q atoms
  Start of MODEL    7
    1   1H    MET   1           HT1      MET   1  57.579   8.056  18.791
    2   2H    MET   1           HT3      MET   1  58.523   8.093  17.383
    3   3H    MET   1           HT2      MET   1  59.006   7.139  18.702
    4    HA   MET   1           HA       MET   1  60.353   9.101  18.654
    5   1HB   MET   1           HB2      MET   1  58.642  10.439  17.371
    6   2HB   MET   1           HB1      MET   1  57.749  10.637  18.877
    7   1HG   MET   1           HG2      MET   1  60.634  11.294  19.039
    8   2HG   MET   1           HG1      MET   1  59.686  12.364  18.009
    9   1HE   MET   1           HE3      MET   1  57.138  12.565  18.777
   10   2HE   MET   1           HE2      MET   1  56.793  13.459  20.255
   11   3HE   MET   1           HE1      MET   1  57.836  14.171  19.026
   12    H    GLU   2           HN       GLU   2  57.305   9.531  20.490
   13    HA   GLU   2           HA       GLU   2  58.826   9.803  22.984
   14   1HB   GLU   2           HB2      GLU   2  56.558  10.074  24.006
   15   2HB   GLU   2           HB1      GLU   2  56.849  11.193  22.675
   16   1HG   GLU   2           HG2      GLU   2  55.447  10.022  21.208
   17   2HG   GLU   2           HG1      GLU   2  55.553   8.531  22.145
   18    H    THR   3           HN       THR   3  57.149   7.275  21.269
   19    HA   THR   3           HA       THR   3  56.899   5.557  23.645
   20    HB   THR   3           HB       THR   3  56.457   3.856  21.586
   21    HG1  THR   3           HG1      THR   3  56.484   4.977  19.822
   22   1HG2  THR   3          HG21      THR   3  54.695   5.861  22.959
   23   2HG2  THR   3          HG23      THR   3  54.021   4.815  21.709
   24   3HG2  THR   3          HG22      THR   3  54.749   4.108  23.152
   25    H    LEU   4           HN       LEU   4  58.640   4.504  24.424
   26    HA   LEU   4           HA       LEU   4  60.931   3.957  22.610
   27   1HB   LEU   4           HB2      LEU   4  61.007   5.084  25.019
   28   2HB   LEU   4           HB1      LEU   4  61.021   3.403  25.551
   29    HG   LEU   4           HG       LEU   4  62.862   4.022  23.314
   30   1HD1  LEU   4          HD12      LEU   4  62.858   6.003  25.072
   31   2HD1  LEU   4          HD11      LEU   4  63.775   4.854  26.046
   32   3HD1  LEU   4          HD13      LEU   4  64.380   5.350  24.466
   33   1HD2  LEU   4          HD23      LEU   4  63.100   2.559  25.964
   34   2HD2  LEU   4          HD22      LEU   4  62.819   1.825  24.385
   35   3HD2  LEU   4          HD21      LEU   4  64.360   2.609  24.732
   36    H    VAL   5           HN       VAL   5  61.419   1.895  22.001
   37    HA   VAL   5           HA       VAL   5  60.002  -0.342  23.391
   38    HB   VAL   5           HB       VAL   5  60.622  -0.173  20.429
   39   1HG1  VAL   5          HG12      VAL   5  59.514  -2.245  22.254
   40   2HG1  VAL   5          HG11      VAL   5  58.714  -2.064  20.692
   41   3HG1  VAL   5          HG13      VAL   5  60.437  -2.435  20.763
   42   1HG2  VAL   5          HG23      VAL   5  58.062   0.305  21.983
   43   2HG2  VAL   5          HG22      VAL   5  58.897   1.442  20.924
   44   3HG2  VAL   5          HG21      VAL   5  58.103   0.022  20.242
   45    H    GLN   6           HN       GLN   6  62.804   0.575  21.409
   46    HA   GLN   6           HA       GLN   6  64.282  -1.745  22.587
   47   1HB   GLN   6           HB2      GLN   6  64.885  -0.262  20.011
   48   2HB   GLN   6           HB1      GLN   6  65.697  -1.711  20.604
   49   1HG   GLN   6           HG2      GLN   6  63.294  -2.742  20.628
   50   2HG   GLN   6           HG1      GLN   6  62.907  -1.424  19.521
   51   1HE2  GLN   6          HE22      GLN   6  65.710  -4.175  18.269
   52   2HE2  GLN   6          HE21      GLN   6  65.608  -3.801  19.921
   53    H    ALA   7           HN       ALA   7  66.774  -1.215  22.561
   54    HA   ALA   7           HA       ALA   7  67.230   0.921  24.390
   55   1HB   ALA   7           HB1      ALA   7  68.672  -1.142  24.068
   56   2HB   ALA   7           HB3      ALA   7  69.318  -0.370  22.620
   57   3HB   ALA   7           HB2      ALA   7  69.562   0.374  24.200
   58    NH1  ARG   8           NH2      ARG   8  71.744   8.432  19.538
   59    NH2  ARG   8           NH1      ARG   8  70.003   8.168  18.121
   60    H    ARG   8           HN       ARG   8  68.407   0.641  21.014
   61    HA   ARG   8           HA       ARG   8  67.723   3.412  20.466
   62   1HB   ARG   8           HB2      ARG   8  70.287   2.833  21.565
   63   2HB   ARG   8           HB1      ARG   8  70.535   3.226  19.865
   64   1HG   ARG   8           HG2      ARG   8  68.676   4.972  21.414
   65   2HG   ARG   8           HG1      ARG   8  70.401   5.126  21.750
   66   1HD   ARG   8           HD2      ARG   8  70.718   5.287  19.206
   67   2HD   ARG   8           HD1      ARG   8  68.973   5.528  19.117
   68    HE   ARG   8           HE       ARG   8  69.722   7.402  20.969
   69   1HH1  ARG   8          HH21      ARG   8  72.195   8.220  20.405
   70   2HH1  ARG   8          HH22      ARG   8  72.176   9.060  18.891
   71   1HH2  ARG   8          HH11      ARG   8  69.119   7.754  17.903
   72   2HH2  ARG   8          HH12      ARG   8  70.435   8.796  17.473
   73    H    LYS   9           HN       LYS   9  67.264   0.690  19.365
   74    HA   LYS   9           HA       LYS   9  68.598   0.909  16.732
   75   1HB   LYS   9           HB2      LYS   9  68.350  -1.273  18.293
   76   2HB   LYS   9           HB1      LYS   9  66.859  -1.416  17.363
   77   1HG   LYS   9           HG2      LYS   9  69.236  -0.739  15.745
   78   2HG   LYS   9           HG1      LYS   9  69.312  -2.322  16.518
   79   1HD   LYS   9           HD2      LYS   9  66.885  -2.622  15.622
   80   2HD   LYS   9           HD1      LYS   9  67.290  -1.290  14.539
   81   1HE   LYS   9           HE2      LYS   9  67.854  -3.261  13.331
   82   2HE   LYS   9           HE1      LYS   9  69.390  -2.631  13.928
   83   1HZ   LYS   9           HZ2      LYS   9  67.856  -4.583  15.519
   84   2HZ   LYS   9           HZ1      LYS   9  68.857  -5.110  14.251
   85   3HZ   LYS   9           HZ3      LYS   9  69.522  -4.248  15.552
   86    NH1  ARG  10           NH1      ARG  10  60.451   5.262  16.601
   87    NH2  ARG  10           NH2      ARG  10  59.106   4.299  18.141
   88    H    ARG  10           HN       ARG  10  66.409   2.676  17.533
   89    HA   ARG  10           HA       ARG  10  64.147   1.708  15.900
   90   1HB   ARG  10           HB2      ARG  10  64.486   3.882  17.945
   91   2HB   ARG  10           HB1      ARG  10  63.136   3.943  16.810
   92   1HG   ARG  10           HG2      ARG  10  62.907   1.378  17.575
   93   2HG   ARG  10           HG1      ARG  10  63.660   2.028  19.033
   94   1HD   ARG  10           HD2      ARG  10  61.205   2.152  19.196
   95   2HD   ARG  10           HD1      ARG  10  61.909   3.768  19.160
   96    HE   ARG  10           HE       ARG  10  60.967   2.613  16.592
   97   1HH1  ARG  10          HH11      ARG  10  61.259   5.227  16.015
   98   2HH1  ARG  10          HH12      ARG  10  59.863   6.072  16.596
   99   1HH2  ARG  10          HH21      ARG  10  58.884   3.526  18.735
  100   2HH2  ARG  10          HH22      ARG  10  58.519   5.108  18.134
  101    H    LYS  11           HN       LYS  11  66.551   2.413  14.523
  102    HA   LYS  11           HA       LYS  11  66.261   5.115  13.478
  103   1HB   LYS  11           HB2      LYS  11  67.944   2.851  12.377
  104   2HB   LYS  11           HB1      LYS  11  68.149   4.574  12.064
  105   1HG   LYS  11           HG2      LYS  11  68.223   4.518  14.804
  106   2HG   LYS  11           HG1      LYS  11  68.976   2.975  14.406
  107   1HD   LYS  11           HD2      LYS  11  70.501   4.193  12.828
  108   2HD   LYS  11           HD1      LYS  11  69.818   5.711  13.411
  109   1HE   LYS  11           HE2      LYS  11  70.429   4.810  15.777
  110   2HE   LYS  11           HE1      LYS  11  71.490   3.703  14.906
  111   1HZ   LYS  11           HZ2      LYS  11  72.422   5.699  13.770
  112   2HZ   LYS  11           HZ1      LYS  11  71.546   6.666  14.858
  113   3HZ   LYS  11           HZ3      LYS  11  72.748   5.619  15.435
  114    NH1  ARG  12           NH2      ARG  12  64.305   9.279  12.483
  115    NH2  ARG  12           NH1      ARG  12  62.328   8.546  13.297
  116    H    ARG  12           HN       ARG  12  66.610   4.855  10.766
  117    HA   ARG  12           HA       ARG  12  64.052   3.555   9.926
  118   1HB   ARG  12           HB2      ARG  12  65.540   5.983   8.934
  119   2HB   ARG  12           HB1      ARG  12  64.355   5.166   7.916
  120   1HG   ARG  12           HG2      ARG  12  62.888   6.575   8.959
  121   2HG   ARG  12           HG1      ARG  12  62.942   5.350  10.226
  122   1HD   ARG  12           HD2      ARG  12  64.643   6.587  11.432
  123   2HD   ARG  12           HD1      ARG  12  64.790   7.749  10.113
  124    HE   ARG  12           HE       ARG  12  62.133   7.941  10.800
  125   1HH1  ARG  12          HH21      ARG  12  64.984   9.303  11.749
  126   2HH1  ARG  12          HH22      ARG  12  64.463   9.792  13.326
  127   1HH2  ARG  12          HH11      ARG  12  61.492   8.008  13.187
  128   2HH2  ARG  12          HH12      ARG  12  62.486   9.058  14.141
  129    H    THR  13           HN       THR  13  66.656   2.193  10.161
  130    HA   THR  13           HA       THR  13  67.589   1.830   7.393
  131    HB   THR  13           HB       THR  13  68.351   0.188   9.819
  132    HG1  THR  13           HG1      THR  13  69.968   1.704  10.142
  133   1HG2  THR  13          HG22      THR  13  68.947  -0.379   7.324
  134   2HG2  THR  13          HG21      THR  13  70.117   0.928   7.508
  135   3HG2  THR  13          HG23      THR  13  70.197  -0.483   8.565
  136    H    SER  14           HN       SER  14  65.501   0.230   9.713
  137    HA   SER  14           HA       SER  14  65.234  -2.161   7.991
  138   1HB   SER  14           HB2      SER  14  65.236  -2.085  10.617
  139   2HB   SER  14           HB1      SER  14  63.549  -1.618  10.423
  140    HG   SER  14           HG       SER  14  64.014  -3.941  10.578
  141    H    ILE  15           HN       ILE  15  62.571  -2.779   8.195
  142    HA   ILE  15           HA       ILE  15  61.356  -0.703   6.474
  143    HB   ILE  15           HB       ILE  15  60.463  -3.513   7.176
  144   1HG1  ILE  15          HG12      ILE  15  62.458  -3.352   5.710
  145   2HG1  ILE  15          HG11      ILE  15  61.068  -3.991   4.836
  146   1HG2  ILE  15          HG21      ILE  15  59.257  -1.514   5.227
  147   2HG2  ILE  15          HG23      ILE  15  58.755  -3.196   5.404
  148   3HG2  ILE  15          HG22      ILE  15  58.515  -2.059   6.731
  149   1HD1  ILE  15          HD12      ILE  15  60.931  -1.174   4.558
  150   2HD1  ILE  15          HD11      ILE  15  62.615  -1.613   4.275
  151   3HD1  ILE  15          HD13      ILE  15  61.338  -2.354   3.314
  152    H    GLU  16           HN       GLU  16  60.938   0.882   8.110
  153    HA   GLU  16           HA       GLU  16  59.344   0.299  10.436
  154   1HB   GLU  16           HB2      GLU  16  60.845   2.441   9.700
  155   2HB   GLU  16           HB1      GLU  16  59.238   3.029   9.272
  156   1HG   GLU  16           HG2      GLU  16  58.439   2.496  11.551
  157   2HG   GLU  16           HG1      GLU  16  60.052   1.926  11.979
  158    H    ASN  17           HN       ASN  17  57.054   0.817  10.655
  159    HA   ASN  17           HA       ASN  17  55.479   0.010   8.426
  160   1HB   ASN  17           HB2      ASN  17  53.526   0.752   9.767
  161   2HB   ASN  17           HB1      ASN  17  54.654  -0.198  10.733
  162   1HD2  ASN  17          HD22      ASN  17  53.931   3.669  11.712
  163   2HD2  ASN  17          HD21      ASN  17  53.155   2.928  10.397
  164    NH1  ARG  18           NH2      ARG  18  52.894   9.460  10.120
  165    NH2  ARG  18           NH1      ARG  18  54.671  10.280  11.251
  166    H    ARG  18           HN       ARG  18  56.716   3.125   9.344
  167    HA   ARG  18           HA       ARG  18  54.875   4.593   7.592
  168   1HB   ARG  18           HB2      ARG  18  56.442   5.298   9.774
  169   2HB   ARG  18           HB1      ARG  18  57.339   5.977   8.417
  170   1HG   ARG  18           HG2      ARG  18  55.355   7.172   7.649
  171   2HG   ARG  18           HG1      ARG  18  54.379   6.421   8.912
  172   1HD   ARG  18           HD2      ARG  18  55.564   7.571  10.643
  173   2HD   ARG  18           HD1      ARG  18  56.822   8.098   9.525
  174    HE   ARG  18           HE       ARG  18  55.073   9.561   8.462
  175   1HH1  ARG  18          HH21      ARG  18  52.521   8.956   9.341
  176   2HH1  ARG  18          HH22      ARG  18  52.278   9.840  10.810
  177   1HH2  ARG  18          HH11      ARG  18  55.659  10.405  11.338
  178   2HH2  ARG  18          HH12      ARG  18  54.056  10.660  11.943
  179    H    VAL  19           HN       VAL  19  58.064   3.135   7.418
  180    HA   VAL  19           HA       VAL  19  58.868   4.544   5.031
  181    HB   VAL  19           HB       VAL  19  60.261   3.032   6.803
  182   1HG1  VAL  19          HG13      VAL  19  59.883   1.222   4.393
  183   2HG1  VAL  19          HG12      VAL  19  61.090   1.009   5.654
  184   3HG1  VAL  19          HG11      VAL  19  59.377   0.866   6.047
  185   1HG2  VAL  19          HG23      VAL  19  61.135   4.645   5.148
  186   2HG2  VAL  19          HG22      VAL  19  62.102   3.169   5.163
  187   3HG2  VAL  19          HG21      VAL  19  60.931   3.444   3.873
  188    NH1  ARG  20           NH1      ARG  20  54.273  -5.463   3.286
  189    NH2  ARG  20           NH2      ARG  20  55.907  -6.036   4.740
  190    H    ARG  20           HN       ARG  20  57.346   1.403   5.637
  191    HA   ARG  20           HA       ARG  20  57.254   0.590   2.896
  192   1HB   ARG  20           HB2      ARG  20  56.559  -0.565   5.305
  193   2HB   ARG  20           HB1      ARG  20  54.987  -0.283   4.560
  194   1HG   ARG  20           HG2      ARG  20  56.008  -1.353   2.441
  195   2HG   ARG  20           HG1      ARG  20  57.289  -1.928   3.509
  196   1HD   ARG  20           HD2      ARG  20  55.189  -2.684   4.987
  197   2HD   ARG  20           HD1      ARG  20  54.413  -2.718   3.404
  198    HE   ARG  20           HE       ARG  20  56.920  -4.085   3.241
  199   1HH1  ARG  20          HH11      ARG  20  53.884  -4.814   2.632
  200   2HH1  ARG  20          HH12      ARG  20  53.798  -6.320   3.482
  201   1HH2  ARG  20          HH21      ARG  20  56.769  -5.827   5.200
  202   2HH2  ARG  20          HH22      ARG  20  55.432  -6.895   4.935
  203    CH2  TRP  21           CH2      TRP  21  50.819  -1.488   2.547
  204    H    TRP  21           HN       TRP  21  54.785   2.207   4.921
  205    HA   TRP  21           HA       TRP  21  53.110   2.532   2.577
  206   1HB   TRP  21           HB2      TRP  21  52.843   3.105   5.439
  207   2HB   TRP  21           HB1      TRP  21  52.139   4.372   4.426
  208    HD1  TRP  21           HD1      TRP  21  49.595   3.695   4.631
  209    HE1  TRP  21           HE1      TRP  21  48.239   1.656   3.802
  210    HE3  TRP  21           HE3      TRP  21  53.390   0.524   3.403
  211    HZ2  TRP  21           HZ2      TRP  21  48.743  -0.986   2.729
  212    HZ3  TRP  21           HZ3      TRP  21  52.968  -1.695   2.485
  213    HH2  TRP  21           HH2      TRP  21  50.629  -2.466   2.130
  214    H    SER  22           HN       SER  22  55.915   4.106   3.639
  215    HA   SER  22           HA       SER  22  55.335   6.708   2.482
  216   1HB   SER  22           HB2      SER  22  57.150   6.802   3.996
  217   2HB   SER  22           HB1      SER  22  57.837   5.294   3.411
  218    HG   SER  22           HG       SER  22  58.635   7.604   2.731
  219    H    LEU  23           HN       LEU  23  56.706   3.594   1.509
  220    HA   LEU  23           HA       LEU  23  57.550   4.206  -1.150
  221   1HB   LEU  23           HB2      LEU  23  56.173   1.689  -0.131
  222   2HB   LEU  23           HB1      LEU  23  57.046   1.812  -1.638
  223    HG   LEU  23           HG       LEU  23  58.492   2.518   0.877
  224   1HD1  LEU  23          HD13      LEU  23  57.096   0.234   0.932
  225   2HD1  LEU  23          HD12      LEU  23  58.452  -0.334  -0.040
  226   3HD1  LEU  23          HD11      LEU  23  58.734   0.316   1.575
  227   1HD2  LEU  23          HD22      LEU  23  59.257   2.508  -1.701
  228   2HD2  LEU  23          HD21      LEU  23  60.370   2.055  -0.410
  229   3HD2  LEU  23          HD23      LEU  23  59.547   0.806  -1.343
  230    H    GLU  24           HN       GLU  24  54.454   3.206   0.219
  231    HA   GLU  24           HA       GLU  24  52.850   3.089  -2.094
  232   1HB   GLU  24           HB2      GLU  24  52.164   2.512   0.269
  233   2HB   GLU  24           HB1      GLU  24  51.960   4.239   0.560
  234   1HG   GLU  24           HG2      GLU  24  50.531   4.023  -1.712
  235   2HG   GLU  24           HG1      GLU  24  50.310   2.389  -1.085
  236    H    THR  25           HN       THR  25  53.337   5.959  -0.007
  237    HA   THR  25           HA       THR  25  51.791   7.757  -1.552
  238    HB   THR  25           HB       THR  25  53.524   9.469  -0.506
  239    HG1  THR  25           HG1      THR  25  54.942   8.584   0.748
  240   1HG2  THR  25          HG23      THR  25  51.109   8.333   0.309
  241   2HG2  THR  25          HG22      THR  25  52.165   8.141   1.709
  242   3HG2  THR  25          HG21      THR  25  51.889   9.744   1.027
  243    H    MET  26           HN       MET  26  55.079   6.602  -2.048
  244    HA   MET  26           HA       MET  26  55.656   8.685  -4.045
  245   1HB   MET  26           HB2      MET  26  57.317   7.402  -2.462
  246   2HB   MET  26           HB1      MET  26  57.294   6.191  -3.744
  247   1HG   MET  26           HG2      MET  26  58.189   7.674  -5.335
  248   2HG   MET  26           HG1      MET  26  57.740   9.098  -4.396
  249   1HE   MET  26           HE1      MET  26  58.760   9.795  -2.193
  250   2HE   MET  26           HE3      MET  26  60.525   9.913  -2.228
  251   3HE   MET  26           HE2      MET  26  59.574  10.467  -3.603
  252    H    PHE  27           HN       PHE  27  54.343   5.450  -4.061
  253    HA   PHE  27           HA       PHE  27  54.817   5.147  -6.959
  254   1HB   PHE  27           HB2      PHE  27  53.737   3.343  -4.805
  255   2HB   PHE  27           HB1      PHE  27  53.442   2.980  -6.501
  256    HD1  PHE  27           HD1      PHE  27  55.515   3.039  -8.092
  257    HD2  PHE  27           HD2      PHE  27  55.768   2.687  -3.821
  258    HE1  PHE  27           HE1      PHE  27  57.808   2.117  -8.300
  259    HE2  PHE  27           HE2      PHE  27  58.055   1.767  -4.026
  260    HZ   PHE  27           HZ       PHE  27  59.077   1.484  -6.263
  261    H    LEU  28           HN       LEU  28  52.349   6.408  -4.923
  262    HA   LEU  28           HA       LEU  28  50.201   5.797  -6.844
  263   1HB   LEU  28           HB2      LEU  28  50.270   7.212  -4.180
  264   2HB   LEU  28           HB1      LEU  28  48.820   7.165  -5.185
  265    HG   LEU  28           HG       LEU  28  50.349   4.710  -4.270
  266   1HD1  LEU  28          HD12      LEU  28  49.156   6.064  -2.460
  267   2HD1  LEU  28          HD11      LEU  28  47.653   5.668  -3.293
  268   3HD1  LEU  28          HD13      LEU  28  48.655   4.380  -2.622
  269   1HD2  LEU  28          HD23      LEU  28  48.003   5.223  -6.036
  270   2HD2  LEU  28          HD22      LEU  28  49.203   3.932  -6.109
  271   3HD2  LEU  28          HD21      LEU  28  47.884   3.844  -4.941
  272    H    LYS  29           HN       LYS  29  52.532   7.724  -7.463
  273    HA   LYS  29           HA       LYS  29  50.903  10.161  -8.009
  274   1HB   LYS  29           HB2      LYS  29  53.018  11.314  -8.432
  275   2HB   LYS  29           HB1      LYS  29  53.095  10.512  -6.867
  276   1HG   LYS  29           HG2      LYS  29  54.237   8.565  -8.045
  277   2HG   LYS  29           HG1      LYS  29  54.351   9.601  -9.469
  278   1HD   LYS  29           HD2      LYS  29  55.308  10.662  -6.833
  279   2HD   LYS  29           HD1      LYS  29  56.332   9.531  -7.719
  280   1HE   LYS  29           HE2      LYS  29  56.561  10.976  -9.554
  281   2HE   LYS  29           HE1      LYS  29  55.121  11.900  -9.127
  282   1HZ   LYS  29           HZ3      LYS  29  57.380  11.841  -7.254
  283   2HZ   LYS  29           HZ2      LYS  29  57.483  12.833  -8.629
  284   3HZ   LYS  29           HZ1      LYS  29  56.223  13.055  -7.511
  285    H    CYS  30           HN       CYS  30  53.023   7.787  -9.537
  286    HA   CYS  30           HA       CYS  30  51.589   8.201 -12.082
  287   1HB   CYS  30           HB2      CYS  30  54.585   8.340 -11.684
  288   2HB   CYS  30           HB1      CYS  30  53.863   7.982 -13.253
  289    HG   CYS  30           HG       CYS  30  53.481  10.684 -11.726
  290    HA   PRO  31           HA       PRO  31  51.947   3.733 -11.627
  291   1HB   PRO  31           HB2      PRO  31  50.456   3.044 -13.813
  292   2HB   PRO  31           HB1      PRO  31  49.730   3.647 -12.313
  293   1HG   PRO  31           HG2      PRO  31  50.054   5.031 -14.924
  294   2HG   PRO  31           HG1      PRO  31  48.880   5.334 -13.634
  295   1HD   PRO  31           HD2      PRO  31  51.266   6.819 -14.165
  296   2HD   PRO  31           HD1      PRO  31  50.181   7.005 -12.772
  297    H    LYS  32           HN       LYS  32  53.925   5.418 -13.394
  298    HA   LYS  32           HA       LYS  32  54.625   3.206 -15.242
  299   1HB   LYS  32           HB2      LYS  32  55.578   4.986 -16.733
  300   2HB   LYS  32           HB1      LYS  32  53.829   5.092 -16.524
  301   1HG   LYS  32           HG2      LYS  32  54.016   6.908 -14.990
  302   2HG   LYS  32           HG1      LYS  32  55.747   6.642 -14.772
  303   1HD   LYS  32           HD2      LYS  32  54.782   7.193 -17.542
  304   2HD   LYS  32           HD1      LYS  32  54.813   8.543 -16.410
  305   1HE   LYS  32           HE2      LYS  32  57.033   8.743 -16.715
  306   2HE   LYS  32           HE1      LYS  32  57.265   7.114 -16.089
  307   1HZ   LYS  32           HZ2      LYS  32  56.300   7.199 -18.812
  308   2HZ   LYS  32           HZ1      LYS  32  57.831   7.902 -18.603
  309   3HZ   LYS  32           HZ3      LYS  32  57.568   6.296 -18.130
  310    HA   PRO  33           HA       PRO  33  58.296   4.460 -12.517
  311   1HB   PRO  33           HB2      PRO  33  58.429   2.266 -10.871
  312   2HB   PRO  33           HB1      PRO  33  57.555   3.751 -10.455
  313   1HG   PRO  33           HG2      PRO  33  56.469   1.114 -11.339
  314   2HG   PRO  33           HG1      PRO  33  55.728   2.345 -10.301
  315   1HD   PRO  33           HD2      PRO  33  55.111   1.932 -13.021
  316   2HD   PRO  33           HD1      PRO  33  54.720   3.384 -12.075
  317    H    SER  34           HN       SER  34  60.375   3.626 -12.957
  318    HA   SER  34           HA       SER  34  60.512   1.507 -14.991
  319   1HB   SER  34           HB2      SER  34  61.763   3.819 -14.964
  320   2HB   SER  34           HB1      SER  34  62.895   2.961 -13.926
  321    HG   SER  34           HG       SER  34  62.702   2.880 -16.560
  322    H    LEU  35           HN       LEU  35  61.817  -0.364 -14.772
  323    HA   LEU  35           HA       LEU  35  61.868  -1.599 -12.183
  324   1HB   LEU  35           HB2      LEU  35  63.162  -2.181 -14.837
  325   2HB   LEU  35           HB1      LEU  35  63.672  -3.086 -13.410
  326    HG   LEU  35           HG       LEU  35  60.756  -2.817 -13.691
  327   1HD1  LEU  35          HD13      LEU  35  62.379  -4.394 -15.709
  328   2HD1  LEU  35          HD12      LEU  35  60.647  -4.603 -15.451
  329   3HD1  LEU  35          HD11      LEU  35  61.270  -3.067 -16.055
  330   1HD2  LEU  35          HD22      LEU  35  62.764  -4.977 -13.056
  331   2HD2  LEU  35          HD21      LEU  35  61.525  -4.288 -12.009
  332   3HD2  LEU  35          HD23      LEU  35  61.067  -5.374 -13.321
  333    H    GLN  36           HN       GLN  36  64.017   0.518 -13.895
  334    HA   GLN  36           HA       GLN  36  66.369   0.059 -12.238
  335   1HB   GLN  36           HB2      GLN  36  65.580   1.857 -14.417
  336   2HB   GLN  36           HB1      GLN  36  66.523   2.690 -13.182
  337   1HG   GLN  36           HG2      GLN  36  68.336   1.126 -13.392
  338   2HG   GLN  36           HG1      GLN  36  67.369   0.053 -14.405
  339   1HE2  GLN  36          HE22      GLN  36  68.554   1.649 -17.300
  340   2HE2  GLN  36          HE21      GLN  36  68.136   0.203 -16.515
  341    H    GLN  37           HN       GLN  37  63.600   2.239 -12.212
  342    HA   GLN  37           HA       GLN  37  64.401   3.834  -9.972
  343   1HB   GLN  37           HB2      GLN  37  62.478   4.278 -11.626
  344   2HB   GLN  37           HB1      GLN  37  61.539   3.141 -10.657
  345   1HG   GLN  37           HG2      GLN  37  61.430   4.555  -8.846
  346   2HG   GLN  37           HG1      GLN  37  62.999   5.284  -9.189
  347   1HE2  GLN  37          HE22      GLN  37  59.978   6.620 -11.637
  348   2HE2  GLN  37          HE21      GLN  37  60.158   4.953 -11.374
  349    H    ILE  38           HN       ILE  38  62.929   0.644 -10.274
  350    HA   ILE  38           HA       ILE  38  62.108   0.444  -7.517
  351    HB   ILE  38           HB       ILE  38  62.573  -1.595  -9.704
  352   1HG1  ILE  38          HG12      ILE  38  60.482  -0.308  -9.764
  353   2HG1  ILE  38          HG11      ILE  38  60.142  -1.986  -9.346
  354   1HG2  ILE  38          HG22      ILE  38  62.140  -2.091  -6.755
  355   2HG2  ILE  38          HG21      ILE  38  61.494  -3.218  -7.947
  356   3HG2  ILE  38          HG23      ILE  38  63.231  -2.921  -7.864
  357   1HD1  ILE  38          HD13      ILE  38  60.356  -1.143  -6.867
  358   2HD1  ILE  38          HD12      ILE  38  60.087   0.446  -7.577
  359   3HD1  ILE  38          HD11      ILE  38  58.868  -0.814  -7.755
  360    H    THR  39           HN       THR  39  65.051  -0.186  -9.306
  361    HA   THR  39           HA       THR  39  66.520  -1.493  -7.209
  362    HB   THR  39           HB       THR  39  68.033   0.354  -8.977
  363    HG1  THR  39           HG1      THR  39  66.531  -1.833  -9.979
  364   1HG2  THR  39          HG22      THR  39  68.184  -2.455  -7.961
  365   2HG2  THR  39          HG21      THR  39  69.086  -2.033  -9.417
  366   3HG2  THR  39          HG23      THR  39  69.399  -1.179  -7.906
  367    H    HIS  40           HN       HIS  40  66.125   1.909  -8.118
  368    HA   HIS  40           HA       HIS  40  67.749   2.970  -5.964
  369   1HB   HIS  40           HB2      HIS  40  65.707   4.144  -7.848
  370   2HB   HIS  40           HB1      HIS  40  66.363   5.098  -6.517
  371    HD1  HIS  40           HD1      HIS  40  69.102   5.194  -6.458
  372    HD2  HIS  40           HD2      HIS  40  67.353   4.093 -10.076
  373    HE1  HIS  40           HE1      HIS  40  70.882   5.495  -8.234
  374    H    ILE  41           HN       ILE  41  64.526   1.741  -6.182
  375    HA   ILE  41           HA       ILE  41  63.411   3.133  -3.921
  376    HB   ILE  41           HB       ILE  41  62.634   1.041  -5.798
  377   1HG1  ILE  41          HG12      ILE  41  60.320   2.000  -4.652
  378   2HG1  ILE  41          HG11      ILE  41  61.458   3.307  -4.332
  379   1HG2  ILE  41          HG23      ILE  41  61.928   0.585  -2.904
  380   2HG2  ILE  41          HG22      ILE  41  60.914  -0.002  -4.221
  381   3HG2  ILE  41          HG21      ILE  41  62.574  -0.574  -4.066
  382   1HD1  ILE  41          HD11      ILE  41  61.122   2.063  -7.071
  383   2HD1  ILE  41          HD13      ILE  41  60.202   3.468  -6.541
  384   3HD1  ILE  41          HD12      ILE  41  61.958   3.560  -6.666
  385    H    ALA  42           HN       ALA  42  65.047   0.011  -4.381
  386    HA   ALA  42           HA       ALA  42  64.937  -0.880  -1.687
  387   1HB   ALA  42           HB2      ALA  42  66.546  -1.538  -4.095
  388   2HB   ALA  42           HB1      ALA  42  67.235  -2.011  -2.542
  389   3HB   ALA  42           HB3      ALA  42  65.647  -2.610  -3.020
  390    H    ASN  43           HN       ASN  43  67.575   0.799  -3.404
  391    HA   ASN  43           HA       ASN  43  69.171   1.204  -1.059
  392   1HB   ASN  43           HB2      ASN  43  69.002   2.720  -3.677
  393   2HB   ASN  43           HB1      ASN  43  70.183   3.097  -2.423
  394   1HD2  ASN  43          HD22      ASN  43  71.864  -0.133  -2.840
  395   2HD2  ASN  43          HD21      ASN  43  71.311   0.870  -1.587
  396    H    GLN  44           HN       GLN  44  66.234   2.641  -2.177
  397    HA   GLN  44           HA       GLN  44  66.505   5.146  -0.763
  398   1HB   GLN  44           HB2      GLN  44  64.530   3.831  -2.473
  399   2HB   GLN  44           HB1      GLN  44  63.814   4.822  -1.208
  400   1HG   GLN  44           HG2      GLN  44  65.999   5.792  -3.068
  401   2HG   GLN  44           HG1      GLN  44  64.281   6.042  -3.374
  402   1HE2  GLN  44          HE22      GLN  44  66.185   8.309  -0.574
  403   2HE2  GLN  44          HE21      GLN  44  66.997   7.043  -1.361
  404    H    LEU  45           HN       LEU  45  65.182   1.966   0.065
  405    HA   LEU  45           HA       LEU  45  64.744   3.057   2.804
  406   1HB   LEU  45           HB2      LEU  45  62.646   2.005   3.080
  407   2HB   LEU  45           HB1      LEU  45  62.575   2.725   1.480
  408    HG   LEU  45           HG       LEU  45  63.390  -0.151   1.869
  409   1HD1  LEU  45          HD12      LEU  45  60.961   0.751   2.714
  410   2HD1  LEU  45          HD11      LEU  45  60.623   0.438   1.012
  411   3HD1  LEU  45          HD13      LEU  45  61.231  -0.854   2.043
  412   1HD2  LEU  45          HD22      LEU  45  62.695   1.690  -0.356
  413   2HD2  LEU  45          HD21      LEU  45  63.855   0.364  -0.308
  414   3HD2  LEU  45          HD23      LEU  45  62.136   0.025  -0.497
  415    H    GLY  46           HN       GLY  46  66.880   1.385   1.468
  416   1HA   GLY  46           HA2      GLY  46  68.217  -0.466   1.965
  417   2HA   GLY  46           HA1      GLY  46  67.753  -0.112   3.622
  418    H    LEU  47           HN       LEU  47  65.315  -1.190   1.278
  419    HA   LEU  47           HA       LEU  47  65.119  -3.693   2.886
  420   1HB   LEU  47           HB2      LEU  47  62.854  -3.713   2.599
  421   2HB   LEU  47           HB1      LEU  47  63.074  -2.008   2.276
  422    HG   LEU  47           HG       LEU  47  62.836  -4.219   0.234
  423   1HD1  LEU  47          HD11      LEU  47  60.805  -3.106   1.556
  424   2HD1  LEU  47          HD13      LEU  47  61.026  -1.852   0.337
  425   3HD1  LEU  47          HD12      LEU  47  60.677  -3.508  -0.155
  426   1HD2  LEU  47          HD21      LEU  47  63.951  -1.548   0.015
  427   2HD2  LEU  47          HD23      LEU  47  64.005  -2.877  -1.131
  428   3HD2  LEU  47          HD22      LEU  47  62.617  -1.796  -1.099
  429    H    GLU  48           HN       GLU  48  64.237  -5.603   1.476
  430    HA   GLU  48           HA       GLU  48  66.174  -5.964  -0.728
  431   1HB   GLU  48           HB2      GLU  48  65.301  -8.351  -0.684
  432   2HB   GLU  48           HB1      GLU  48  66.143  -7.827   0.770
  433   1HG   GLU  48           HG2      GLU  48  64.087  -7.508   1.948
  434   2HG   GLU  48           HG1      GLU  48  63.151  -7.687   0.471
  435    H    LYS  49           HN       LYS  49  65.476  -6.597  -2.816
  436    HA   LYS  49           HA       LYS  49  63.151  -5.276  -3.791
  437   1HB   LYS  49           HB2      LYS  49  64.588  -7.573  -5.135
  438   2HB   LYS  49           HB1      LYS  49  63.621  -6.320  -5.910
  439   1HG   LYS  49           HG2      LYS  49  65.429  -4.989  -6.066
  440   2HG   LYS  49           HG1      LYS  49  65.632  -5.032  -4.316
  441   1HD   LYS  49           HD2      LYS  49  67.031  -6.967  -4.430
  442   2HD   LYS  49           HD1      LYS  49  66.609  -7.258  -6.118
  443   1HE   LYS  49           HE2      LYS  49  67.895  -5.443  -6.882
  444   2HE   LYS  49           HE1      LYS  49  67.923  -4.675  -5.295
  445   1HZ   LYS  49           HZ1      LYS  49  69.178  -7.308  -5.784
  446   2HZ   LYS  49           HZ3      LYS  49  70.019  -5.857  -6.038
  447   3HZ   LYS  49           HZ2      LYS  49  69.437  -6.240  -4.488
  448    H    ASP  50           HN       ASP  50  63.429  -8.324  -2.197
  449    HA   ASP  50           HA       ASP  50  61.133  -9.558  -3.484
  450   1HB   ASP  50           HB2      ASP  50  62.613 -10.212  -0.921
  451   2HB   ASP  50           HB1      ASP  50  61.315 -11.200  -1.593
  452    H    VAL  51           HN       VAL  51  61.628  -7.516  -0.611
  453    HA   VAL  51           HA       VAL  51  58.829  -7.942   0.213
  454    HB   VAL  51           HB       VAL  51  60.532  -7.679   1.976
  455   1HG1  VAL  51          HG13      VAL  51  61.279  -5.372   0.329
  456   2HG1  VAL  51          HG12      VAL  51  61.166  -4.989   2.042
  457   3HG1  VAL  51          HG11      VAL  51  62.238  -6.273   1.495
  458   1HG2  VAL  51          HG21      VAL  51  58.567  -5.378   1.746
  459   2HG2  VAL  51          HG23      VAL  51  58.285  -6.935   2.524
  460   3HG2  VAL  51          HG22      VAL  51  59.430  -5.793   3.227
  461    H    VAL  52           HN       VAL  52  60.799  -5.659  -1.576
  462    HA   VAL  52           HA       VAL  52  58.735  -3.592  -1.575
  463    HB   VAL  52           HB       VAL  52  61.421  -3.531  -2.046
  464   1HG1  VAL  52          HG11      VAL  52  61.131  -4.626  -4.288
  465   2HG1  VAL  52          HG13      VAL  52  60.220  -3.205  -4.801
  466   3HG1  VAL  52          HG12      VAL  52  61.916  -3.048  -4.346
  467   1HG2  VAL  52          HG22      VAL  52  59.454  -1.734  -1.735
  468   2HG2  VAL  52          HG21      VAL  52  61.083  -1.270  -2.215
  469   3HG2  VAL  52          HG23      VAL  52  59.822  -1.442  -3.434
  470    NH1  ARG  53           NH2      ARG  53  57.976 -10.565  -9.940
  471    NH2  ARG  53           NH1      ARG  53  56.077 -11.004  -8.796
  472    H    ARG  53           HN       ARG  53  59.507  -6.389  -3.521
  473    HA   ARG  53           HA       ARG  53  57.787  -5.568  -5.745
  474   1HB   ARG  53           HB2      ARG  53  59.868  -7.107  -5.862
  475   2HB   ARG  53           HB1      ARG  53  58.788  -8.370  -5.266
  476   1HG   ARG  53           HG2      ARG  53  57.833  -6.700  -7.550
  477   2HG   ARG  53           HG1      ARG  53  59.080  -7.902  -7.882
  478   1HD   ARG  53           HD2      ARG  53  56.891  -8.912  -6.190
  479   2HD   ARG  53           HD1      ARG  53  56.377  -8.424  -7.805
  480    HE   ARG  53           HE       ARG  53  58.582 -10.391  -7.337
  481   1HH1  ARG  53          HH21      ARG  53  58.902 -10.188  -9.969
  482   2HH1  ARG  53          HH22      ARG  53  57.580 -10.979 -10.759
  483   1HH2  ARG  53          HH11      ARG  53  55.549 -10.964  -7.948
  484   2HH2  ARG  53          HH12      ARG  53  55.679 -11.418  -9.615
  485    H    VAL  54           HN       VAL  54  57.587  -7.855  -3.005
  486    HA   VAL  54           HA       VAL  54  55.031  -8.951  -3.739
  487    HB   VAL  54           HB       VAL  54  56.204  -8.631  -0.954
  488   1HG1  VAL  54          HG12      VAL  54  53.957 -10.266  -2.130
  489   2HG1  VAL  54          HG11      VAL  54  54.801 -10.805  -0.678
  490   3HG1  VAL  54          HG13      VAL  54  53.946  -9.262  -0.680
  491   1HG2  VAL  54          HG23      VAL  54  57.472  -9.891  -2.940
  492   2HG2  VAL  54          HG22      VAL  54  57.447 -10.550  -1.305
  493   3HG2  VAL  54          HG21      VAL  54  56.335 -11.173  -2.524
  494    CH2  TRP  55           CH2      TRP  55  54.188   0.951  -2.495
  495    H    TRP  55           HN       TRP  55  55.923  -6.187  -1.640
  496    HA   TRP  55           HA       TRP  55  53.193  -5.557  -0.979
  497   1HB   TRP  55           HB2      TRP  55  54.808  -4.521   0.431
  498   2HB   TRP  55           HB1      TRP  55  55.749  -3.929  -0.936
  499    HD1  TRP  55           HD1      TRP  55  52.387  -3.263   0.886
  500    HE1  TRP  55           HE1      TRP  55  51.650  -0.860   0.331
  501    HE3  TRP  55           HE3      TRP  55  55.977  -1.949  -2.521
  502    HZ2  TRP  55           HZ2      TRP  55  52.444   1.310  -1.297
  503    HZ3  TRP  55           HZ3      TRP  55  55.917   0.292  -3.574
  504    HH2  TRP  55           HH2      TRP  55  54.177   1.927  -2.953
  505    H    PHE  56           HN       PHE  56  55.373  -4.497  -3.634
  506    HA   PHE  56           HA       PHE  56  53.312  -2.759  -4.681
  507   1HB   PHE  56           HB2      PHE  56  55.971  -2.743  -5.101
  508   2HB   PHE  56           HB1      PHE  56  55.458  -3.625  -6.543
  509    HD1  PHE  56           HD1      PHE  56  53.859  -0.865  -4.580
  510    HD2  PHE  56           HD2      PHE  56  55.383  -2.126  -8.381
  511    HE1  PHE  56           HE1      PHE  56  53.064   1.239  -5.574
  512    HE2  PHE  56           HE2      PHE  56  54.566  -0.008  -9.392
  513    HZ   PHE  56           HZ       PHE  56  53.391   1.663  -7.968
  514    H    CYS  57           HN       CYS  57  53.613  -6.096  -4.745
  515    HA   CYS  57           HA       CYS  57  52.461  -6.521  -7.391
  516   1HB   CYS  57           HB2      CYS  57  53.468  -8.170  -5.277
  517   2HB   CYS  57           HB1      CYS  57  51.786  -8.631  -5.524
  518    HG   CYS  57           HG       CYS  57  52.850  -8.556  -8.232
  519    H    ASN  58           HN       ASN  58  51.372  -6.092  -4.075
  520    HA   ASN  58           HA       ASN  58  48.528  -6.326  -4.775
  521   1HB   ASN  58           HB2      ASN  58  49.652  -6.879  -2.492
  522   2HB   ASN  58           HB1      ASN  58  49.609  -5.136  -2.222
  523   1HD2  ASN  58          HD22      ASN  58  46.025  -5.011  -1.981
  524   2HD2  ASN  58          HD21      ASN  58  47.388  -4.089  -2.398
  525    NH1  ARG  59           NH2      ARG  59  48.291   0.205  -1.175
  526    NH2  ARG  59           NH1      ARG  59  47.358   2.022  -2.142
  527    H    ARG  59           HN       ARG  59  50.954  -3.797  -4.486
  528    HA   ARG  59           HA       ARG  59  48.998  -1.618  -4.445
  529   1HB   ARG  59           HB2      ARG  59  51.799  -1.818  -3.941
  530   2HB   ARG  59           HB1      ARG  59  51.624  -0.729  -5.307
  531   1HG   ARG  59           HG2      ARG  59  50.390  -0.461  -2.565
  532   2HG   ARG  59           HG1      ARG  59  51.538   0.616  -3.351
  533   1HD   ARG  59           HD2      ARG  59  49.720   1.837  -3.936
  534   2HD   ARG  59           HD1      ARG  59  49.458   0.592  -5.156
  535    HE   ARG  59           HE       ARG  59  47.639  -0.216  -3.873
  536   1HH1  ARG  59          HH21      ARG  59  48.760  -0.675  -1.256
  537   2HH1  ARG  59          HH22      ARG  59  48.068   0.571  -0.272
  538   1HH2  ARG  59          HH11      ARG  59  47.111   2.534  -2.965
  539   2HH2  ARG  59          HH12      ARG  59  47.137   2.389  -1.239
  540    NH1  ARG  60           NH1      ARG  60  54.160  -6.553 -11.228
  541    NH2  ARG  60           NH2      ARG  60  51.975  -7.122 -11.353
  542    H    ARG  60           HN       ARG  60  50.380  -3.648  -6.864
  543    HA   ARG  60           HA       ARG  60  50.164  -1.683  -9.028
  544   1HB   ARG  60           HB2      ARG  60  51.086  -4.478  -8.716
  545   2HB   ARG  60           HB1      ARG  60  50.334  -4.118 -10.270
  546   1HG   ARG  60           HG2      ARG  60  51.885  -2.347 -10.714
  547   2HG   ARG  60           HG1      ARG  60  52.495  -2.380  -9.060
  548   1HD   ARG  60           HD2      ARG  60  54.015  -3.521 -10.693
  549   2HD   ARG  60           HD1      ARG  60  53.457  -4.587  -9.404
  550    HE   ARG  60           HE       ARG  60  51.941  -4.601 -11.955
  551   1HH1  ARG  60          HH11      ARG  60  54.870  -5.851 -11.178
  552   2HH1  ARG  60          HH12      ARG  60  54.412  -7.521 -11.230
  553   1HH2  ARG  60          HH21      ARG  60  51.012  -6.856 -11.400
  554   2HH2  ARG  60          HH22      ARG  60  52.228  -8.089 -11.355
  555    H    GLN  61           HN       GLN  61  48.413  -4.656  -8.071
  556    HA   GLN  61           HA       GLN  61  46.223  -3.909  -9.933
  557   1HB   GLN  61           HB2      GLN  61  46.478  -6.401  -8.223
  558   2HB   GLN  61           HB1      GLN  61  45.378  -6.151  -9.578
  559   1HG   GLN  61           HG2      GLN  61  47.652  -5.657 -10.874
  560   2HG   GLN  61           HG1      GLN  61  48.321  -6.676  -9.599
  561   1HE2  GLN  61          HE21      GLN  61  47.373  -8.897  -9.378
  562   2HE2  GLN  61          HE22      GLN  61  46.658  -9.635 -10.729
  563    H    LYS  62           HN       LYS  62  46.343  -2.102  -7.980
  564    HA   LYS  62           HA       LYS  62  44.639  -2.835  -5.722
  565   1HB   LYS  62           HB2      LYS  62  44.773  -0.415  -5.188
  566   2HB   LYS  62           HB1      LYS  62  46.366  -1.124  -5.447
  567   1HG   LYS  62           HG2      LYS  62  46.729   0.055  -7.375
  568   2HG   LYS  62           HG1      LYS  62  45.033   0.003  -7.852
  569   1HD   LYS  62           HD2      LYS  62  44.705   1.581  -5.766
  570   2HD   LYS  62           HD1      LYS  62  46.420   1.914  -6.001
  571   1HE   LYS  62           HE2      LYS  62  45.881   3.358  -7.640
  572   2HE   LYS  62           HE1      LYS  62  45.213   2.019  -8.573
  573   1HZ   LYS  62           HZ3      LYS  62  43.618   3.208  -6.410
  574   2HZ   LYS  62           HZ2      LYS  62  43.717   4.010  -7.904
  575   3HZ   LYS  62           HZ1      LYS  62  43.100   2.429  -7.824
  576    H    GLY  63           HN       GLY  63  44.208  -1.629  -8.959
  577   1HA   GLY  63           HA2      GLY  63  41.283  -1.605  -8.524
  578   2HA   GLY  63           HA1      GLY  63  42.017  -0.142  -9.182
  579    H    LYS  64           HN       LYS  64  41.831  -3.657  -9.776
  580    HA   LYS  64           HA       LYS  64  41.441  -3.134 -12.643
  581   1HB   LYS  64           HB2      LYS  64  44.018  -3.443 -11.879
  582   2HB   LYS  64           HB1      LYS  64  43.567  -5.134 -12.096
  583   1HG   LYS  64           HG2      LYS  64  42.659  -4.519 -14.367
  584   2HG   LYS  64           HG1      LYS  64  43.348  -2.911 -14.143
  585   1HD   LYS  64           HD2      LYS  64  45.461  -3.629 -14.552
  586   2HD   LYS  64           HD1      LYS  64  45.250  -5.090 -13.588
  587   1HE   LYS  64           HE2      LYS  64  43.679  -5.777 -15.629
  588   2HE   LYS  64           HE1      LYS  64  44.712  -4.639 -16.494
  589   1HZ   LYS  64           HZ1      LYS  64  46.592  -5.945 -15.289
  590   2HZ   LYS  64           HZ3      LYS  64  45.423  -7.171 -15.186
  591   3HZ   LYS  64           HZ2      LYS  64  45.893  -6.571 -16.705
  592    NH1  ARG  65           NH2      ARG  65  40.754 -11.883 -14.312
  593    NH2  ARG  65           NH1      ARG  65  42.496 -11.209 -15.583
  594    H    ARG  65           HN       ARG  65  42.243  -5.777 -10.385
  595    HA   ARG  65           HA       ARG  65  39.799  -7.183 -11.366
  596   1HB   ARG  65           HB2      ARG  65  42.600  -8.240 -11.034
  597   2HB   ARG  65           HB1      ARG  65  41.215  -9.323 -10.888
  598   1HG   ARG  65           HG2      ARG  65  40.557  -9.001 -13.111
  599   2HG   ARG  65           HG1      ARG  65  41.421  -7.469 -13.246
  600   1HD   ARG  65           HD2      ARG  65  42.848  -8.879 -14.424
  601   2HD   ARG  65           HD1      ARG  65  43.543  -8.978 -12.806
  602    HE   ARG  65           HE       ARG  65  42.657 -11.198 -12.597
  603   1HH1  ARG  65          HH21      ARG  65  40.290 -11.918 -13.427
  604   2HH1  ARG  65          HH22      ARG  65  40.347 -12.331 -15.108
  605   1HH2  ARG  65          HH11      ARG  65  43.367 -10.726 -15.673
  606   2HH2  ARG  65          HH12      ARG  65  42.089 -11.658 -16.379
  607    H    SER  66           HN       SER  66  38.672  -6.471  -9.475
  608    HA   SER  66           HA       SER  66  39.769  -7.177  -6.829
  609   1HB   SER  66           HB2      SER  66  37.621  -6.168  -6.002
  610   2HB   SER  66           HB1      SER  66  38.579  -5.070  -6.992
  611    HG   SER  66           HG       SER  66  37.066  -5.099  -8.459
  612    H    SER  67           HN       SER  67  39.721  -9.403  -6.608
  613    HA   SER  67           HA       SER  67  37.097 -10.760  -7.073
  614   1HB   SER  67           HB2      SER  67  38.417 -12.856  -7.180
  615   2HB   SER  67           HB1      SER  67  38.946 -11.695  -8.395
  616    HG   SER  67           HG       SER  67  40.832 -11.941  -7.508
   
  Start of MODEL           8
 Raw file had  616 H/Q atoms
  Start of MODEL    8
    1   1H    MET   1           HT2      MET   1  45.630  28.227  13.602
    2   2H    MET   1           HT1      MET   1  45.702  28.303  15.298
    3   3H    MET   1           HT3      MET   1  47.033  28.798  14.370
    4    HA   MET   1           HA       MET   1  47.629  26.693  15.149
    5   1HB   MET   1           HB2      MET   1  44.769  26.005  14.451
    6   2HB   MET   1           HB1      MET   1  45.984  24.758  14.733
    7   1HG   MET   1           HG2      MET   1  45.821  26.929  16.762
    8   2HG   MET   1           HG1      MET   1  44.473  25.793  16.719
    9   1HE   MET   1           HE1      MET   1  44.711  23.559  16.273
   10   2HE   MET   1           HE3      MET   1  46.195  22.596  16.260
   11   3HE   MET   1           HE2      MET   1  45.237  22.725  17.733
   12    H    GLU   2           HN       GLU   2  48.812  27.556  13.158
   13    HA   GLU   2           HA       GLU   2  48.154  25.911  10.746
   14   1HB   GLU   2           HB2      GLU   2  49.219  28.672  11.106
   15   2HB   GLU   2           HB1      GLU   2  49.884  27.730   9.771
   16   1HG   GLU   2           HG2      GLU   2  47.554  27.250   9.004
   17   2HG   GLU   2           HG1      GLU   2  46.951  28.313  10.276
   18    H    THR   3           HN       THR   3  50.854  27.207  12.684
   19    HA   THR   3           HA       THR   3  52.733  25.298  11.465
   20    HB   THR   3           HB       THR   3  54.182  26.350  13.456
   21    HG1  THR   3           HG1      THR   3  52.920  27.691  14.476
   22   1HG2  THR   3          HG21      THR   3  54.250  26.613  10.846
   23   2HG2  THR   3          HG23      THR   3  53.517  28.183  11.176
   24   3HG2  THR   3          HG22      THR   3  55.092  27.782  11.862
   25    H    LEU   4           HN       LEU   4  51.413  23.415  12.219
   26    HA   LEU   4           HA       LEU   4  52.243  22.627  14.970
   27   1HB   LEU   4           HB2      LEU   4  49.834  23.349  14.948
   28   2HB   LEU   4           HB1      LEU   4  49.513  22.062  13.786
   29    HG   LEU   4           HG       LEU   4  50.856  20.674  15.716
   30   1HD1  LEU   4          HD12      LEU   4  50.717  22.941  17.033
   31   2HD1  LEU   4          HD11      LEU   4  49.045  22.461  17.316
   32   3HD1  LEU   4          HD13      LEU   4  50.364  21.430  17.871
   33   1HD2  LEU   4          HD21      LEU   4  48.580  20.279  14.592
   34   2HD2  LEU   4          HD23      LEU   4  48.741  19.718  16.256
   35   3HD2  LEU   4          HD22      LEU   4  47.888  21.222  15.911
   36    H    VAL   5           HN       VAL   5  50.545  21.283  12.133
   37    HA   VAL   5           HA       VAL   5  52.110  18.788  12.434
   38    HB   VAL   5           HB       VAL   5  50.484  17.912  10.757
   39   1HG1  VAL   5          HG11      VAL   5  49.711  19.070  13.389
   40   2HG1  VAL   5          HG13      VAL   5  48.409  18.477  12.358
   41   3HG1  VAL   5          HG12      VAL   5  49.704  17.388  12.857
   42   1HG2  VAL   5          HG22      VAL   5  50.123  20.395   9.911
   43   2HG2  VAL   5          HG21      VAL   5  48.809  19.223   9.819
   44   3HG2  VAL   5          HG23      VAL   5  48.853  20.395  11.135
   45    H    GLN   6           HN       GLN   6  53.330  21.277  11.378
   46    HA   GLN   6           HA       GLN   6  53.674  20.688   8.493
   47   1HB   GLN   6           HB2      GLN   6  54.202  22.993  10.282
   48   2HB   GLN   6           HB1      GLN   6  55.378  22.754   8.990
   49   1HG   GLN   6           HG2      GLN   6  53.605  22.772   7.315
   50   2HG   GLN   6           HG1      GLN   6  52.377  22.886   8.576
   51   1HE2  GLN   6          HE22      GLN   6  52.539  26.395   8.441
   52   2HE2  GLN   6          HE21      GLN   6  51.580  24.997   8.536
   53    H    ALA   7           HN       ALA   7  55.054  19.002   8.161
   54    HA   ALA   7           HA       ALA   7  57.182  18.260   9.925
   55   1HB   ALA   7           HB3      ALA   7  55.954  16.933   7.991
   56   2HB   ALA   7           HB2      ALA   7  57.272  17.573   7.010
   57   3HB   ALA   7           HB1      ALA   7  57.626  16.557   8.407
   58    NH1  ARG   8           NH2      ARG   8  58.888  21.547  12.345
   59    NH2  ARG   8           NH1      ARG   8  60.402  21.122  13.969
   60    H    ARG   8           HN       ARG   8  59.410  17.926   8.266
   61    HA   ARG   8           HA       ARG   8  60.135  20.676   7.442
   62   1HB   ARG   8           HB2      ARG   8  61.373  18.992   9.546
   63   2HB   ARG   8           HB1      ARG   8  62.493  19.823   8.465
   64   1HG   ARG   8           HG2      ARG   8  61.782  21.937   9.127
   65   2HG   ARG   8           HG1      ARG   8  60.195  21.357   9.633
   66   1HD   ARG   8           HD2      ARG   8  62.668  20.422  11.066
   67   2HD   ARG   8           HD1      ARG   8  61.947  21.980  11.467
   68    HE   ARG   8           HE       ARG   8  60.588  19.343  11.791
   69   1HH1  ARG   8          HH21      ARG   8  58.584  21.450  11.397
   70   2HH1  ARG   8          HH22      ARG   8  58.336  22.068  12.996
   71   1HH2  ARG   8          HH11      ARG   8  61.259  20.700  14.265
   72   2HH2  ARG   8          HH12      ARG   8  59.850  21.643  14.620
   73    H    LYS   9           HN       LYS   9  61.025  17.231   7.361
   74    HA   LYS   9           HA       LYS   9  61.682  17.491   4.522
   75   1HB   LYS   9           HB2      LYS   9  63.719  17.038   6.660
   76   2HB   LYS   9           HB1      LYS   9  63.893  16.134   5.154
   77   1HG   LYS   9           HG2      LYS   9  63.448  18.498   4.053
   78   2HG   LYS   9           HG1      LYS   9  64.019  19.095   5.611
   79   1HD   LYS   9           HD2      LYS   9  66.164  18.475   5.200
   80   2HD   LYS   9           HD1      LYS   9  65.681  16.935   4.490
   81   1HE   LYS   9           HE2      LYS   9  66.592  18.082   2.655
   82   2HE   LYS   9           HE1      LYS   9  64.863  18.387   2.485
   83   1HZ   LYS   9           HZ2      LYS   9  66.585  20.230   4.018
   84   2HZ   LYS   9           HZ1      LYS   9  66.464  20.357   2.328
   85   3HZ   LYS   9           HZ3      LYS   9  65.079  20.533   3.291
   86    NH1  ARG  10           NH1      ARG  10  63.062  10.042   6.208
   87    NH2  ARG  10           NH2      ARG  10  63.827  10.938   8.137
   88    H    ARG  10           HN       ARG  10  59.603  16.148   4.952
   89    HA   ARG  10           HA       ARG  10  60.327  13.333   4.675
   90   1HB   ARG  10           HB2      ARG  10  59.630  14.250   7.215
   91   2HB   ARG  10           HB1      ARG  10  58.129  13.566   6.596
   92   1HG   ARG  10           HG2      ARG  10  59.005  11.594   7.335
   93   2HG   ARG  10           HG1      ARG  10  59.915  11.649   5.825
   94   1HD   ARG  10           HD2      ARG  10  61.750  12.847   7.014
   95   2HD   ARG  10           HD1      ARG  10  60.852  12.672   8.523
   96    HE   ARG  10           HE       ARG  10  61.057  10.156   8.121
   97   1HH1  ARG  10          HH11      ARG  10  62.299   9.795   5.611
   98   2HH1  ARG  10          HH12      ARG  10  64.001   9.850   5.925
   99   1HH2  ARG  10          HH21      ARG  10  63.650  11.378   9.018
  100   2HH2  ARG  10          HH22      ARG  10  64.766  10.746   7.854
  101    H    LYS  11           HN       LYS  11  59.040  15.551   3.123
  102    HA   LYS  11           HA       LYS  11  56.238  14.809   2.869
  103   1HB   LYS  11           HB2      LYS  11  58.042  16.888   1.840
  104   2HB   LYS  11           HB1      LYS  11  56.870  16.339   0.647
  105   1HG   LYS  11           HG2      LYS  11  55.463  17.816   1.653
  106   2HG   LYS  11           HG1      LYS  11  55.297  16.570   2.889
  107   1HD   LYS  11           HD2      LYS  11  55.959  18.281   4.266
  108   2HD   LYS  11           HD1      LYS  11  57.563  17.750   3.761
  109   1HE   LYS  11           HE2      LYS  11  57.677  19.450   2.061
  110   2HE   LYS  11           HE1      LYS  11  55.981  19.873   2.292
  111   1HZ   LYS  11           HZ1      LYS  11  56.614  20.432   4.643
  112   2HZ   LYS  11           HZ3      LYS  11  58.236  20.311   4.159
  113   3HZ   LYS  11           HZ2      LYS  11  57.223  21.475   3.449
  114    NH1  ARG  12           NH2      ARG  12  50.991  15.423   0.157
  115    NH2  ARG  12           NH1      ARG  12  51.698  16.265  -1.818
  116    H    ARG  12           HN       ARG  12  55.841  14.779   0.116
  117    HA   ARG  12           HA       ARG  12  56.872  12.100  -0.574
  118   1HB   ARG  12           HB2      ARG  12  54.974  13.914  -2.098
  119   2HB   ARG  12           HB1      ARG  12  55.274  12.206  -2.422
  120   1HG   ARG  12           HG2      ARG  12  54.028  11.505  -0.628
  121   2HG   ARG  12           HG1      ARG  12  54.467  12.902   0.356
  122   1HD   ARG  12           HD2      ARG  12  52.621  13.084  -2.036
  123   2HD   ARG  12           HD1      ARG  12  52.041  12.841  -0.388
  124    HE   ARG  12           HE       ARG  12  53.812  15.118  -0.526
  125   1HH1  ARG  12          HH21      ARG  12  51.130  14.813   0.937
  126   2HH1  ARG  12          HH22      ARG  12  50.174  15.997   0.110
  127   1HH2  ARG  12          HH11      ARG  12  52.378  16.300  -2.551
  128   2HH2  ARG  12          HH12      ARG  12  50.881  16.840  -1.866
  129    H    THR  13           HN       THR  13  59.119  13.266  -0.663
  130    HA   THR  13           HA       THR  13  59.634  14.856  -3.061
  131    HB   THR  13           HB       THR  13  61.745  13.482  -1.401
  132    HG1  THR  13           HG1      THR  13  60.604  14.458   0.153
  133   1HG2  THR  13          HG22      THR  13  62.418  14.707  -3.438
  134   2HG2  THR  13          HG21      THR  13  61.620  16.155  -2.824
  135   3HG2  THR  13          HG23      THR  13  63.025  15.499  -1.984
  136    H    SER  14           HN       SER  14  60.108  11.528  -1.980
  137    HA   SER  14           HA       SER  14  60.188  10.640  -4.767
  138   1HB   SER  14           HB2      SER  14  62.616  11.180  -3.599
  139   2HB   SER  14           HB1      SER  14  62.420   9.466  -3.243
  140    HG   SER  14           HG       SER  14  61.959   9.192  -5.504
  141    H    ILE  15           HN       ILE  15  58.577  10.299  -2.273
  142    HA   ILE  15           HA       ILE  15  58.205   7.403  -2.507
  143    HB   ILE  15           HB       ILE  15  59.046   8.684   0.109
  144   1HG1  ILE  15          HG12      ILE  15  60.864   7.824  -1.327
  145   2HG1  ILE  15          HG11      ILE  15  60.697   6.847   0.126
  146   1HG2  ILE  15          HG21      ILE  15  57.401   6.237  -0.409
  147   2HG2  ILE  15          HG23      ILE  15  58.626   6.149   0.859
  148   3HG2  ILE  15          HG22      ILE  15  57.345   7.358   0.951
  149   1HD1  ILE  15          HD11      ILE  15  59.240   5.259  -1.217
  150   2HD1  ILE  15          HD13      ILE  15  59.705   6.161  -2.656
  151   3HD1  ILE  15          HD12      ILE  15  60.925   5.315  -1.719
  152    H    GLU  16           HN       GLU  16  56.360   8.619  -3.520
  153    HA   GLU  16           HA       GLU  16  54.441   9.950  -1.851
  154   1HB   GLU  16           HB2      GLU  16  54.766   9.676  -4.559
  155   2HB   GLU  16           HB1      GLU  16  53.441   8.552  -4.259
  156   1HG   GLU  16           HG2      GLU  16  52.185  10.333  -3.104
  157   2HG   GLU  16           HG1      GLU  16  53.512  11.460  -3.393
  158    H    ASN  17           HN       ASN  17  52.319   8.987  -1.290
  159    HA   ASN  17           HA       ASN  17  52.586   6.453   0.000
  160   1HB   ASN  17           HB2      ASN  17  50.386   8.387  -0.488
  161   2HB   ASN  17           HB1      ASN  17  49.887   6.722  -0.189
  162   1HD2  ASN  17          HD22      ASN  17  50.434   8.682   3.058
  163   2HD2  ASN  17          HD21      ASN  17  49.635   9.125   1.628
  164    NH1  ARG  18           NH2      ARG  18  46.562   8.178  -8.195
  165    NH2  ARG  18           NH1      ARG  18  45.596   6.135  -8.206
  166    H    ARG  18           HN       ARG  18  51.704   7.331  -3.248
  167    HA   ARG  18           HA       ARG  18  50.457   4.756  -3.847
  168   1HB   ARG  18           HB2      ARG  18  50.541   7.291  -5.084
  169   2HB   ARG  18           HB1      ARG  18  51.399   6.213  -6.184
  170   1HG   ARG  18           HG2      ARG  18  49.518   4.705  -6.290
  171   2HG   ARG  18           HG1      ARG  18  48.682   5.575  -5.004
  172   1HD   ARG  18           HD2      ARG  18  49.091   7.611  -6.741
  173   2HD   ARG  18           HD1      ARG  18  48.972   6.267  -7.877
  174    HE   ARG  18           HE       ARG  18  46.839   6.317  -5.870
  175   1HH1  ARG  18          HH21      ARG  18  47.226   8.821  -7.813
  176   2HH1  ARG  18          HH22      ARG  18  45.970   8.461  -8.951
  177   1HH2  ARG  18          HH11      ARG  18  45.520   5.211  -7.831
  178   2HH2  ARG  18          HH12      ARG  18  45.005   6.419  -8.961
  179    H    VAL  19           HN       VAL  19  53.665   6.187  -3.981
  180    HA   VAL  19           HA       VAL  19  54.813   4.255  -5.750
  181    HB   VAL  19           HB       VAL  19  55.774   6.569  -4.722
  182   1HG1  VAL  19          HG12      VAL  19  56.953   4.408  -2.963
  183   2HG1  VAL  19          HG11      VAL  19  57.885   5.817  -3.415
  184   3HG1  VAL  19          HG13      VAL  19  56.385   6.015  -2.516
  185   1HG2  VAL  19          HG22      VAL  19  57.085   4.151  -5.918
  186   2HG2  VAL  19          HG21      VAL  19  56.764   5.722  -6.652
  187   3HG2  VAL  19          HG23      VAL  19  58.078   5.544  -5.488
  188    NH1  ARG  20           NH2      ARG  20  56.041   6.615   3.432
  189    NH2  ARG  20           NH1      ARG  20  55.254   4.820   4.555
  190    H    ARG  20           HN       ARG  20  54.585   4.391  -2.208
  191    HA   ARG  20           HA       ARG  20  55.984   1.955  -1.704
  192   1HB   ARG  20           HB2      ARG  20  53.811   3.398  -0.185
  193   2HB   ARG  20           HB1      ARG  20  54.530   1.904   0.418
  194   1HG   ARG  20           HG2      ARG  20  56.804   3.082   0.037
  195   2HG   ARG  20           HG1      ARG  20  55.859   4.569  -0.049
  196   1HD   ARG  20           HD2      ARG  20  55.253   2.766   2.233
  197   2HD   ARG  20           HD1      ARG  20  56.818   3.578   2.276
  198    HE   ARG  20           HE       ARG  20  54.465   5.283   1.730
  199   1HH1  ARG  20          HH21      ARG  20  56.216   7.088   2.569
  200   2HH1  ARG  20          HH22      ARG  20  56.293   7.047   4.298
  201   1HH2  ARG  20          HH11      ARG  20  54.825   3.916   4.553
  202   2HH2  ARG  20          HH12      ARG  20  55.509   5.250   5.421
  203    CH2  TRP  21           CH2      TRP  21  52.511  -0.689   2.606
  204    H    TRP  21           HN       TRP  21  52.475   2.459  -2.118
  205    HA   TRP  21           HA       TRP  21  52.104  -0.422  -2.124
  206   1HB   TRP  21           HB2      TRP  21  50.077   1.737  -2.711
  207   2HB   TRP  21           HB1      TRP  21  49.720   0.028  -2.402
  208    HD1  TRP  21           HD1      TRP  21  49.256   2.861  -0.486
  209    HE1  TRP  21           HE1      TRP  21  49.964   2.661   1.991
  210    HE3  TRP  21           HE3      TRP  21  52.172  -1.349  -0.695
  211    HZ2  TRP  21           HZ2      TRP  21  51.599   0.954   3.646
  212    HZ3  TRP  21           HZ3      TRP  21  53.312  -2.197   1.294
  213    HH2  TRP  21           HH2      TRP  21  52.998  -1.082   3.485
  214    H    SER  22           HN       SER  22  53.316   1.612  -4.381
  215    HA   SER  22           HA       SER  22  52.298   0.198  -6.728
  216   1HB   SER  22           HB2      SER  22  54.204   2.422  -6.195
  217   2HB   SER  22           HB1      SER  22  54.605   1.392  -7.565
  218    HG   SER  22           HG       SER  22  53.244   3.061  -8.232
  219    H    LEU  23           HN       LEU  23  55.012   0.214  -4.455
  220    HA   LEU  23           HA       LEU  23  56.717  -1.772  -5.607
  221   1HB   LEU  23           HB2      LEU  23  56.001  -1.358  -2.687
  222   2HB   LEU  23           HB1      LEU  23  57.361  -2.284  -3.251
  223    HG   LEU  23           HG       LEU  23  57.147   0.590  -4.042
  224   1HD1  LEU  23          HD13      LEU  23  56.702   0.121  -1.495
  225   2HD1  LEU  23          HD12      LEU  23  58.413  -0.298  -1.441
  226   3HD1  LEU  23          HD11      LEU  23  57.918   1.325  -1.923
  227   1HD2  LEU  23          HD22      LEU  23  59.297  -1.487  -3.560
  228   2HD2  LEU  23          HD21      LEU  23  59.016  -0.518  -5.007
  229   3HD2  LEU  23          HD23      LEU  23  59.698   0.229  -3.563
  230    H    GLU  24           HN       GLU  24  53.961  -1.903  -3.412
  231    HA   GLU  24           HA       GLU  24  53.785  -4.690  -2.998
  232   1HB   GLU  24           HB2      GLU  24  52.056  -2.369  -2.668
  233   2HB   GLU  24           HB1      GLU  24  51.124  -3.789  -3.138
  234   1HG   GLU  24           HG2      GLU  24  53.205  -4.039  -0.988
  235   2HG   GLU  24           HG1      GLU  24  51.630  -3.348  -0.596
  236    H    THR  25           HN       THR  25  52.477  -2.745  -5.678
  237    HA   THR  25           HA       THR  25  50.990  -4.833  -6.936
  238    HB   THR  25           HB       THR  25  52.409  -2.731  -8.547
  239    HG1  THR  25           HG1      THR  25  51.193  -1.174  -7.712
  240   1HG2  THR  25          HG23      THR  25  50.160  -4.516  -8.864
  241   2HG2  THR  25          HG22      THR  25  49.623  -2.844  -9.021
  242   3HG2  THR  25          HG21      THR  25  50.911  -3.457 -10.058
  243    H    MET  26           HN       MET  26  54.383  -3.879  -7.149
  244    HA   MET  26           HA       MET  26  55.000  -5.789  -9.269
  245   1HB   MET  26           HB2      MET  26  56.289  -3.671  -8.836
  246   2HB   MET  26           HB1      MET  26  56.926  -4.425  -7.373
  247   1HG   MET  26           HG2      MET  26  57.822  -6.289  -8.752
  248   2HG   MET  26           HG1      MET  26  57.244  -5.469 -10.202
  249   1HE   MET  26           HE1      MET  26  57.666  -3.255 -10.809
  250   2HE   MET  26           HE3      MET  26  57.994  -2.221  -9.411
  251   3HE   MET  26           HE2      MET  26  59.209  -2.416 -10.672
  252    H    PHE  27           HN       PHE  27  54.881  -5.940  -5.776
  253    HA   PHE  27           HA       PHE  27  56.482  -8.421  -5.704
  254   1HB   PHE  27           HB2      PHE  27  55.191  -6.721  -3.561
  255   2HB   PHE  27           HB1      PHE  27  55.855  -8.315  -3.222
  256    HD1  PHE  27           HD2      PHE  27  58.276  -8.704  -4.400
  257    HD2  PHE  27           HD1      PHE  27  56.619  -4.923  -3.213
  258    HE1  PHE  27           HE2      PHE  27  60.557  -7.735  -4.296
  259    HE2  PHE  27           HE1      PHE  27  58.898  -3.955  -3.111
  260    HZ   PHE  27           HZ       PHE  27  60.865  -5.359  -3.651
  261    H    LEU  28           HN       LEU  28  53.172  -7.592  -6.081
  262    HA   LEU  28           HA       LEU  28  52.233 -10.088  -4.833
  263   1HB   LEU  28           HB2      LEU  28  50.779  -7.802  -6.177
  264   2HB   LEU  28           HB1      LEU  28  49.968  -9.228  -5.521
  265    HG   LEU  28           HG       LEU  28  51.859  -7.514  -3.895
  266   1HD1  LEU  28          HD12      LEU  28  49.537  -6.536  -4.832
  267   2HD1  LEU  28          HD11      LEU  28  48.924  -7.414  -3.430
  268   3HD1  LEU  28          HD13      LEU  28  50.142  -6.156  -3.219
  269   1HD2  LEU  28          HD21      LEU  28  49.933  -9.761  -3.307
  270   2HD2  LEU  28          HD23      LEU  28  51.647  -9.652  -2.906
  271   3HD2  LEU  28          HD22      LEU  28  50.474  -8.659  -2.041
  272    H    LYS  29           HN       LYS  29  53.853 -10.881  -6.711
  273    HA   LYS  29           HA       LYS  29  52.091 -11.812  -8.941
  274   1HB   LYS  29           HB2      LYS  29  53.793 -10.331  -9.878
  275   2HB   LYS  29           HB1      LYS  29  55.058 -11.134  -8.955
  276   1HG   LYS  29           HG2      LYS  29  55.390 -12.517 -10.703
  277   2HG   LYS  29           HG1      LYS  29  53.782 -13.184 -10.432
  278   1HD   LYS  29           HD2      LYS  29  53.047 -10.982 -11.753
  279   2HD   LYS  29           HD1      LYS  29  54.673 -11.137 -12.417
  280   1HE   LYS  29           HE2      LYS  29  53.487 -12.464 -13.906
  281   2HE   LYS  29           HE1      LYS  29  53.963 -13.670 -12.710
  282   1HZ   LYS  29           HZ3      LYS  29  51.786 -13.105 -11.574
  283   2HZ   LYS  29           HZ2      LYS  29  51.349 -12.323 -13.017
  284   3HZ   LYS  29           HZ1      LYS  29  51.685 -13.988 -13.020
  285    H    CYS  30           HN       CYS  30  55.154 -12.511  -7.313
  286    HA   CYS  30           HA       CYS  30  54.236 -15.235  -6.672
  287   1HB   CYS  30           HB2      CYS  30  56.828 -14.547  -8.105
  288   2HB   CYS  30           HB1      CYS  30  56.448 -16.133  -7.438
  289    HG   CYS  30           HG       CYS  30  55.661 -16.268  -9.887
  290    HA   PRO  31           HA       PRO  31  56.419 -14.154  -2.969
  291   1HB   PRO  31           HB2      PRO  31  57.097 -16.632  -2.011
  292   2HB   PRO  31           HB1      PRO  31  55.438 -16.009  -1.985
  293   1HG   PRO  31           HG2      PRO  31  56.632 -18.088  -3.748
  294   2HG   PRO  31           HG1      PRO  31  54.939 -17.852  -3.281
  295   1HD   PRO  31           HD2      PRO  31  56.143 -17.089  -5.752
  296   2HD   PRO  31           HD1      PRO  31  54.514 -16.655  -5.197
  297    H    LYS  32           HN       LYS  32  58.025 -15.339  -5.656
  298    HA   LYS  32           HA       LYS  32  60.644 -15.340  -4.272
  299   1HB   LYS  32           HB2      LYS  32  61.399 -16.667  -6.320
  300   2HB   LYS  32           HB1      LYS  32  60.301 -17.501  -5.222
  301   1HG   LYS  32           HG2      LYS  32  58.401 -17.028  -6.670
  302   2HG   LYS  32           HG1      LYS  32  59.397 -16.020  -7.720
  303   1HD   LYS  32           HD2      LYS  32  60.841 -18.057  -8.147
  304   2HD   LYS  32           HD1      LYS  32  59.628 -19.012  -7.296
  305   1HE   LYS  32           HE2      LYS  32  58.250 -17.386  -9.199
  306   2HE   LYS  32           HE1      LYS  32  59.606 -18.149 -10.029
  307   1HZ   LYS  32           HZ3      LYS  32  57.922 -19.750  -8.230
  308   2HZ   LYS  32           HZ2      LYS  32  57.370 -19.399  -9.799
  309   3HZ   LYS  32           HZ1      LYS  32  58.829 -20.242  -9.576
  310    HA   PRO  33           HA       PRO  33  60.627 -11.773  -7.249
  311   1HB   PRO  33           HB2      PRO  33  61.564  -9.880  -5.485
  312   2HB   PRO  33           HB1      PRO  33  59.842 -10.212  -5.742
  313   1HG   PRO  33           HG2      PRO  33  61.578 -10.970  -3.443
  314   2HG   PRO  33           HG1      PRO  33  59.827 -10.704  -3.489
  315   1HD   PRO  33           HD2      PRO  33  61.111 -13.230  -3.461
  316   2HD   PRO  33           HD1      PRO  33  59.405 -12.934  -3.859
  317    H    SER  34           HN       SER  34  62.595 -10.687  -8.081
  318    HA   SER  34           HA       SER  34  65.010 -12.265  -7.517
  319   1HB   SER  34           HB2      SER  34  64.342 -10.204  -9.617
  320   2HB   SER  34           HB1      SER  34  65.924 -10.967  -9.478
  321    HG   SER  34           HG       SER  34  64.800 -12.223 -10.873
  322    H    LEU  35           HN       LEU  35  66.865 -11.466  -6.581
  323    HA   LEU  35           HA       LEU  35  66.722  -9.097  -4.954
  324   1HB   LEU  35           HB2      LEU  35  69.071 -10.749  -5.933
  325   2HB   LEU  35           HB1      LEU  35  69.246  -9.395  -4.817
  326    HG   LEU  35           HG       LEU  35  67.114 -11.131  -3.918
  327   1HD1  LEU  35          HD11      LEU  35  68.922 -12.642  -5.276
  328   2HD1  LEU  35          HD13      LEU  35  69.672 -12.612  -3.679
  329   3HD1  LEU  35          HD12      LEU  35  68.028 -13.222  -3.871
  330   1HD2  LEU  35          HD22      LEU  35  69.672  -9.974  -2.891
  331   2HD2  LEU  35          HD21      LEU  35  68.042  -9.856  -2.229
  332   3HD2  LEU  35          HD23      LEU  35  68.980 -11.333  -2.004
  333    H    GLN  36           HN       GLN  36  67.617  -9.761  -8.261
  334    HA   GLN  36           HA       GLN  36  68.955  -7.239  -8.806
  335   1HB   GLN  36           HB2      GLN  36  67.548  -9.272 -10.569
  336   2HB   GLN  36           HB1      GLN  36  68.297  -7.812 -11.215
  337   1HG   GLN  36           HG2      GLN  36  70.426  -8.571 -10.841
  338   2HG   GLN  36           HG1      GLN  36  69.969  -9.450  -9.382
  339   1HE2  GLN  36          HE22      GLN  36  68.881 -11.382 -12.839
  340   2HE2  GLN  36          HE21      GLN  36  68.472  -9.748 -12.631
  341    H    GLN  37           HN       GLN  37  65.663  -8.485  -8.926
  342    HA   GLN  37           HA       GLN  37  64.449  -6.104 -10.000
  343   1HB   GLN  37           HB2      GLN  37  63.419  -8.435  -9.947
  344   2HB   GLN  37           HB1      GLN  37  63.115  -8.168  -8.230
  345   1HG   GLN  37           HG2      GLN  37  61.430  -6.677  -8.624
  346   2HG   GLN  37           HG1      GLN  37  62.247  -5.969 -10.018
  347   1HE2  GLN  37          HE21      GLN  37  61.417  -9.427  -9.512
  348   2HE2  GLN  37          HE22      GLN  37  60.393  -9.536 -10.862
  349    H    ILE  38           HN       ILE  38  65.620  -7.007  -6.826
  350    HA   ILE  38           HA       ILE  38  63.997  -5.043  -5.414
  351    HB   ILE  38           HB       ILE  38  66.408  -6.686  -4.588
  352   1HG1  ILE  38          HG12      ILE  38  64.242  -7.850  -4.737
  353   2HG1  ILE  38          HG11      ILE  38  64.743  -7.703  -3.054
  354   1HG2  ILE  38          HG23      ILE  38  65.065  -4.384  -3.171
  355   2HG2  ILE  38          HG22      ILE  38  65.671  -5.741  -2.221
  356   3HG2  ILE  38          HG21      ILE  38  66.778  -4.805  -3.224
  357   1HD1  ILE  38          HD12      ILE  38  63.318  -5.381  -3.389
  358   2HD1  ILE  38          HD11      ILE  38  62.438  -6.481  -4.447
  359   3HD1  ILE  38          HD13      ILE  38  62.638  -6.872  -2.739
  360    H    THR  39           HN       THR  39  67.105  -5.165  -7.008
  361    HA   THR  39           HA       THR  39  68.089  -2.618  -6.052
  362    HB   THR  39           HB       THR  39  68.767  -3.744  -8.767
  363    HG1  THR  39           HG1      THR  39  69.544  -5.466  -7.889
  364   1HG2  THR  39          HG22      THR  39  70.001  -1.978  -6.717
  365   2HG2  THR  39          HG21      THR  39  71.091  -3.040  -7.608
  366   3HG2  THR  39          HG23      THR  39  70.079  -1.886  -8.476
  367    H    HIS  40           HN       HIS  40  66.165  -3.697  -8.811
  368    HA   HIS  40           HA       HIS  40  65.868  -1.039  -9.976
  369   1HB   HIS  40           HB2      HIS  40  64.420  -3.665 -10.396
  370   2HB   HIS  40           HB1      HIS  40  64.001  -2.190 -11.271
  371    HD1  HIS  40           HD1      HIS  40  66.516  -0.984 -12.146
  372    HD2  HIS  40           HD2      HIS  40  66.120  -5.131 -11.998
  373    HE1  HIS  40           HE1      HIS  40  68.292  -1.927 -13.685
  374    H    ILE  41           HN       ILE  41  64.342  -2.824  -7.429
  375    HA   ILE  41           HA       ILE  41  61.825  -1.415  -7.381
  376    HB   ILE  41           HB       ILE  41  63.196  -3.470  -5.904
  377   1HG1  ILE  41          HG12      ILE  41  60.535  -3.343  -4.992
  378   2HG1  ILE  41          HG11      ILE  41  60.493  -2.700  -6.634
  379   1HG2  ILE  41          HG23      ILE  41  61.956  -1.355  -4.145
  380   2HG2  ILE  41          HG22      ILE  41  62.295  -3.004  -3.617
  381   3HG2  ILE  41          HG21      ILE  41  63.619  -1.941  -4.097
  382   1HD1  ILE  41          HD11      ILE  41  61.937  -5.268  -5.950
  383   2HD1  ILE  41          HD13      ILE  41  60.230  -5.240  -6.394
  384   3HD1  ILE  41          HD12      ILE  41  61.449  -4.688  -7.543
  385    H    ALA  42           HN       ALA  42  64.975  -1.026  -5.856
  386    HA   ALA  42           HA       ALA  42  64.391   1.239  -4.245
  387   1HB   ALA  42           HB1      ALA  42  66.946   0.207  -5.480
  388   2HB   ALA  42           HB3      ALA  42  66.916   1.634  -4.443
  389   3HB   ALA  42           HB2      ALA  42  66.422   0.066  -3.801
  390    H    ASN  43           HN       ASN  43  65.883   1.061  -7.478
  391    HA   ASN  43           HA       ASN  43  65.865   3.892  -7.927
  392   1HB   ASN  43           HB2      ASN  43  67.043   1.993  -9.284
  393   2HB   ASN  43           HB1      ASN  43  65.506   1.882 -10.142
  394   1HD2  ASN  43          HD22      ASN  43  67.831   5.235 -10.615
  395   2HD2  ASN  43          HD21      ASN  43  68.115   4.198  -9.302
  396    H    GLN  44           HN       GLN  44  63.396   1.479  -7.903
  397    HA   GLN  44           HA       GLN  44  61.480   2.743  -9.611
  398   1HB   GLN  44           HB2      GLN  44  61.711   0.369  -8.092
  399   2HB   GLN  44           HB1      GLN  44  60.252   1.172  -7.534
  400   1HG   GLN  44           HG2      GLN  44  60.918   0.567 -10.431
  401   2HG   GLN  44           HG1      GLN  44  59.816  -0.377  -9.429
  402   1HE2  GLN  44          HE21      GLN  44  57.725   0.553  -8.910
  403   2HE2  GLN  44          HE22      GLN  44  57.151   1.954  -9.678
  404    H    LEU  45           HN       LEU  45  62.197   2.965  -6.140
  405    HA   LEU  45           HA       LEU  45  60.325   5.288  -6.063
  406   1HB   LEU  45           HB2      LEU  45  59.475   4.681  -3.932
  407   2HB   LEU  45           HB1      LEU  45  59.447   3.212  -4.890
  408    HG   LEU  45           HG       LEU  45  61.751   3.863  -3.053
  409   1HD1  LEU  45          HD11      LEU  45  59.041   3.245  -2.303
  410   2HD1  LEU  45          HD13      LEU  45  60.060   1.855  -1.930
  411   3HD1  LEU  45          HD12      LEU  45  60.449   3.437  -1.261
  412   1HD2  LEU  45          HD23      LEU  45  60.810   1.586  -4.719
  413   2HD2  LEU  45          HD22      LEU  45  62.454   2.104  -4.346
  414   3HD2  LEU  45          HD21      LEU  45  61.528   1.184  -3.160
  415    H    GLY  46           HN       GLY  46  63.319   5.039  -6.366
  416   1HA   GLY  46           HA2      GLY  46  65.254   6.108  -5.590
  417   2HA   GLY  46           HA1      GLY  46  64.135   7.401  -5.186
  418    H    LEU  47           HN       LEU  47  63.986   4.278  -3.527
  419    HA   LEU  47           HA       LEU  47  64.896   5.716  -1.074
  420   1HB   LEU  47           HB2      LEU  47  63.396   4.551   0.202
  421   2HB   LEU  47           HB1      LEU  47  62.561   4.385  -1.326
  422    HG   LEU  47           HG       LEU  47  64.335   2.350   0.014
  423   1HD1  LEU  47          HD13      LEU  47  61.605   2.879   0.280
  424   2HD1  LEU  47          HD12      LEU  47  61.668   1.518  -0.838
  425   3HD1  LEU  47          HD11      LEU  47  62.419   1.388   0.746
  426   1HD2  LEU  47          HD23      LEU  47  63.530   2.641  -2.788
  427   2HD2  LEU  47          HD22      LEU  47  64.829   1.685  -2.094
  428   3HD2  LEU  47          HD21      LEU  47  63.184   1.062  -2.110
  429    H    GLU  48           HN       GLU  48  65.839   3.956   0.589
  430    HA   GLU  48           HA       GLU  48  68.222   2.848  -0.782
  431   1HB   GLU  48           HB2      GLU  48  68.942   2.371   1.656
  432   2HB   GLU  48           HB1      GLU  48  68.859   4.054   1.153
  433   1HG   GLU  48           HG2      GLU  48  66.921   4.465   2.388
  434   2HG   GLU  48           HG1      GLU  48  66.455   2.766   2.409
  435    H    LYS  49           HN       LYS  49  68.943   0.684   0.666
  436    HA   LYS  49           HA       LYS  49  66.852  -1.268  -0.051
  437   1HB   LYS  49           HB2      LYS  49  69.723  -1.540   0.861
  438   2HB   LYS  49           HB1      LYS  49  68.664  -2.928   0.615
  439   1HG   LYS  49           HG2      LYS  49  68.622  -2.671  -1.675
  440   2HG   LYS  49           HG1      LYS  49  68.813  -0.919  -1.585
  441   1HD   LYS  49           HD2      LYS  49  71.117  -1.035  -1.407
  442   2HD   LYS  49           HD1      LYS  49  71.082  -2.626  -0.648
  443   1HE   LYS  49           HE2      LYS  49  71.746  -3.333  -2.716
  444   2HE   LYS  49           HE1      LYS  49  70.023  -3.232  -3.075
  445   1HZ   LYS  49           HZ1      LYS  49  70.368  -0.959  -3.849
  446   2HZ   LYS  49           HZ3      LYS  49  72.031  -1.094  -3.541
  447   3HZ   LYS  49           HZ2      LYS  49  71.309  -2.063  -4.734
  448    H    ASP  50           HN       ASP  50  67.885   0.415   2.763
  449    HA   ASP  50           HA       ASP  50  67.166  -1.674   4.665
  450   1HB   ASP  50           HB2      ASP  50  68.751   0.486   4.893
  451   2HB   ASP  50           HB1      ASP  50  67.252   1.180   5.513
  452    H    VAL  51           HN       VAL  51  65.586   1.311   3.426
  453    HA   VAL  51           HA       VAL  51  63.226   0.791   5.083
  454    HB   VAL  51           HB       VAL  51  63.896   3.107   4.488
  455   1HG1  VAL  51          HG11      VAL  51  63.909   1.965   1.819
  456   2HG1  VAL  51          HG13      VAL  51  62.907   3.414   1.883
  457   3HG1  VAL  51          HG12      VAL  51  64.597   3.483   2.379
  458   1HG2  VAL  51          HG23      VAL  51  61.478   2.332   4.917
  459   2HG2  VAL  51          HG22      VAL  51  61.687   3.895   4.125
  460   3HG2  VAL  51          HG21      VAL  51  61.249   2.476   3.174
  461    H    VAL  52           HN       VAL  52  64.401  -0.097   1.932
  462    HA   VAL  52           HA       VAL  52  61.790  -0.774   0.843
  463    HB   VAL  52           HB       VAL  52  64.144  -0.260  -0.337
  464   1HG1  VAL  52          HG12      VAL  52  65.211  -2.348   0.559
  465   2HG1  VAL  52          HG11      VAL  52  64.071  -3.280  -0.413
  466   3HG1  VAL  52          HG13      VAL  52  65.241  -2.220  -1.200
  467   1HG2  VAL  52          HG21      VAL  52  61.748  -0.698  -1.243
  468   2HG2  VAL  52          HG23      VAL  52  63.123  -0.870  -2.330
  469   3HG2  VAL  52          HG22      VAL  52  62.373  -2.302  -1.631
  470    NH1  ARG  53           NH1      ARG  53  65.565  -6.223   8.001
  471    NH2  ARG  53           NH2      ARG  53  65.884  -8.403   7.493
  472    H    ARG  53           HN       ARG  53  64.302  -2.444   2.657
  473    HA   ARG  53           HA       ARG  53  63.101  -5.082   2.275
  474   1HB   ARG  53           HB2      ARG  53  65.580  -4.492   2.795
  475   2HB   ARG  53           HB1      ARG  53  65.038  -4.383   4.470
  476   1HG   ARG  53           HG2      ARG  53  64.162  -6.781   2.941
  477   2HG   ARG  53           HG1      ARG  53  65.871  -6.697   3.371
  478   1HD   ARG  53           HD2      ARG  53  63.894  -6.021   5.499
  479   2HD   ARG  53           HD1      ARG  53  64.047  -7.719   5.044
  480    HE   ARG  53           HE       ARG  53  66.666  -6.699   5.415
  481   1HH1  ARG  53          HH11      ARG  53  65.461  -5.272   7.708
  482   2HH1  ARG  53          HH12      ARG  53  65.526  -6.454   8.973
  483   1HH2  ARG  53          HH21      ARG  53  66.024  -9.122   6.812
  484   2HH2  ARG  53          HH22      ARG  53  65.847  -8.635   8.465
  485    H    VAL  54           HN       VAL  54  63.135  -2.638   4.876
  486    HA   VAL  54           HA       VAL  54  61.654  -4.216   6.774
  487    HB   VAL  54           HB       VAL  54  61.727  -1.191   6.503
  488   1HG1  VAL  54          HG11      VAL  54  60.699  -3.112   8.528
  489   2HG1  VAL  54          HG13      VAL  54  61.563  -1.707   9.150
  490   3HG1  VAL  54          HG12      VAL  54  60.139  -1.487   8.133
  491   1HG2  VAL  54          HG22      VAL  54  63.952  -2.615   6.701
  492   2HG2  VAL  54          HG21      VAL  54  63.732  -1.170   7.689
  493   3HG2  VAL  54          HG23      VAL  54  63.455  -2.766   8.386
  494    CH2  TRP  55           CH2      TRP  55  55.726  -3.089  -1.126
  495    H    TRP  55           HN       TRP  55  60.687  -1.886   4.280
  496    HA   TRP  55           HA       TRP  55  57.870  -1.944   4.860
  497   1HB   TRP  55           HB2      TRP  55  58.765  -0.135   3.526
  498   2HB   TRP  55           HB1      TRP  55  59.463  -1.256   2.365
  499    HD1  TRP  55           HD1      TRP  55  56.279   0.598   3.195
  500    HE1  TRP  55           HE1      TRP  55  54.532   0.114   1.396
  501    HE3  TRP  55           HE3      TRP  55  58.582  -3.222   0.690
  502    HZ2  TRP  55           HZ2      TRP  55  54.111  -1.713  -0.786
  503    HZ3  TRP  55           HZ3      TRP  55  57.487  -4.317  -1.230
  504    HH2  TRP  55           HH2      TRP  55  55.249  -3.572  -1.963
  505    H    PHE  56           HN       PHE  56  59.910  -3.858   2.622
  506    HA   PHE  56           HA       PHE  56  57.571  -5.451   1.870
  507   1HB   PHE  56           HB2      PHE  56  59.583  -4.955   0.332
  508   2HB   PHE  56           HB1      PHE  56  60.410  -6.226   1.237
  509    HD1  PHE  56           HD2      PHE  56  56.855  -5.829   0.059
  510    HD2  PHE  56           HD1      PHE  56  60.424  -8.218  -0.007
  511    HE1  PHE  56           HE2      PHE  56  55.672  -7.552  -1.247
  512    HE2  PHE  56           HE1      PHE  56  59.228  -9.952  -1.314
  513    HZ   PHE  56           HZ       PHE  56  56.847  -9.611  -1.929
  514    H    CYS  57           HN       CYS  57  59.475  -5.402   4.601
  515    HA   CYS  57           HA       CYS  57  59.789  -8.260   5.006
  516   1HB   CYS  57           HB2      CYS  57  61.128  -6.462   6.211
  517   2HB   CYS  57           HB1      CYS  57  59.668  -6.096   7.130
  518    HG   CYS  57           HG       CYS  57  61.138  -8.857   7.260
  519    H    ASN  58           HN       ASN  58  57.463  -5.774   6.000
  520    HA   ASN  58           HA       ASN  58  55.736  -7.664   7.390
  521   1HB   ASN  58           HB2      ASN  58  55.598  -4.782   6.603
  522   2HB   ASN  58           HB1      ASN  58  54.073  -5.614   6.907
  523   1HD2  ASN  58          HD22      ASN  58  54.585  -5.845  10.408
  524   2HD2  ASN  58          HD21      ASN  58  53.623  -6.321   9.093
  525    NH1  ARG  59           NH1      ARG  59  52.589  -3.819   4.794
  526    NH2  ARG  59           NH2      ARG  59  54.437  -2.537   4.612
  527    H    ARG  59           HN       ARG  59  55.858  -6.151   4.176
  528    HA   ARG  59           HA       ARG  59  53.390  -7.196   3.159
  529   1HB   ARG  59           HB2      ARG  59  55.683  -5.815   2.120
  530   2HB   ARG  59           HB1      ARG  59  55.340  -7.171   1.054
  531   1HG   ARG  59           HG2      ARG  59  54.160  -5.085   0.394
  532   2HG   ARG  59           HG1      ARG  59  53.066  -6.421   0.734
  533   1HD   ARG  59           HD2      ARG  59  52.402  -4.150   1.715
  534   2HD   ARG  59           HD1      ARG  59  52.440  -5.497   2.847
  535    HE   ARG  59           HE       ARG  59  54.977  -4.103   2.769
  536   1HH1  ARG  59          HH11      ARG  59  52.004  -4.554   4.458
  537   2HH1  ARG  59          HH12      ARG  59  52.339  -3.327   5.627
  538   1HH2  ARG  59          HH21      ARG  59  55.278  -2.285   4.132
  539   2HH2  ARG  59          HH22      ARG  59  54.174  -2.053   5.447
  540    NH1  ARG  60           NH2      ARG  60  61.665 -13.639   0.606
  541    NH2  ARG  60           NH1      ARG  60  62.599 -12.416   2.262
  542    H    ARG  60           HN       ARG  60  56.512  -8.705   3.677
  543    HA   ARG  60           HA       ARG  60  55.891 -11.024   2.002
  544   1HB   ARG  60           HB2      ARG  60  58.188 -10.002   3.496
  545   2HB   ARG  60           HB1      ARG  60  57.990 -11.742   3.698
  546   1HG   ARG  60           HG2      ARG  60  57.993 -12.083   1.298
  547   2HG   ARG  60           HG1      ARG  60  57.992 -10.343   1.009
  548   1HD   ARG  60           HD2      ARG  60  60.254 -10.782   0.791
  549   2HD   ARG  60           HD1      ARG  60  60.175 -10.434   2.517
  550    HE   ARG  60           HE       ARG  60  59.789 -13.111   2.536
  551   1HH1  ARG  60          HH21      ARG  60  60.852 -13.968   0.125
  552   2HH1  ARG  60          HH22      ARG  60  62.574 -13.916   0.298
  553   1HH2  ARG  60          HH11      ARG  60  62.501 -11.808   3.050
  554   2HH2  ARG  60          HH12      ARG  60  63.508 -12.694   1.955
  555    H    GLN  61           HN       GLN  61  56.088 -10.397   5.521
  556    HA   GLN  61           HA       GLN  61  54.799 -13.040   5.983
  557   1HB   GLN  61           HB2      GLN  61  55.419 -12.670   8.367
  558   2HB   GLN  61           HB1      GLN  61  56.819 -12.638   7.295
  559   1HG   GLN  61           HG2      GLN  61  57.190 -10.404   7.620
  560   2HG   GLN  61           HG1      GLN  61  55.472 -10.032   7.772
  561   1HE2  GLN  61          HE22      GLN  61  57.612 -11.100  11.102
  562   2HE2  GLN  61          HE21      GLN  61  58.263 -11.373   9.559
  563    H    LYS  62           HN       LYS  62  53.002 -11.419   4.884
  564    HA   LYS  62           HA       LYS  62  51.547  -9.835   6.864
  565   1HB   LYS  62           HB2      LYS  62  50.900 -10.786   4.061
  566   2HB   LYS  62           HB1      LYS  62  49.765  -9.848   5.032
  567   1HG   LYS  62           HG2      LYS  62  51.748  -8.190   5.339
  568   2HG   LYS  62           HG1      LYS  62  52.449  -9.015   3.948
  569   1HD   LYS  62           HD2      LYS  62  51.225  -7.593   2.679
  570   2HD   LYS  62           HD1      LYS  62  49.834  -8.574   3.136
  571   1HE   LYS  62           HE2      LYS  62  50.833  -6.193   4.726
  572   2HE   LYS  62           HE1      LYS  62  49.504  -6.126   3.568
  573   1HZ   LYS  62           HZ1      LYS  62  49.612  -7.863   5.976
  574   2HZ   LYS  62           HZ3      LYS  62  48.702  -6.439   5.826
  575   3HZ   LYS  62           HZ2      LYS  62  48.331  -7.788   4.863
  576    H    GLY  63           HN       GLY  63  51.614 -13.163   5.809
  577   1HA   GLY  63           HA2      GLY  63  49.622 -13.841   7.871
  578   2HA   GLY  63           HA1      GLY  63  49.222 -14.316   6.220
  579    H    LYS  64           HN       LYS  64  51.985 -14.513   8.491
  580    HA   LYS  64           HA       LYS  64  52.947 -16.961   7.185
  581   1HB   LYS  64           HB2      LYS  64  54.218 -14.960   8.541
  582   2HB   LYS  64           HB1      LYS  64  54.093 -16.189   9.800
  583   1HG   LYS  64           HG2      LYS  64  55.170 -17.836   8.353
  584   2HG   LYS  64           HG1      LYS  64  55.212 -16.677   7.023
  585   1HD   LYS  64           HD2      LYS  64  57.329 -16.311   7.837
  586   2HD   LYS  64           HD1      LYS  64  56.456 -15.204   8.898
  587   1HE   LYS  64           HE2      LYS  64  56.247 -17.042  10.577
  588   2HE   LYS  64           HE1      LYS  64  57.237 -18.064   9.534
  589   1HZ   LYS  64           HZ3      LYS  64  58.211 -15.403  10.324
  590   2HZ   LYS  64           HZ2      LYS  64  58.342 -16.700  11.413
  591   3HZ   LYS  64           HZ1      LYS  64  59.095 -16.785   9.892
  592    NH1  ARG  65           NH2      ARG  65  53.297 -21.058  16.777
  593    NH2  ARG  65           NH1      ARG  65  54.274 -22.535  15.372
  594    H    ARG  65           HN       ARG  65  52.260 -16.254  10.610
  595    HA   ARG  65           HA       ARG  65  51.421 -19.082  10.929
  596   1HB   ARG  65           HB2      ARG  65  52.704 -17.096  12.630
  597   2HB   ARG  65           HB1      ARG  65  51.303 -17.799  13.436
  598   1HG   ARG  65           HG2      ARG  65  52.340 -20.067  12.504
  599   2HG   ARG  65           HG1      ARG  65  53.828 -19.120  12.527
  600   1HD   ARG  65           HD2      ARG  65  53.151 -18.468  14.935
  601   2HD   ARG  65           HD1      ARG  65  52.016 -19.813  14.838
  602    HE   ARG  65           HE       ARG  65  54.912 -20.283  14.300
  603   1HH1  ARG  65          HH21      ARG  65  52.991 -20.128  16.980
  604   2HH1  ARG  65          HH22      ARG  65  53.160 -21.787  17.448
  605   1HH2  ARG  65          HH11      ARG  65  54.716 -22.737  14.499
  606   2HH2  ARG  65          HH12      ARG  65  54.137 -23.264  16.044
  607    H    SER  66           HN       SER  66  49.710 -17.109   9.565
  608    HA   SER  66           HA       SER  66  47.272 -17.560  11.152
  609   1HB   SER  66           HB2      SER  66  47.754 -14.760  10.161
  610   2HB   SER  66           HB1      SER  66  46.631 -15.319  11.398
  611    HG   SER  66           HG       SER  66  48.673 -14.240  12.084
  612    H    SER  67           HN       SER  67  45.403 -16.324   9.722
  613    HA   SER  67           HA       SER  67  45.957 -16.559   6.835
  614   1HB   SER  67           HB2      SER  67  45.383 -18.883   7.718
  615   2HB   SER  67           HB1      SER  67  43.778 -18.252   8.077
  616    HG   SER  67           HG       SER  67  44.727 -19.128   5.764
   
  Start of MODEL           9
 Raw file had  616 H/Q atoms
  Start of MODEL    9
    1   1H    MET   1           HT2      MET   1  52.984  11.248  26.507
    2   2H    MET   1           HT1      MET   1  51.566  11.156  27.436
    3   3H    MET   1           HT3      MET   1  52.507  12.565  27.467
    4    HA   MET   1           HA       MET   1  54.283  11.467  28.583
    5   1HB   MET   1           HB2      MET   1  51.691  11.848  29.649
    6   2HB   MET   1           HB1      MET   1  52.238  10.296  30.281
    7   1HG   MET   1           HG2      MET   1  54.452  11.524  30.826
    8   2HG   MET   1           HG1      MET   1  53.526  13.006  30.592
    9   1HE   MET   1           HE2      MET   1  55.074  11.242  32.936
   10   2HE   MET   1           HE1      MET   1  54.706  12.893  33.430
   11   3HE   MET   1           HE3      MET   1  54.195  11.530  34.437
   12    H    GLU   2           HN       GLU   2  55.085   9.447  29.571
   13    HA   GLU   2           HA       GLU   2  55.626   7.171  29.454
   14   1HB   GLU   2           HB2      GLU   2  52.928   7.272  29.932
   15   2HB   GLU   2           HB1      GLU   2  52.976   6.331  28.441
   16   1HG   GLU   2           HG2      GLU   2  55.007   5.158  29.819
   17   2HG   GLU   2           HG1      GLU   2  53.951   5.630  31.152
   18    H    THR   3           HN       THR   3  56.131   8.790  27.156
   19    HA   THR   3           HA       THR   3  55.456   7.022  24.860
   20    HB   THR   3           HB       THR   3  56.753   9.026  23.680
   21    HG1  THR   3           HG1      THR   3  56.746  10.846  24.835
   22   1HG2  THR   3          HG22      THR   3  53.938   9.092  24.784
   23   2HG2  THR   3          HG21      THR   3  54.538  10.257  23.603
   24   3HG2  THR   3          HG23      THR   3  54.453   8.545  23.188
   25    H    LEU   4           HN       LEU   4  56.935   5.448  24.453
   26    HA   LEU   4           HA       LEU   4  59.820   6.147  24.605
   27   1HB   LEU   4           HB2      LEU   4  58.385   4.110  26.215
   28   2HB   LEU   4           HB1      LEU   4  59.910   3.586  25.498
   29    HG   LEU   4           HG       LEU   4  59.794   6.240  26.891
   30   1HD1  LEU   4          HD12      LEU   4  58.770   4.344  28.335
   31   2HD1  LEU   4          HD11      LEU   4  60.408   3.690  28.381
   32   3HD1  LEU   4          HD13      LEU   4  60.081   5.295  29.035
   33   1HD2  LEU   4          HD23      LEU   4  61.819   4.194  26.085
   34   2HD2  LEU   4          HD22      LEU   4  61.896   5.953  25.974
   35   3HD2  LEU   4          HD21      LEU   4  62.155   5.155  27.525
   36    H    VAL   5           HN       VAL   5  57.700   3.367  23.867
   37    HA   VAL   5           HA       VAL   5  59.080   3.170  21.218
   38    HB   VAL   5           HB       VAL   5  58.042   0.781  22.764
   39   1HG1  VAL   5          HG11      VAL   5  59.537   1.278  20.231
   40   2HG1  VAL   5          HG13      VAL   5  59.986  -0.147  21.167
   41   3HG1  VAL   5          HG12      VAL   5  58.328   0.049  20.598
   42   1HG2  VAL   5          HG22      VAL   5  60.809   2.024  22.752
   43   2HG2  VAL   5          HG21      VAL   5  59.790   1.691  24.152
   44   3HG2  VAL   5          HG23      VAL   5  60.505   0.358  23.245
   45    H    GLN   6           HN       GLN   6  56.714   4.628  21.632
   46    HA   GLN   6           HA       GLN   6  54.539   2.846  20.655
   47   1HB   GLN   6           HB2      GLN   6  54.626   5.561  21.933
   48   2HB   GLN   6           HB1      GLN   6  53.231   5.111  20.952
   49   1HG   GLN   6           HG2      GLN   6  54.238   3.208  23.047
   50   2HG   GLN   6           HG1      GLN   6  53.230   4.574  23.527
   51   1HE2  GLN   6          HE22      GLN   6  51.554   1.416  21.593
   52   2HE2  GLN   6          HE21      GLN   6  53.222   1.465  21.905
   53    H    ALA   7           HN       ALA   7  56.580   5.544  19.700
   54    HA   ALA   7           HA       ALA   7  55.173   6.400  17.387
   55   1HB   ALA   7           HB1      ALA   7  57.090   7.635  18.338
   56   2HB   ALA   7           HB3      ALA   7  58.169   6.325  17.856
   57   3HB   ALA   7           HB2      ALA   7  57.346   7.287  16.628
   58    NH1  ARG   8           NH1      ARG   8  57.302  -1.513  13.382
   59    NH2  ARG   8           NH2      ARG   8  56.117  -3.254  14.203
   60    H    ARG   8           HN       ARG   8  54.762   5.321  15.530
   61    HA   ARG   8           HA       ARG   8  56.710   3.400  14.475
   62   1HB   ARG   8           HB2      ARG   8  54.388   2.563  15.938
   63   2HB   ARG   8           HB1      ARG   8  54.171   2.103  14.250
   64   1HG   ARG   8           HG2      ARG   8  56.686   1.295  14.490
   65   2HG   ARG   8           HG1      ARG   8  56.266   1.224  16.202
   66   1HD   ARG   8           HD2      ARG   8  54.284  -0.177  15.620
   67   2HD   ARG   8           HD1      ARG   8  54.814  -0.175  13.937
   68    HE   ARG   8           HE       ARG   8  56.345  -1.434  16.175
   69   1HH1  ARG   8          HH11      ARG   8  57.591  -0.557  13.441
   70   2HH1  ARG   8          HH12      ARG   8  57.633  -2.090  12.635
   71   1HH2  ARG   8          HH21      ARG   8  55.498  -3.632  14.892
   72   2HH2  ARG   8          HH22      ARG   8  56.447  -3.831  13.457
   73    H    LYS   9           HN       LYS   9  53.305   4.406  13.954
   74    HA   LYS   9           HA       LYS   9  54.083   5.317  11.256
   75   1HB   LYS   9           HB2      LYS   9  52.016   4.209  10.323
   76   2HB   LYS   9           HB1      LYS   9  53.271   3.083  10.842
   77   1HG   LYS   9           HG2      LYS   9  52.095   2.809  13.015
   78   2HG   LYS   9           HG1      LYS   9  50.815   3.876  12.437
   79   1HD   LYS   9           HD2      LYS   9  50.782   2.188  10.393
   80   2HD   LYS   9           HD1      LYS   9  51.492   1.089  11.575
   81   1HE   LYS   9           HE2      LYS   9  49.604   1.644  13.135
   82   2HE   LYS   9           HE1      LYS   9  48.864   2.576  11.833
   83   1HZ   LYS   9           HZ2      LYS   9  49.674  -0.211  11.359
   84   2HZ   LYS   9           HZ1      LYS   9  48.214   0.112  12.165
   85   3HZ   LYS   9           HZ3      LYS   9  48.462   0.701  10.593
   86    NH1  ARG  10           NH2      ARG  10  49.837  11.020  18.869
   87    NH2  ARG  10           NH1      ARG  10  48.912   9.045  19.463
   88    H    ARG  10           HN       ARG  10  53.672   7.097  13.218
   89    HA   ARG  10           HA       ARG  10  50.887   8.055  12.852
   90   1HB   ARG  10           HB2      ARG  10  52.172   7.597  15.213
   91   2HB   ARG  10           HB1      ARG  10  52.552   9.300  14.956
   92   1HG   ARG  10           HG2      ARG  10  49.969   9.449  14.375
   93   2HG   ARG  10           HG1      ARG  10  49.890   7.993  15.369
   94   1HD   ARG  10           HD2      ARG  10  51.446   9.495  16.963
   95   2HD   ARG  10           HD1      ARG  10  50.563  10.787  16.151
   96    HE   ARG  10           HE       ARG  10  48.574   9.023  16.918
   97   1HH1  ARG  10          HH21      ARG  10  50.187  11.635  18.162
   98   2HH1  ARG  10          HH22      ARG  10  49.844  11.305  19.827
   99   1HH2  ARG  10          HH11      ARG  10  48.554   8.146  19.211
  100   2HH2  ARG  10          HH12      ARG  10  48.920   9.329  20.421
  101    H    LYS  11           HN       LYS  11  53.278   8.438  11.055
  102    HA   LYS  11           HA       LYS  11  52.925  11.290  10.620
  103   1HB   LYS  11           HB2      LYS  11  54.914  10.727  12.368
  104   2HB   LYS  11           HB1      LYS  11  55.797  10.564  10.851
  105   1HG   LYS  11           HG2      LYS  11  56.050  12.829  11.117
  106   2HG   LYS  11           HG1      LYS  11  54.471  12.853  10.332
  107   1HD   LYS  11           HD2      LYS  11  53.367  12.875  12.536
  108   2HD   LYS  11           HD1      LYS  11  54.944  12.847  13.327
  109   1HE   LYS  11           HE2      LYS  11  54.435  14.983  11.298
  110   2HE   LYS  11           HE1      LYS  11  53.669  15.145  12.879
  111   1HZ   LYS  11           HZ2      LYS  11  56.534  14.487  12.677
  112   2HZ   LYS  11           HZ1      LYS  11  56.018  16.099  12.526
  113   3HZ   LYS  11           HZ3      LYS  11  55.693  15.237  13.950
  114    NH1  ARG  12           NH1      ARG  12  55.420  17.144   6.773
  115    NH2  ARG  12           NH2      ARG  12  54.482  16.936   4.728
  116    H    ARG  12           HN       ARG  12  54.117  11.961   8.589
  117    HA   ARG  12           HA       ARG  12  53.975   9.773   6.631
  118   1HB   ARG  12           HB2      ARG  12  54.366  11.598   4.971
  119   2HB   ARG  12           HB1      ARG  12  52.983  11.906   6.022
  120   1HG   ARG  12           HG2      ARG  12  54.095  13.564   7.227
  121   2HG   ARG  12           HG1      ARG  12  55.691  12.933   6.815
  122   1HD   ARG  12           HD2      ARG  12  55.168  13.573   4.396
  123   2HD   ARG  12           HD1      ARG  12  53.790  14.469   5.033
  124    HE   ARG  12           HE       ARG  12  56.630  15.069   5.756
  125   1HH1  ARG  12          HH11      ARG  12  55.964  16.759   7.519
  126   2HH1  ARG  12          HH12      ARG  12  55.052  18.070   6.848
  127   1HH2  ARG  12          HH21      ARG  12  54.306  16.393   3.907
  128   2HH2  ARG  12          HH22      ARG  12  54.112  17.863   4.803
  129    H    THR  13           HN       THR  13  56.437  11.095   8.574
  130    HA   THR  13           HA       THR  13  58.605  10.820   6.637
  131    HB   THR  13           HB       THR  13  59.016  10.843   9.614
  132    HG1  THR  13           HG1      THR  13  58.336  12.836   9.762
  133   1HG2  THR  13          HG21      THR  13  60.458  11.790   7.152
  134   2HG2  THR  13          HG23      THR  13  60.824  12.503   8.724
  135   3HG2  THR  13          HG22      THR  13  61.053  10.774   8.464
  136    H    SER  14           HN       SER  14  56.886   8.688   8.769
  137    HA   SER  14           HA       SER  14  59.064   6.670   8.682
  138   1HB   SER  14           HB2      SER  14  57.806   5.475  10.343
  139   2HB   SER  14           HB1      SER  14  57.768   7.172  10.812
  140    HG   SER  14           HG       SER  14  55.745   5.505  10.002
  141    H    ILE  15           HN       ILE  15  57.762   4.309   8.544
  142    HA   ILE  15           HA       ILE  15  56.845   4.229   5.758
  143    HB   ILE  15           HB       ILE  15  57.272   2.078   7.846
  144   1HG1  ILE  15          HG12      ILE  15  59.305   3.190   6.955
  145   2HG1  ILE  15          HG11      ILE  15  59.215   1.502   6.460
  146   1HG2  ILE  15          HG21      ILE  15  56.063   1.956   5.120
  147   2HG2  ILE  15          HG23      ILE  15  57.198   0.678   5.551
  148   3HG2  ILE  15          HG22      ILE  15  55.756   0.943   6.530
  149   1HD1  ILE  15          HD13      ILE  15  57.838   3.027   4.480
  150   2HD1  ILE  15          HD12      ILE  15  59.372   3.839   4.793
  151   3HD1  ILE  15          HD11      ILE  15  59.356   2.145   4.308
  152    H    GLU  16           HN       GLU  16  54.869   5.509   6.120
  153    HA   GLU  16           HA       GLU  16  52.777   4.336   7.761
  154   1HB   GLU  16           HB2      GLU  16  51.322   6.094   6.668
  155   2HB   GLU  16           HB1      GLU  16  52.706   6.731   7.550
  156   1HG   GLU  16           HG2      GLU  16  53.917   7.161   5.552
  157   2HG   GLU  16           HG1      GLU  16  52.832   6.162   4.596
  158    H    ASN  17           HN       ASN  17  50.587   3.911   6.569
  159    HA   ASN  17           HA       ASN  17  51.073   1.772   4.703
  160   1HB   ASN  17           HB2      ASN  17  48.758   2.915   6.106
  161   2HB   ASN  17           HB1      ASN  17  48.363   2.351   4.482
  162   1HD2  ASN  17          HD22      ASN  17  49.445  -1.071   5.285
  163   2HD2  ASN  17          HD21      ASN  17  49.680   0.075   4.055
  164    NH1  ARG  18           NH2      ARG  18  44.977   7.140   1.909
  165    NH2  ARG  18           NH1      ARG  18  44.924   9.237   2.749
  166    H    ARG  18           HN       ARG  18  50.369   5.169   4.388
  167    HA   ARG  18           HA       ARG  18  49.653   4.978   1.555
  168   1HB   ARG  18           HB2      ARG  18  49.291   6.880   3.572
  169   2HB   ARG  18           HB1      ARG  18  50.488   7.621   2.513
  170   1HG   ARG  18           HG2      ARG  18  49.038   7.364   0.591
  171   2HG   ARG  18           HG1      ARG  18  47.879   6.426   1.535
  172   1HD   ARG  18           HD2      ARG  18  47.775   8.510   3.078
  173   2HD   ARG  18           HD1      ARG  18  48.520   9.366   1.729
  174    HE   ARG  18           HE       ARG  18  46.525   8.916   0.405
  175   1HH1  ARG  18          HH21      ARG  18  45.416   6.448   1.336
  176   2HH1  ARG  18          HH22      ARG  18  44.142   6.917   2.412
  177   1HH2  ARG  18          HH11      ARG  18  45.321  10.152   2.818
  178   2HH2  ARG  18          HH12      ARG  18  44.089   9.015   3.252
  179    H    VAL  19           HN       VAL  19  52.588   4.836   3.264
  180    HA   VAL  19           HA       VAL  19  54.110   6.161   1.121
  181    HB   VAL  19           HB       VAL  19  54.630   6.083   3.801
  182   1HG1  VAL  19          HG12      VAL  19  56.174   3.757   2.613
  183   2HG1  VAL  19          HG11      VAL  19  56.778   4.684   3.967
  184   3HG1  VAL  19          HG13      VAL  19  55.257   3.811   4.119
  185   1HG2  VAL  19          HG23      VAL  19  56.545   6.229   1.463
  186   2HG2  VAL  19          HG22      VAL  19  55.697   7.568   2.238
  187   3HG2  VAL  19          HG21      VAL  19  56.977   6.714   3.103
  188    NH1  ARG  20           NH1      ARG  20  56.529  -1.912   5.773
  189    NH2  ARG  20           NH2      ARG  20  54.475  -2.498   6.514
  190    H    ARG  20           HN       ARG  20  53.688   2.957   2.561
  191    HA   ARG  20           HA       ARG  20  55.421   1.605   0.732
  192   1HB   ARG  20           HB2      ARG  20  53.335   0.818   2.680
  193   2HB   ARG  20           HB1      ARG  20  53.616  -0.329   1.369
  194   1HG   ARG  20           HG2      ARG  20  56.106  -0.115   1.899
  195   2HG   ARG  20           HG1      ARG  20  55.622   0.720   3.376
  196   1HD   ARG  20           HD2      ARG  20  54.248  -1.855   2.802
  197   2HD   ARG  20           HD1      ARG  20  55.948  -1.955   3.262
  198    HE   ARG  20           HE       ARG  20  54.030  -0.430   4.965
  199   1HH1  ARG  20          HH11      ARG  20  57.106  -1.410   5.130
  200   2HH1  ARG  20          HH12      ARG  20  56.947  -2.466   6.494
  201   1HH2  ARG  20          HH21      ARG  20  53.479  -2.445   6.438
  202   2HH2  ARG  20          HH22      ARG  20  54.892  -3.052   7.235
  203    CH2  TRP  21           CH2      TRP  21  52.133  -3.366  -0.220
  204    H    TRP  21           HN       TRP  21  51.928   2.294   0.609
  205    HA   TRP  21           HA       TRP  21  51.833   1.039  -2.029
  206   1HB   TRP  21           HB2      TRP  21  49.618   2.435  -0.531
  207   2HB   TRP  21           HB1      TRP  21  49.432   1.444  -1.988
  208    HD1  TRP  21           HD1      TRP  21  48.556   0.843   1.278
  209    HE1  TRP  21           HE1      TRP  21  49.190  -1.483   2.203
  210    HE3  TRP  21           HE3      TRP  21  52.019  -0.633  -2.205
  211    HZ2  TRP  21           HZ2      TRP  21  50.976  -3.660   1.563
  212    HZ3  TRP  21           HZ3      TRP  21  53.174  -2.776  -2.008
  213    HH2  TRP  21           HH2      TRP  21  52.633  -4.319  -0.150
  214    H    SER  22           HN       SER  22  53.053   3.839  -1.061
  215    HA   SER  22           HA       SER  22  52.224   5.426  -3.383
  216   1HB   SER  22           HB2      SER  22  53.838   5.885  -0.929
  217   2HB   SER  22           HB1      SER  22  54.461   6.664  -2.380
  218    HG   SER  22           HG       SER  22  53.016   8.106  -1.743
  219    H    LEU  23           HN       LEU  23  54.851   3.457  -2.060
  220    HA   LEU  23           HA       LEU  23  56.808   3.610  -4.122
  221   1HB   LEU  23           HB2      LEU  23  55.904   1.158  -2.576
  222   2HB   LEU  23           HB1      LEU  23  57.397   1.278  -3.472
  223    HG   LEU  23           HG       LEU  23  56.845   3.222  -1.261
  224   1HD1  LEU  23          HD13      LEU  23  56.440   0.663  -0.701
  225   2HD1  LEU  23          HD12      LEU  23  58.199   0.571  -0.771
  226   3HD1  LEU  23          HD11      LEU  23  57.418   1.644   0.390
  227   1HD2  LEU  23          HD23      LEU  23  58.893   3.038  -3.002
  228   2HD2  LEU  23          HD22      LEU  23  59.150   3.526  -1.327
  229   3HD2  LEU  23          HD21      LEU  23  59.457   1.861  -1.816
  230    H    GLU  24           HN       GLU  24  54.063   1.421  -3.667
  231    HA   GLU  24           HA       GLU  24  54.336  -0.097  -6.034
  232   1HB   GLU  24           HB2      GLU  24  52.727  -0.391  -4.014
  233   2HB   GLU  24           HB1      GLU  24  51.629   0.627  -4.944
  234   1HG   GLU  24           HG2      GLU  24  52.073  -0.989  -6.902
  235   2HG   GLU  24           HG1      GLU  24  52.760  -2.071  -5.690
  236    H    THR  25           HN       THR  25  52.667   2.998  -5.530
  237    HA   THR  25           HA       THR  25  51.451   3.146  -8.118
  238    HB   THR  25           HB       THR  25  52.463   5.477  -6.466
  239    HG1  THR  25           HG1      THR  25  50.001   4.076  -6.326
  240   1HG2  THR  25          HG22      THR  25  51.423   5.542  -8.946
  241   2HG2  THR  25          HG21      THR  25  49.926   5.524  -8.015
  242   3HG2  THR  25          HG23      THR  25  51.111   6.805  -7.756
  243    H    MET  26           HN       MET  26  54.674   3.884  -6.928
  244    HA   MET  26           HA       MET  26  55.504   5.096  -9.481
  245   1HB   MET  26           HB2      MET  26  56.789   4.613  -6.817
  246   2HB   MET  26           HB1      MET  26  57.818   4.905  -8.220
  247   1HG   MET  26           HG2      MET  26  56.876   7.046  -8.606
  248   2HG   MET  26           HG1      MET  26  55.494   6.716  -7.561
  249   1HE   MET  26           HE2      MET  26  59.033   7.425  -8.085
  250   2HE   MET  26           HE1      MET  26  58.462   9.008  -7.565
  251   3HE   MET  26           HE3      MET  26  59.660   8.134  -6.600
  252    H    PHE  27           HN       PHE  27  55.425   1.898  -8.128
  253    HA   PHE  27           HA       PHE  27  57.612   0.941  -9.870
  254   1HB   PHE  27           HB2      PHE  27  55.908  -0.361  -7.745
  255   2HB   PHE  27           HB1      PHE  27  56.798  -1.348  -8.902
  256    HD1  PHE  27           HD1      PHE  27  59.322  -0.657  -9.279
  257    HD2  PHE  27           HD2      PHE  27  57.003   0.338  -5.803
  258    HE1  PHE  27           HE1      PHE  27  61.410  -0.330  -7.980
  259    HE2  PHE  27           HE2      PHE  27  59.089   0.669  -4.506
  260    HZ   PHE  27           HZ       PHE  27  61.292   0.334  -5.594
  261    H    LEU  28           HN       LEU  28  54.140   1.170  -9.927
  262    HA   LEU  28           HA       LEU  28  53.930  -0.851 -12.064
  263   1HB   LEU  28           HB2      LEU  28  51.878   0.803 -10.588
  264   2HB   LEU  28           HB1      LEU  28  51.466  -0.243 -11.949
  265    HG   LEU  28           HG       LEU  28  52.903  -1.161  -9.442
  266   1HD1  LEU  28          HD11      LEU  28  50.271  -0.472  -9.572
  267   2HD1  LEU  28          HD13      LEU  28  50.190  -2.163 -10.066
  268   3HD1  LEU  28          HD12      LEU  28  50.904  -1.731  -8.512
  269   1HD2  LEU  28          HD22      LEU  28  52.595  -2.330 -12.050
  270   2HD2  LEU  28          HD21      LEU  28  53.376  -3.018 -10.628
  271   3HD2  LEU  28          HD23      LEU  28  51.655  -3.280 -10.903
  272    H    LYS  29           HN       LYS  29  55.435   1.610 -12.600
  273    HA   LYS  29           HA       LYS  29  53.674   2.958 -14.581
  274   1HB   LYS  29           HB2      LYS  29  55.440   4.662 -14.743
  275   2HB   LYS  29           HB1      LYS  29  54.972   4.440 -13.061
  276   1HG   LYS  29           HG2      LYS  29  56.968   2.692 -13.067
  277   2HG   LYS  29           HG1      LYS  29  57.516   3.644 -14.444
  278   1HD   LYS  29           HD2      LYS  29  56.690   4.971 -11.863
  279   2HD   LYS  29           HD1      LYS  29  58.320   4.332 -12.074
  280   1HE   LYS  29           HE2      LYS  29  58.799   5.810 -13.855
  281   2HE   LYS  29           HE1      LYS  29  57.096   6.181 -14.119
  282   1HZ   LYS  29           HZ1      LYS  29  58.071   6.808 -11.465
  283   2HZ   LYS  29           HZ3      LYS  29  58.787   7.714 -12.707
  284   3HZ   LYS  29           HZ2      LYS  29  57.100   7.724 -12.516
  285    H    CYS  30           HN       CYS  30  56.741   1.251 -14.249
  286    HA   CYS  30           HA       CYS  30  56.504   0.296 -17.012
  287   1HB   CYS  30           HB2      CYS  30  58.565   2.156 -16.004
  288   2HB   CYS  30           HB1      CYS  30  59.229   0.725 -16.789
  289    HG   CYS  30           HG       CYS  30  58.057   1.376 -18.980
  290    HA   PRO  31           HA       PRO  31  57.897  -3.292 -14.726
  291   1HB   PRO  31           HB2      PRO  31  58.326  -4.976 -16.836
  292   2HB   PRO  31           HB1      PRO  31  56.699  -4.541 -16.280
  293   1HG   PRO  31           HG2      PRO  31  58.154  -3.639 -18.714
  294   2HG   PRO  31           HG1      PRO  31  56.410  -3.724 -18.420
  295   1HD   PRO  31           HD2      PRO  31  58.048  -1.384 -18.301
  296   2HD   PRO  31           HD1      PRO  31  56.347  -1.514 -17.805
  297    H    LYS  32           HN       LYS  32  59.919  -1.229 -16.214
  298    HA   LYS  32           HA       LYS  32  62.236  -3.048 -15.994
  299   1HB   LYS  32           HB2      LYS  32  63.282  -1.726 -17.847
  300   2HB   LYS  32           HB1      LYS  32  61.851  -2.628 -18.341
  301   1HG   LYS  32           HG2      LYS  32  60.518  -0.483 -17.884
  302   2HG   LYS  32           HG1      LYS  32  62.074   0.342 -17.788
  303   1HD   LYS  32           HD2      LYS  32  61.234  -1.360 -20.149
  304   2HD   LYS  32           HD1      LYS  32  60.992   0.385 -20.078
  305   1HE   LYS  32           HE2      LYS  32  63.725  -0.623 -19.450
  306   2HE   LYS  32           HE1      LYS  32  63.206  -0.706 -21.134
  307   1HZ   LYS  32           HZ1      LYS  32  62.780   1.766 -19.599
  308   2HZ   LYS  32           HZ3      LYS  32  64.316   1.437 -20.240
  309   3HZ   LYS  32           HZ2      LYS  32  62.974   1.559 -21.275
  310    HA   PRO  33           HA       PRO  33  62.829   0.929 -13.540
  311   1HB   PRO  33           HB2      PRO  33  62.792  -0.133 -11.001
  312   2HB   PRO  33           HB1      PRO  33  61.358   0.525 -11.809
  313   1HG   PRO  33           HG2      PRO  33  62.094  -2.316 -11.310
  314   2HG   PRO  33           HG1      PRO  33  60.492  -1.590 -11.516
  315   1HD   PRO  33           HD2      PRO  33  61.909  -3.053 -13.490
  316   2HD   PRO  33           HD1      PRO  33  60.478  -2.038 -13.768
  317    H    SER  34           HN       SER  34  64.910   1.492 -12.756
  318    HA   SER  34           HA       SER  34  66.977  -0.570 -13.098
  319   1HB   SER  34           HB2      SER  34  68.514   1.438 -12.810
  320   2HB   SER  34           HB1      SER  34  67.458   1.467 -14.219
  321    HG   SER  34           HG       SER  34  66.441   3.117 -13.400
  322    H    LEU  35           HN       LEU  35  68.565  -1.049 -11.525
  323    HA   LEU  35           HA       LEU  35  67.662  -1.191  -8.804
  324   1HB   LEU  35           HB2      LEU  35  70.361  -1.495 -10.130
  325   2HB   LEU  35           HB1      LEU  35  70.192  -1.589  -8.376
  326    HG   LEU  35           HG       LEU  35  68.199  -3.181  -9.839
  327   1HD1  LEU  35          HD13      LEU  35  70.233  -3.411 -11.310
  328   2HD1  LEU  35          HD12      LEU  35  71.102  -4.054  -9.916
  329   3HD1  LEU  35          HD11      LEU  35  69.716  -4.927 -10.570
  330   1HD2  LEU  35          HD21      LEU  35  68.675  -3.209  -7.359
  331   2HD2  LEU  35          HD23      LEU  35  68.736  -4.800  -8.117
  332   3HD2  LEU  35          HD22      LEU  35  70.232  -3.951  -7.723
  333    H    GLN  36           HN       GLN  36  69.251   1.239 -10.698
  334    HA   GLN  36           HA       GLN  36  70.304   2.830  -8.503
  335   1HB   GLN  36           HB2      GLN  36  71.086   3.126 -10.843
  336   2HB   GLN  36           HB1      GLN  36  69.471   3.654 -11.312
  337   1HG   GLN  36           HG2      GLN  36  69.768   5.438  -9.428
  338   2HG   GLN  36           HG1      GLN  36  71.484   5.065  -9.572
  339   1HE2  GLN  36          HE22      GLN  36  71.085   7.781 -11.973
  340   2HE2  GLN  36          HE21      GLN  36  71.264   7.539 -10.303
  341    H    GLN  37           HN       GLN  37  67.301   2.703 -10.362
  342    HA   GLN  37           HA       GLN  37  66.011   4.922  -9.085
  343   1HB   GLN  37           HB2      GLN  37  65.195   3.860 -11.202
  344   2HB   GLN  37           HB1      GLN  37  64.707   2.449 -10.264
  345   1HG   GLN  37           HG2      GLN  37  62.739   3.482  -9.869
  346   2HG   GLN  37           HG1      GLN  37  63.613   4.652  -8.885
  347   1HE2  GLN  37          HE22      GLN  37  63.957   6.859 -11.883
  348   2HE2  GLN  37          HE21      GLN  37  65.047   6.080 -10.841
  349    H    ILE  38           HN       ILE  38  66.549   1.565  -8.138
  350    HA   ILE  38           HA       ILE  38  64.557   1.575  -6.036
  351    HB   ILE  38           HB       ILE  38  66.930  -0.216  -6.611
  352   1HG1  ILE  38          HG12      ILE  38  64.894  -0.514  -7.962
  353   2HG1  ILE  38          HG11      ILE  38  65.127  -1.897  -6.895
  354   1HG2  ILE  38          HG22      ILE  38  65.135  -0.205  -4.158
  355   2HG2  ILE  38          HG21      ILE  38  65.976  -1.659  -4.695
  356   3HG2  ILE  38          HG23      ILE  38  66.898  -0.236  -4.207
  357   1HD1  ILE  38          HD13      ILE  38  63.604  -0.367  -5.271
  358   2HD1  ILE  38          HD12      ILE  38  63.024   0.219  -6.827
  359   3HD1  ILE  38          HD11      ILE  38  62.902  -1.494  -6.430
  360    H    THR  39           HN       THR  39  67.904   2.551  -6.332
  361    HA   THR  39           HA       THR  39  68.407   2.994  -3.521
  362    HB   THR  39           HB       THR  39  69.578   4.481  -5.900
  363    HG1  THR  39           HG1      THR  39  71.252   2.911  -5.656
  364   1HG2  THR  39          HG21      THR  39  69.863   5.411  -3.522
  365   2HG2  THR  39          HG23      THR  39  70.844   3.979  -3.207
  366   3HG2  THR  39          HG22      THR  39  71.338   5.129  -4.448
  367    H    HIS  40           HN       HIS  40  67.036   4.896  -6.140
  368    HA   HIS  40           HA       HIS  40  66.614   7.319  -4.590
  369   1HB   HIS  40           HB2      HIS  40  66.761   7.336  -7.063
  370   2HB   HIS  40           HB1      HIS  40  65.313   6.336  -7.154
  371    HD1  HIS  40           HD1      HIS  40  65.822   9.327  -4.862
  372    HD2  HIS  40           HD2      HIS  40  63.513   8.216  -8.149
  373    HE1  HIS  40           HE1      HIS  40  64.130  11.180  -5.210
  374    H    ILE  41           HN       ILE  41  64.940   4.286  -4.959
  375    HA   ILE  41           HA       ILE  41  62.344   5.214  -4.105
  376    HB   ILE  41           HB       ILE  41  63.630   2.672  -4.792
  377   1HG1  ILE  41          HG12      ILE  41  60.893   2.343  -5.048
  378   2HG1  ILE  41          HG11      ILE  41  61.083   4.087  -5.186
  379   1HG2  ILE  41          HG23      ILE  41  61.634   2.644  -2.520
  380   2HG2  ILE  41          HG22      ILE  41  62.022   1.233  -3.504
  381   3HG2  ILE  41          HG21      ILE  41  63.270   1.984  -2.511
  382   1HD1  ILE  41          HD13      ILE  41  62.843   2.198  -6.750
  383   2HD1  ILE  41          HD12      ILE  41  61.265   2.688  -7.358
  384   3HD1  ILE  41          HD11      ILE  41  62.513   3.899  -7.068
  385    H    ALA  42           HN       ALA  42  65.153   3.757  -2.476
  386    HA   ALA  42           HA       ALA  42  64.067   3.662   0.139
  387   1HB   ALA  42           HB1      ALA  42  66.752   3.504  -1.069
  388   2HB   ALA  42           HB3      ALA  42  66.731   4.079   0.598
  389   3HB   ALA  42           HB2      ALA  42  66.030   2.512   0.197
  390    H    ASN  43           HN       ASN  43  66.156   6.141  -1.338
  391    HA   ASN  43           HA       ASN  43  65.921   7.986   0.842
  392   1HB   ASN  43           HB2      ASN  43  66.680   8.224  -2.059
  393   2HB   ASN  43           HB1      ASN  43  66.437   9.684  -1.095
  394   1HD2  ASN  43          HD22      ASN  43  69.875   7.673  -0.704
  395   2HD2  ASN  43          HD21      ASN  43  68.772   7.398  -1.965
  396    H    GLN  44           HN       GLN  44  63.746   7.002  -1.661
  397    HA   GLN  44           HA       GLN  44  62.139   9.398  -1.695
  398   1HB   GLN  44           HB2      GLN  44  62.089   6.751  -2.953
  399   2HB   GLN  44           HB1      GLN  44  60.498   7.441  -2.662
  400   1HG   GLN  44           HG2      GLN  44  62.775   8.817  -4.130
  401   2HG   GLN  44           HG1      GLN  44  61.382   8.058  -4.899
  402   1HE2  GLN  44          HE22      GLN  44  59.098  10.615  -3.614
  403   2HE2  GLN  44          HE21      GLN  44  59.173   8.927  -3.776
  404    H    LEU  45           HN       LEU  45  62.110   6.444   0.250
  405    HA   LEU  45           HA       LEU  45  59.832   7.659   1.741
  406   1HB   LEU  45           HB2      LEU  45  58.702   5.602   2.007
  407   2HB   LEU  45           HB1      LEU  45  59.181   5.641   0.318
  408    HG   LEU  45           HG       LEU  45  60.877   4.270   2.398
  409   1HD1  LEU  45          HD12      LEU  45  58.279   3.535   1.926
  410   2HD1  LEU  45          HD11      LEU  45  59.128   2.618   0.681
  411   3HD1  LEU  45          HD13      LEU  45  59.557   2.414   2.376
  412   1HD2  LEU  45          HD22      LEU  45  60.709   4.488  -0.568
  413   2HD2  LEU  45          HD21      LEU  45  62.129   4.405   0.472
  414   3HD2  LEU  45          HD23      LEU  45  61.218   2.941   0.105
  415    H    GLY  46           HN       GLY  46  62.887   7.445   2.141
  416   1HA   GLY  46           HA2      GLY  46  64.359   7.204   3.944
  417   2HA   GLY  46           HA1      GLY  46  62.964   7.660   4.909
  418    H    LEU  47           HN       LEU  47  62.993   4.628   3.096
  419    HA   LEU  47           HA       LEU  47  63.000   3.217   5.723
  420   1HB   LEU  47           HB2      LEU  47  61.618   1.597   4.858
  421   2HB   LEU  47           HB1      LEU  47  61.185   2.885   3.751
  422    HG   LEU  47           HG       LEU  47  63.163   0.658   3.246
  423   1HD1  LEU  47          HD11      LEU  47  60.482   0.489   3.080
  424   2HD1  LEU  47          HD13      LEU  47  60.823   1.166   1.488
  425   3HD1  LEU  47          HD12      LEU  47  61.554  -0.363   1.969
  426   1HD2  LEU  47          HD23      LEU  47  62.768   3.240   1.934
  427   2HD2  LEU  47          HD22      LEU  47  64.142   2.152   1.867
  428   3HD2  LEU  47          HD21      LEU  47  62.744   1.876   0.832
  429    H    GLU  48           HN       GLU  48  63.983   0.853   5.417
  430    HA   GLU  48           HA       GLU  48  66.779   1.280   4.559
  431   1HB   GLU  48           HB2      GLU  48  65.955   0.133   6.785
  432   2HB   GLU  48           HB1      GLU  48  65.745  -1.280   5.750
  433   1HG   GLU  48           HG2      GLU  48  68.125  -0.972   4.976
  434   2HG   GLU  48           HG1      GLU  48  68.301   0.282   6.203
  435    H    LYS  49           HN       LYS  49  67.736  -0.009   2.940
  436    HA   LYS  49           HA       LYS  49  66.138  -0.788   0.733
  437   1HB   LYS  49           HB2      LYS  49  68.720  -0.369   0.910
  438   2HB   LYS  49           HB1      LYS  49  68.790  -2.098   1.249
  439   1HG   LYS  49           HG2      LYS  49  67.084  -2.006  -0.919
  440   2HG   LYS  49           HG1      LYS  49  68.218  -0.705  -1.284
  441   1HD   LYS  49           HD2      LYS  49  69.950  -2.140  -1.631
  442   2HD   LYS  49           HD1      LYS  49  69.491  -3.173  -0.278
  443   1HE   LYS  49           HE2      LYS  49  68.188  -4.530  -1.579
  444   2HE   LYS  49           HE1      LYS  49  67.649  -3.201  -2.605
  445   1HZ   LYS  49           HZ3      LYS  49  70.102  -3.215  -3.383
  446   2HZ   LYS  49           HZ2      LYS  49  70.111  -4.802  -2.775
  447   3HZ   LYS  49           HZ1      LYS  49  69.024  -4.366  -4.006
  448    H    ASP  50           HN       ASP  50  66.840  -2.502   3.670
  449    HA   ASP  50           HA       ASP  50  66.430  -5.168   2.651
  450   1HB   ASP  50           HB2      ASP  50  67.545  -4.409   4.874
  451   2HB   ASP  50           HB1      ASP  50  65.898  -4.332   5.498
  452    H    VAL  51           HN       VAL  51  64.249  -2.719   4.109
  453    HA   VAL  51           HA       VAL  51  61.996  -4.608   3.985
  454    HB   VAL  51           HB       VAL  51  62.095  -2.921   5.788
  455   1HG1  VAL  51          HG12      VAL  51  62.574  -1.157   3.513
  456   2HG1  VAL  51          HG11      VAL  51  61.296  -0.546   4.561
  457   3HG1  VAL  51          HG13      VAL  51  62.893  -0.886   5.224
  458   1HG2  VAL  51          HG22      VAL  51  59.828  -2.576   3.799
  459   2HG2  VAL  51          HG21      VAL  51  59.893  -3.722   5.137
  460   3HG2  VAL  51          HG23      VAL  51  59.779  -1.992   5.462
  461    H    VAL  52           HN       VAL  52  63.490  -2.241   1.923
  462    HA   VAL  52           HA       VAL  52  61.144  -1.881   0.228
  463    HB   VAL  52           HB       VAL  52  63.334  -0.344   0.614
  464   1HG1  VAL  52          HG11      VAL  52  64.673  -2.200  -0.677
  465   2HG1  VAL  52          HG13      VAL  52  63.986  -1.418  -2.102
  466   3HG1  VAL  52          HG12      VAL  52  64.996  -0.495  -0.990
  467   1HG2  VAL  52          HG23      VAL  52  61.069  -0.176  -0.838
  468   2HG2  VAL  52          HG22      VAL  52  62.342   1.041  -0.903
  469   3HG2  VAL  52          HG21      VAL  52  62.255  -0.207  -2.144
  470    NH1  ARG  53           NH1      ARG  53  66.434  -7.875   1.552
  471    NH2  ARG  53           NH2      ARG  53  65.210  -9.766   1.371
  472    H    ARG  53           HN       ARG  53  63.851  -4.081   0.427
  473    HA   ARG  53           HA       ARG  53  63.536  -5.141  -2.276
  474   1HB   ARG  53           HB2      ARG  53  65.683  -5.197  -0.900
  475   2HB   ARG  53           HB1      ARG  53  64.923  -6.456   0.074
  476   1HG   ARG  53           HG2      ARG  53  64.768  -6.881  -2.852
  477   2HG   ARG  53           HG1      ARG  53  66.394  -6.952  -2.174
  478   1HD   ARG  53           HD2      ARG  53  64.111  -8.447  -0.890
  479   2HD   ARG  53           HD1      ARG  53  65.018  -9.146  -2.231
  480    HE   ARG  53           HE       ARG  53  67.016  -9.119  -0.818
  481   1HH1  ARG  53          HH11      ARG  53  66.986  -7.157   1.128
  482   2HH1  ARG  53          HH12      ARG  53  66.270  -7.863   2.538
  483   1HH2  ARG  53          HH21      ARG  53  64.823 -10.498   0.808
  484   2HH2  ARG  53          HH22      ARG  53  65.045  -9.755   2.357
  485    H    VAL  54           HN       VAL  54  62.685  -6.198   1.021
  486    HA   VAL  54           HA       VAL  54  61.334  -8.608   0.129
  487    HB   VAL  54           HB       VAL  54  61.015  -7.085   2.736
  488   1HG1  VAL  54          HG12      VAL  54  59.287  -8.838   2.173
  489   2HG1  VAL  54          HG11      VAL  54  60.591 -10.024   2.127
  490   3HG1  VAL  54          HG13      VAL  54  60.217  -9.182   3.631
  491   1HG2  VAL  54          HG23      VAL  54  63.386  -7.724   2.138
  492   2HG2  VAL  54          HG22      VAL  54  62.783  -8.490   3.607
  493   3HG2  VAL  54          HG21      VAL  54  62.861  -9.406   2.103
  494    CH2  TRP  55           CH2      TRP  55  55.860  -1.029  -3.493
  495    H    TRP  55           HN       TRP  55  60.404  -5.258   0.535
  496    HA   TRP  55           HA       TRP  55  57.535  -5.793   0.477
  497   1HB   TRP  55           HB2      TRP  55  58.291  -3.782   1.610
  498   2HB   TRP  55           HB1      TRP  55  59.159  -3.242   0.177
  499    HD1  TRP  55           HD1      TRP  55  55.699  -3.278   1.751
  500    HE1  TRP  55           HE1      TRP  55  54.105  -1.948   0.267
  501    HE3  TRP  55           HE3      TRP  55  58.645  -2.595  -2.373
  502    HZ2  TRP  55           HZ2      TRP  55  54.031  -0.809  -2.378
  503    HZ3  TRP  55           HZ3      TRP  55  57.798  -1.392  -4.352
  504    HH2  TRP  55           HH2      TRP  55  55.493  -0.509  -4.361
  505    H    PHE  56           HN       PHE  56  60.031  -4.937  -1.920
  506    HA   PHE  56           HA       PHE  56  57.968  -4.775  -4.016
  507   1HB   PHE  56           HB2      PHE  56  60.137  -3.348  -3.954
  508   2HB   PHE  56           HB1      PHE  56  60.927  -4.797  -4.581
  509    HD1  PHE  56           HD1      PHE  56  57.581  -3.212  -5.200
  510    HD2  PHE  56           HD2      PHE  56  61.254  -4.623  -6.908
  511    HE1  PHE  56           HE1      PHE  56  56.712  -2.711  -7.452
  512    HE2  PHE  56           HE2      PHE  56  60.379  -4.123  -9.176
  513    HZ   PHE  56           HZ       PHE  56  58.097  -3.170  -9.439
  514    H    CYS  57           HN       CYS  57  59.810  -7.248  -2.548
  515    HA   CYS  57           HA       CYS  57  60.177  -8.962  -4.839
  516   1HB   CYS  57           HB2      CYS  57  61.271  -9.219  -2.534
  517   2HB   CYS  57           HB1      CYS  57  59.726  -9.863  -1.979
  518    HG   CYS  57           HG       CYS  57  61.133 -11.229  -4.404
  519    H    ASN  58           HN       ASN  58  57.606  -8.477  -2.467
  520    HA   ASN  58           HA       ASN  58  55.891 -10.541  -3.637
  521   1HB   ASN  58           HB2      ASN  58  55.573  -8.445  -1.497
  522   2HB   ASN  58           HB1      ASN  58  54.147  -9.252  -2.151
  523   1HD2  ASN  58          HD22      ASN  58  55.447 -12.537  -1.014
  524   2HD2  ASN  58          HD21      ASN  58  54.920 -11.864  -2.480
  525    NH1  ARG  59           NH1      ARG  59  51.933  -5.905  -1.919
  526    NH2  ARG  59           NH2      ARG  59  53.998  -6.615  -1.338
  527    H    ARG  59           HN       ARG  59  56.251  -7.020  -3.771
  528    HA   ARG  59           HA       ARG  59  53.937  -6.539  -5.443
  529   1HB   ARG  59           HB2      ARG  59  55.868  -4.953  -4.147
  530   2HB   ARG  59           HB1      ARG  59  56.095  -4.622  -5.863
  531   1HG   ARG  59           HG2      ARG  59  54.472  -3.077  -4.846
  532   2HG   ARG  59           HG1      ARG  59  53.740  -4.063  -6.108
  533   1HD   ARG  59           HD2      ARG  59  52.383  -3.799  -3.950
  534   2HD   ARG  59           HD1      ARG  59  52.619  -5.450  -4.511
  535    HE   ARG  59           HE       ARG  59  54.599  -4.472  -2.556
  536   1HH1  ARG  59          HH11      ARG  59  51.343  -5.289  -2.442
  537   2HH1  ARG  59          HH12      ARG  59  51.528  -6.589  -1.313
  538   1HH2  ARG  59          HH21      ARG  59  54.993  -6.543  -1.416
  539   2HH2  ARG  59          HH22      ARG  59  53.591  -7.298  -0.733
  540    NH1  ARG  60           NH1      ARG  60  63.527  -8.104  -6.711
  541    NH2  ARG  60           NH2      ARG  60  63.867  -6.113  -7.724
  542    H    ARG  60           HN       ARG  60  56.975  -8.000  -6.103
  543    HA   ARG  60           HA       ARG  60  57.040  -7.187  -8.929
  544   1HB   ARG  60           HB2      ARG  60  58.734  -8.941  -7.164
  545   2HB   ARG  60           HB1      ARG  60  58.889  -9.043  -8.918
  546   1HG   ARG  60           HG2      ARG  60  59.770  -6.918  -9.106
  547   2HG   ARG  60           HG1      ARG  60  58.900  -6.320  -7.694
  548   1HD   ARG  60           HD2      ARG  60  60.742  -6.633  -6.440
  549   2HD   ARG  60           HD1      ARG  60  60.683  -8.359  -6.789
  550    HE   ARG  60           HE       ARG  60  61.863  -7.225  -9.045
  551   1HH1  ARG  60          HH11      ARG  60  62.948  -8.901  -6.541
  552   2HH1  ARG  60          HH12      ARG  60  64.424  -8.035  -6.275
  553   1HH2  ARG  60          HH21      ARG  60  63.550  -5.384  -8.330
  554   2HH2  ARG  60          HH22      ARG  60  64.764  -6.045  -7.287
  555    H    GLN  61           HN       GLN  61  56.429 -10.149  -7.041
  556    HA   GLN  61           HA       GLN  61  55.326 -11.420  -9.499
  557   1HB   GLN  61           HB2      GLN  61  55.372 -13.522  -8.120
  558   2HB   GLN  61           HB1      GLN  61  56.964 -12.795  -8.338
  559   1HG   GLN  61           HG2      GLN  61  56.920 -11.840  -6.134
  560   2HG   GLN  61           HG1      GLN  61  55.220 -12.256  -5.924
  561   1HE2  GLN  61          HE22      GLN  61  57.481 -14.847  -4.295
  562   2HE2  GLN  61          HE21      GLN  61  57.450 -13.152  -4.198
  563    H    LYS  62           HN       LYS  62  53.686  -9.518  -8.783
  564    HA   LYS  62           HA       LYS  62  51.670 -10.536  -6.881
  565   1HB   LYS  62           HB2      LYS  62  50.542  -8.372  -7.360
  566   2HB   LYS  62           HB1      LYS  62  52.205  -8.158  -6.816
  567   1HG   LYS  62           HG2      LYS  62  52.813  -7.182  -8.758
  568   2HG   LYS  62           HG1      LYS  62  52.071  -8.464  -9.715
  569   1HD   LYS  62           HD2      LYS  62  49.989  -7.389  -9.784
  570   2HD   LYS  62           HD1      LYS  62  50.345  -6.399  -8.370
  571   1HE   LYS  62           HE2      LYS  62  51.153  -4.756  -9.673
  572   2HE   LYS  62           HE1      LYS  62  52.298  -5.864 -10.428
  573   1HZ   LYS  62           HZ3      LYS  62  49.441  -5.730 -11.200
  574   2HZ   LYS  62           HZ2      LYS  62  50.645  -4.802 -11.957
  575   3HZ   LYS  62           HZ1      LYS  62  50.707  -6.498 -12.026
  576    H    GLY  63           HN       GLY  63  52.346 -11.461  -9.894
  577   1HA   GLY  63           HA2      GLY  63  49.468 -11.740 -10.619
  578   2HA   GLY  63           HA1      GLY  63  50.662 -11.307 -11.843
  579    H    LYS  64           HN       LYS  64  51.612 -13.507  -9.318
  580    HA   LYS  64           HA       LYS  64  51.437 -15.768 -11.263
  581   1HB   LYS  64           HB2      LYS  64  53.596 -15.051  -9.270
  582   2HB   LYS  64           HB1      LYS  64  53.481 -16.648 -10.011
  583   1HG   LYS  64           HG2      LYS  64  53.366 -14.306 -11.847
  584   2HG   LYS  64           HG1      LYS  64  54.927 -14.660 -11.104
  585   1HD   LYS  64           HD2      LYS  64  53.277 -16.802 -12.455
  586   2HD   LYS  64           HD1      LYS  64  54.441 -15.817 -13.342
  587   1HE   LYS  64           HE2      LYS  64  55.221 -17.278 -10.818
  588   2HE   LYS  64           HE1      LYS  64  55.280 -18.069 -12.392
  589   1HZ   LYS  64           HZ1      LYS  64  56.526 -15.700 -12.847
  590   2HZ   LYS  64           HZ3      LYS  64  57.030 -16.081 -11.272
  591   3HZ   LYS  64           HZ2      LYS  64  57.303 -17.178 -12.540
  592    NH1  ARG  65           NH2      ARG  65  53.572 -20.704  -9.437
  593    NH2  ARG  65           NH1      ARG  65  54.106 -22.554  -8.254
  594    H    ARG  65           HN       ARG  65  51.932 -15.199  -7.779
  595    HA   ARG  65           HA       ARG  65  49.722 -17.108  -7.240
  596   1HB   ARG  65           HB2      ARG  65  52.564 -17.308  -6.254
  597   2HB   ARG  65           HB1      ARG  65  51.235 -17.996  -5.321
  598   1HG   ARG  65           HG2      ARG  65  50.555 -19.363  -7.229
  599   2HG   ARG  65           HG1      ARG  65  51.809 -18.631  -8.229
  600   1HD   ARG  65           HD2      ARG  65  53.552 -19.558  -6.804
  601   2HD   ARG  65           HD1      ARG  65  52.343 -20.193  -5.687
  602    HE   ARG  65           HE       ARG  65  51.677 -21.794  -7.429
  603   1HH1  ARG  65          HH21      ARG  65  53.012 -19.884  -9.557
  604   2HH1  ARG  65          HH22      ARG  65  54.284 -20.925 -10.104
  605   1HH2  ARG  65          HH11      ARG  65  53.956 -23.152  -7.467
  606   2HH2  ARG  65          HH12      ARG  65  54.819 -22.774  -8.920
  607    H    SER  66           HN       SER  66  48.601 -15.083  -6.703
  608    HA   SER  66           HA       SER  66  49.151 -14.262  -3.907
  609   1HB   SER  66           HB2      SER  66  49.175 -12.449  -6.307
  610   2HB   SER  66           HB1      SER  66  48.646 -11.832  -4.744
  611    HG   SER  66           HG       SER  66  50.640 -11.883  -4.076
  612    H    SER  67           HN       SER  67  47.270 -13.219  -2.919
  613    HA   SER  67           HA       SER  67  44.760 -14.333  -3.935
  614   1HB   SER  67           HB2      SER  67  43.837 -13.134  -1.859
  615   2HB   SER  67           HB1      SER  67  45.005 -14.420  -1.571
  616    HG   SER  67           HG       SER  67  45.162 -11.778  -1.011
   
  Start of MODEL          10
 Raw file had  616 H/Q atoms
  Start of MODEL   10
    1   1H    MET   1           HT3      MET   1  57.840  21.440  24.177
    2   2H    MET   1           HT2      MET   1  58.974  21.183  25.416
    3   3H    MET   1           HT1      MET   1  58.324  22.732  25.163
    4    HA   MET   1           HA       MET   1  59.465  23.006  23.133
    5   1HB   MET   1           HB2      MET   1  60.735  22.834  25.535
    6   2HB   MET   1           HB1      MET   1  61.643  21.637  24.612
    7   1HG   MET   1           HG2      MET   1  62.208  23.254  22.921
    8   2HG   MET   1           HG1      MET   1  61.092  24.439  23.602
    9   1HE   MET   1           HE1      MET   1  63.646  24.909  22.683
   10   2HE   MET   1           HE3      MET   1  63.829  26.248  23.825
   11   3HE   MET   1           HE2      MET   1  65.048  24.978  23.749
   12    H    GLU   2           HN       GLU   2  60.483  22.092  21.308
   13    HA   GLU   2           HA       GLU   2  60.952  20.423  19.731
   14   1HB   GLU   2           HB2      GLU   2  61.448  18.685  22.167
   15   2HB   GLU   2           HB1      GLU   2  62.056  18.411  20.533
   16   1HG   GLU   2           HG2      GLU   2  62.948  20.949  20.978
   17   2HG   GLU   2           HG1      GLU   2  63.011  20.291  22.614
   18    H    THR   3           HN       THR   3  58.297  20.804  20.124
   19    HA   THR   3           HA       THR   3  57.176  18.029  20.177
   20    HB   THR   3           HB       THR   3  56.312  19.293  22.069
   21    HG1  THR   3           HG1      THR   3  54.835  18.013  20.858
   22   1HG2  THR   3          HG21      THR   3  56.027  21.416  19.986
   23   2HG2  THR   3          HG23      THR   3  54.847  21.379  21.295
   24   3HG2  THR   3          HG22      THR   3  56.564  21.552  21.660
   25    H    LEU   4           HN       LEU   4  55.103  17.906  18.815
   26    HA   LEU   4           HA       LEU   4  54.951  19.832  16.589
   27   1HB   LEU   4           HB2      LEU   4  55.225  18.034  14.875
   28   2HB   LEU   4           HB1      LEU   4  56.701  18.333  15.791
   29    HG   LEU   4           HG       LEU   4  55.674  16.436  17.366
   30   1HD1  LEU   4          HD11      LEU   4  54.209  16.242  14.780
   31   2HD1  LEU   4          HD13      LEU   4  54.790  14.731  15.479
   32   3HD1  LEU   4          HD12      LEU   4  53.699  15.766  16.400
   33   1HD2  LEU   4          HD21      LEU   4  57.857  16.418  16.127
   34   2HD2  LEU   4          HD23      LEU   4  57.082  14.836  16.192
   35   3HD2  LEU   4          HD22      LEU   4  57.003  15.796  14.715
   36    H    VAL   5           HN       VAL   5  53.170  18.998  14.992
   37    HA   VAL   5           HA       VAL   5  51.097  17.428  16.443
   38    HB   VAL   5           HB       VAL   5  50.557  20.049  15.023
   39   1HG1  VAL   5          HG11      VAL   5  48.821  18.216  16.707
   40   2HG1  VAL   5          HG13      VAL   5  48.326  19.799  16.109
   41   3HG1  VAL   5          HG12      VAL   5  48.668  18.495  14.972
   42   1HG2  VAL   5          HG21      VAL   5  51.122  19.357  17.884
   43   2HG2  VAL   5          HG23      VAL   5  51.582  20.794  16.969
   44   3HG2  VAL   5          HG22      VAL   5  49.925  20.607  17.543
   45    H    GLN   6           HN       GLN   6  51.585  19.181  13.372
   46    HA   GLN   6           HA       GLN   6  50.732  16.690  11.950
   47   1HB   GLN   6           HB2      GLN   6  49.754  18.204  10.209
   48   2HB   GLN   6           HB1      GLN   6  48.957  18.347  11.776
   49   1HG   GLN   6           HG2      GLN   6  49.895  20.433  12.217
   50   2HG   GLN   6           HG1      GLN   6  51.269  20.154  11.145
   51   1HE2  GLN   6          HE22      GLN   6  47.961  21.948   9.694
   52   2HE2  GLN   6          HE21      GLN   6  48.148  21.591  11.343
   53    H    ALA   7           HN       ALA   7  53.425  17.168  12.508
   54    HA   ALA   7           HA       ALA   7  54.627  18.438  10.154
   55   1HB   ALA   7           HB3      ALA   7  55.482  18.408  12.666
   56   2HB   ALA   7           HB2      ALA   7  56.243  16.905  12.144
   57   3HB   ALA   7           HB1      ALA   7  56.623  18.418  11.321
   58    NH1  ARG   8           NH2      ARG   8  59.710  11.764   9.035
   59    NH2  ARG   8           NH1      ARG   8  59.680  13.680  10.235
   60    H    ARG   8           HN       ARG   8  53.113  15.634  10.316
   61    HA   ARG   8           HA       ARG   8  54.753  14.406   8.267
   62   1HB   ARG   8           HB2      ARG   8  55.814  13.689  10.471
   63   2HB   ARG   8           HB1      ARG   8  54.322  12.811  10.802
   64   1HG   ARG   8           HG2      ARG   8  54.817  11.167   9.314
   65   2HG   ARG   8           HG1      ARG   8  55.418  12.310   8.112
   66   1HD   ARG   8           HD2      ARG   8  56.927  11.343  10.559
   67   2HD   ARG   8           HD1      ARG   8  57.247  10.872   8.889
   68    HE   ARG   8           HE       ARG   8  57.367  13.726   9.103
   69   1HH1  ARG   8          HH21      ARG   8  59.228  11.068   8.504
   70   2HH1  ARG   8          HH22      ARG   8  60.697  11.690   9.179
   71   1HH2  ARG   8          HH11      ARG   8  59.176  14.451  10.623
   72   2HH2  ARG   8          HH12      ARG   8  60.667  13.604  10.379
   73    H    LYS   9           HN       LYS   9  52.198  15.361   8.100
   74    HA   LYS   9           HA       LYS   9  50.703  12.938   7.446
   75   1HB   LYS   9           HB2      LYS   9  50.237  13.729   9.928
   76   2HB   LYS   9           HB1      LYS   9  49.228  14.934   9.125
   77   1HG   LYS   9           HG2      LYS   9  48.249  12.925   7.806
   78   2HG   LYS   9           HG1      LYS   9  48.967  11.932   9.075
   79   1HD   LYS   9           HD2      LYS   9  46.809  12.339   9.903
   80   2HD   LYS   9           HD1      LYS   9  47.772  13.578  10.708
   81   1HE   LYS   9           HE2      LYS   9  45.764  14.616   9.810
   82   2HE   LYS   9           HE1      LYS   9  47.156  15.175   8.882
   83   1HZ   LYS   9           HZ1      LYS   9  45.689  12.789   7.990
   84   2HZ   LYS   9           HZ3      LYS   9  45.045  14.324   7.669
   85   3HZ   LYS   9           HZ2      LYS   9  46.582  13.909   7.077
   86    NH1  ARG  10           NH1      ARG  10  51.992  18.883   6.890
   87    NH2  ARG  10           NH2      ARG  10  53.363  20.645   6.541
   88    H    ARG  10           HN       ARG  10  51.871  15.166   5.978
   89    HA   ARG  10           HA       ARG  10  49.704  16.939   5.201
   90   1HB   ARG  10           HB2      ARG  10  52.261  17.397   5.111
   91   2HB   ARG  10           HB1      ARG  10  52.210  16.502   3.593
   92   1HG   ARG  10           HG2      ARG  10  51.033  18.139   2.505
   93   2HG   ARG  10           HG1      ARG  10  50.128  18.593   3.950
   94   1HD   ARG  10           HD2      ARG  10  53.072  19.146   3.852
   95   2HD   ARG  10           HD1      ARG  10  51.973  20.213   2.979
   96    HE   ARG  10           HE       ARG  10  50.987  20.861   5.091
   97   1HH1  ARG  10          HH11      ARG  10  51.216  18.319   6.605
   98   2HH1  ARG  10          HH12      ARG  10  52.491  18.659   7.725
   99   1HH2  ARG  10          HH21      ARG  10  53.640  21.430   5.987
  100   2HH2  ARG  10          HH22      ARG  10  53.860  20.426   7.381
  101    H    LYS  11           HN       LYS  11  51.608  14.577   3.294
  102    HA   LYS  11           HA       LYS  11  49.139  13.560   2.092
  103   1HB   LYS  11           HB2      LYS  11  50.700  15.580   0.805
  104   2HB   LYS  11           HB1      LYS  11  50.916  14.084  -0.101
  105   1HG   LYS  11           HG2      LYS  11  48.741  14.034  -0.795
  106   2HG   LYS  11           HG1      LYS  11  48.133  14.662   0.736
  107   1HD   LYS  11           HD2      LYS  11  48.068  16.772  -0.061
  108   2HD   LYS  11           HD1      LYS  11  49.729  16.670  -0.642
  109   1HE   LYS  11           HE2      LYS  11  49.043  15.707  -2.720
  110   2HE   LYS  11           HE1      LYS  11  47.412  15.406  -2.122
  111   1HZ   LYS  11           HZ3      LYS  11  48.449  18.155  -2.143
  112   2HZ   LYS  11           HZ2      LYS  11  47.904  17.469  -3.598
  113   3HZ   LYS  11           HZ1      LYS  11  46.848  17.606  -2.274
  114    NH1  ARG  12           NH2      ARG  12  55.737  13.617  -0.625
  115    NH2  ARG  12           NH1      ARG  12  56.656  14.511   1.237
  116    H    ARG  12           HN       ARG  12  50.998  12.310   3.786
  117    HA   ARG  12           HA       ARG  12  52.036  10.210   1.950
  118   1HB   ARG  12           HB2      ARG  12  53.591  11.834   3.917
  119   2HB   ARG  12           HB1      ARG  12  53.984  10.120   3.777
  120   1HG   ARG  12           HG2      ARG  12  54.523  10.318   1.474
  121   2HG   ARG  12           HG1      ARG  12  53.745  11.896   1.347
  122   1HD   ARG  12           HD2      ARG  12  55.453  12.835   2.893
  123   2HD   ARG  12           HD1      ARG  12  56.255  11.264   2.926
  124    HE   ARG  12           HE       ARG  12  56.941  11.606   0.640
  125   1HH1  ARG  12          HH21      ARG  12  55.429  12.818  -1.141
  126   2HH1  ARG  12          HH22      ARG  12  55.646  14.532  -1.019
  127   1HH2  ARG  12          HH11      ARG  12  57.053  14.395   2.148
  128   2HH2  ARG  12          HH12      ARG  12  56.565  15.426   0.844
  129    H    THR  13           HN       THR  13  49.685  10.452   3.756
  130    HA   THR  13           HA       THR  13  50.252   8.747   6.060
  131    HB   THR  13           HB       THR  13  47.636   8.721   6.079
  132    HG1  THR  13           HG1      THR  13  46.691   9.910   4.627
  133   1HG2  THR  13          HG23      THR  13  49.458  10.278   7.291
  134   2HG2  THR  13          HG22      THR  13  48.652  11.508   6.319
  135   3HG2  THR  13          HG21      THR  13  47.725  10.548   7.470
  136    H    SER  14           HN       SER  14  49.136   8.359   2.760
  137    HA   SER  14           HA       SER  14  48.808   5.425   3.244
  138   1HB   SER  14           HB2      SER  14  47.742   6.879   0.829
  139   2HB   SER  14           HB1      SER  14  47.206   5.349   1.517
  140    HG   SER  14           HG       SER  14  46.383   6.500   3.281
  141    H    ILE  15           HN       ILE  15  48.991   4.606   0.575
  142    HA   ILE  15           HA       ILE  15  51.885   4.762   0.149
  143    HB   ILE  15           HB       ILE  15  49.679   3.388  -1.422
  144   1HG1  ILE  15          HG12      ILE  15  50.017   2.540   0.883
  145   2HG1  ILE  15          HG11      ILE  15  50.523   1.355  -0.319
  146   1HG2  ILE  15          HG22      ILE  15  52.700   3.243  -1.667
  147   2HG2  ILE  15          HG21      ILE  15  51.602   2.076  -2.403
  148   3HG2  ILE  15          HG23      ILE  15  51.559   3.766  -2.906
  149   1HD1  ILE  15          HD11      ILE  15  52.786   2.998   0.220
  150   2HD1  ILE  15          HD13      ILE  15  52.089   2.549   1.777
  151   3HD1  ILE  15          HD12      ILE  15  52.561   1.301   0.626
  152    H    GLU  16           HN       GLU  16  52.400   6.846  -0.518
  153    HA   GLU  16           HA       GLU  16  50.935   8.269  -2.552
  154   1HB   GLU  16           HB2      GLU  16  53.280   8.710  -0.886
  155   2HB   GLU  16           HB1      GLU  16  53.598   9.208  -2.546
  156   1HG   GLU  16           HG2      GLU  16  51.032  10.018  -1.201
  157   2HG   GLU  16           HG1      GLU  16  52.514  10.925  -0.896
  158    H    ASN  17           HN       ASN  17  52.083   8.795  -4.698
  159    HA   ASN  17           HA       ASN  17  52.738   6.295  -5.994
  160   1HB   ASN  17           HB2      ASN  17  53.116   7.745  -8.013
  161   2HB   ASN  17           HB1      ASN  17  51.542   8.000  -7.258
  162   1HD2  ASN  17          HD22      ASN  17  52.242  11.339  -6.293
  163   2HD2  ASN  17          HD21      ASN  17  51.156  10.039  -6.184
  164    NH1  ARG  18           NH2      ARG  18  59.663  14.434  -6.083
  165    NH2  ARG  18           NH1      ARG  18  61.342  13.001  -6.575
  166    H    ARG  18           HN       ARG  18  54.539   9.036  -4.764
  167    HA   ARG  18           HA       ARG  18  57.074   8.136  -5.910
  168   1HB   ARG  18           HB2      ARG  18  56.101  10.426  -4.337
  169   2HB   ARG  18           HB1      ARG  18  57.708   9.886  -3.854
  170   1HG   ARG  18           HG2      ARG  18  58.223   9.866  -6.404
  171   2HG   ARG  18           HG1      ARG  18  56.788  10.883  -6.543
  172   1HD   ARG  18           HD2      ARG  18  57.731  12.560  -5.108
  173   2HD   ARG  18           HD1      ARG  18  59.060  11.499  -4.641
  174    HE   ARG  18           HE       ARG  18  59.077  11.891  -7.488
  175   1HH1  ARG  18          HH21      ARG  18  58.687  14.615  -5.961
  176   2HH1  ARG  18          HH22      ARG  18  60.328  15.168  -5.946
  177   1HH2  ARG  18          HH11      ARG  18  61.652  12.085  -6.831
  178   2HH2  ARG  18          HH12      ARG  18  62.008  13.734  -6.438
  179    H    VAL  19           HN       VAL  19  55.211   7.455  -3.037
  180    HA   VAL  19           HA       VAL  19  57.509   6.522  -1.513
  181    HB   VAL  19           HB       VAL  19  55.039   7.314  -0.721
  182   1HG1  VAL  19          HG11      VAL  19  53.896   5.299  -1.626
  183   2HG1  VAL  19          HG13      VAL  19  54.922   4.279  -0.618
  184   3HG1  VAL  19          HG12      VAL  19  53.773   5.387   0.131
  185   1HG2  VAL  19          HG21      VAL  19  56.861   5.306   0.633
  186   2HG2  VAL  19          HG23      VAL  19  57.009   7.062   0.694
  187   3HG2  VAL  19          HG22      VAL  19  55.635   6.266   1.462
  188    NH1  ARG  20           NH1      ARG  20  50.148   5.148  -6.909
  189    NH2  ARG  20           NH2      ARG  20  49.701   3.183  -5.883
  190    H    ARG  20           HN       ARG  20  54.889   4.983  -3.354
  191    HA   ARG  20           HA       ARG  20  55.779   2.299  -2.887
  192   1HB   ARG  20           HB2      ARG  20  54.372   1.713  -4.837
  193   2HB   ARG  20           HB1      ARG  20  53.523   2.788  -3.734
  194   1HG   ARG  20           HG2      ARG  20  54.114   4.720  -5.164
  195   2HG   ARG  20           HG1      ARG  20  54.943   3.632  -6.276
  196   1HD   ARG  20           HD2      ARG  20  52.881   3.719  -7.305
  197   2HD   ARG  20           HD1      ARG  20  52.609   2.359  -6.217
  198    HE   ARG  20           HE       ARG  20  51.887   4.665  -4.780
  199   1HH1  ARG  20          HH11      ARG  20  50.777   5.901  -7.101
  200   2HH1  ARG  20          HH12      ARG  20  49.233   5.146  -7.312
  201   1HH2  ARG  20          HH21      ARG  20  49.989   2.430  -5.291
  202   2HH2  ARG  20          HH22      ARG  20  48.786   3.181  -6.285
  203    CH2  TRP  21           CH2      TRP  21  54.870  -0.149  -8.142
  204    H    TRP  21           HN       TRP  21  56.534   4.646  -5.436
  205    HA   TRP  21           HA       TRP  21  58.392   2.697  -6.592
  206   1HB   TRP  21           HB2      TRP  21  57.731   5.472  -7.572
  207   2HB   TRP  21           HB1      TRP  21  58.646   4.238  -8.455
  208    HD1  TRP  21           HD1      TRP  21  55.485   5.486  -8.944
  209    HE1  TRP  21           HE1      TRP  21  53.632   3.734  -9.361
  210    HE3  TRP  21           HE3      TRP  21  57.820   1.247  -7.261
  211    HZ2  TRP  21           HZ2      TRP  21  53.196   0.899  -8.976
  212    HZ3  TRP  21           HZ3      TRP  21  56.677  -0.909  -7.262
  213    HH2  TRP  21           HH2      TRP  21  54.381  -1.111  -8.160
  214    H    SER  22           HN       SER  22  58.615   4.435  -3.987
  215    HA   SER  22           HA       SER  22  61.426   5.242  -4.320
  216   1HB   SER  22           HB2      SER  22  59.281   5.784  -2.342
  217   2HB   SER  22           HB1      SER  22  60.856   5.447  -1.629
  218    HG   SER  22           HG       SER  22  61.720   7.131  -2.784
  219    H    LEU  23           HN       LEU  23  59.204   2.930  -2.826
  220    HA   LEU  23           HA       LEU  23  60.986   1.222  -1.406
  221   1HB   LEU  23           HB2      LEU  23  58.612   0.442  -3.130
  222   2HB   LEU  23           HB1      LEU  23  59.353  -0.580  -1.925
  223    HG   LEU  23           HG       LEU  23  58.259   2.080  -1.107
  224   1HD1  LEU  23          HD13      LEU  23  56.679   0.548  -2.612
  225   2HD1  LEU  23          HD12      LEU  23  56.535  -0.388  -1.126
  226   3HD1  LEU  23          HD11      LEU  23  56.047   1.306  -1.152
  227   1HD2  LEU  23          HD21      LEU  23  58.704  -0.654   0.124
  228   2HD2  LEU  23          HD23      LEU  23  59.403   0.885   0.625
  229   3HD2  LEU  23          HD22      LEU  23  57.694   0.559   0.908
  230    H    GLU  24           HN       GLU  24  59.819   1.161  -4.746
  231    HA   GLU  24           HA       GLU  24  61.351  -1.058  -5.634
  232   1HB   GLU  24           HB2      GLU  24  59.414   0.239  -6.796
  233   2HB   GLU  24           HB1      GLU  24  60.703   1.245  -7.454
  234   1HG   GLU  24           HG2      GLU  24  61.785  -1.111  -8.021
  235   2HG   GLU  24           HG1      GLU  24  60.106  -1.646  -7.954
  236    H    THR  25           HN       THR  25  62.205   2.343  -5.296
  237    HA   THR  25           HA       THR  25  64.622   2.254  -6.847
  238    HB   THR  25           HB       THR  25  64.000   3.978  -4.424
  239    HG1  THR  25           HG1      THR  25  63.620   4.478  -7.187
  240   1HG2  THR  25          HG22      THR  25  66.336   3.729  -6.072
  241   2HG2  THR  25          HG21      THR  25  65.579   5.288  -6.404
  242   3HG2  THR  25          HG23      THR  25  66.038   4.864  -4.756
  243    H    MET  26           HN       MET  26  63.813   1.383  -3.540
  244    HA   MET  26           HA       MET  26  66.613   0.877  -2.804
  245   1HB   MET  26           HB2      MET  26  64.437   1.542  -1.346
  246   2HB   MET  26           HB1      MET  26  64.408  -0.209  -1.138
  247   1HG   MET  26           HG2      MET  26  65.758   0.670   0.640
  248   2HG   MET  26           HG1      MET  26  66.866  -0.064  -0.519
  249   1HE   MET  26           HE3      MET  26  65.013   2.863   0.655
  250   2HE   MET  26           HE2      MET  26  65.996   4.295   0.369
  251   3HE   MET  26           HE1      MET  26  65.030   3.622  -0.942
  252    H    PHE  27           HN       PHE  27  63.927  -1.025  -4.067
  253    HA   PHE  27           HA       PHE  27  65.250  -3.575  -3.366
  254   1HB   PHE  27           HB2      PHE  27  62.638  -2.941  -4.774
  255   2HB   PHE  27           HB1      PHE  27  63.273  -4.576  -4.619
  256    HD1  PHE  27           HD2      PHE  27  64.189  -5.081  -2.096
  257    HD2  PHE  27           HD1      PHE  27  61.091  -2.306  -3.169
  258    HE1  PHE  27           HE2      PHE  27  63.256  -5.236   0.196
  259    HE2  PHE  27           HE1      PHE  27  60.157  -2.463  -0.877
  260    HZ   PHE  27           HZ       PHE  27  61.240  -3.927   0.803
  261    H    LEU  28           HN       LEU  28  65.361  -1.372  -5.985
  262    HA   LEU  28           HA       LEU  28  65.921  -3.476  -7.970
  263   1HB   LEU  28           HB2      LEU  28  65.742  -0.468  -8.169
  264   2HB   LEU  28           HB1      LEU  28  66.188  -1.503  -9.528
  265    HG   LEU  28           HG       LEU  28  63.642  -1.811  -7.912
  266   1HD1  LEU  28          HD13      LEU  28  64.301  -0.272 -10.392
  267   2HD1  LEU  28          HD12      LEU  28  62.729  -1.063 -10.285
  268   3HD1  LEU  28          HD11      LEU  28  63.195   0.138  -9.080
  269   1HD2  LEU  28          HD23      LEU  28  64.812  -3.193 -10.321
  270   2HD2  LEU  28          HD22      LEU  28  64.128  -3.909  -8.861
  271   3HD2  LEU  28          HD21      LEU  28  63.068  -3.164 -10.058
  272    H    LYS  29           HN       LYS  29  67.795  -3.399  -5.850
  273    HA   LYS  29           HA       LYS  29  70.235  -2.513  -7.329
  274   1HB   LYS  29           HB2      LYS  29  71.351  -2.188  -5.141
  275   2HB   LYS  29           HB1      LYS  29  69.937  -1.146  -5.286
  276   1HG   LYS  29           HG2      LYS  29  68.653  -3.057  -4.096
  277   2HG   LYS  29           HG1      LYS  29  70.248  -3.673  -3.664
  278   1HD   LYS  29           HD2      LYS  29  70.720  -1.273  -2.812
  279   2HD   LYS  29           HD1      LYS  29  68.970  -1.058  -2.873
  280   1HE   LYS  29           HE2      LYS  29  68.751  -3.148  -1.472
  281   2HE   LYS  29           HE1      LYS  29  70.504  -3.124  -1.275
  282   1HZ   LYS  29           HZ2      LYS  29  68.659  -0.924  -0.519
  283   2HZ   LYS  29           HZ1      LYS  29  69.366  -2.027   0.562
  284   3HZ   LYS  29           HZ3      LYS  29  70.342  -0.936  -0.294
  285    H    CYS  30           HN       CYS  30  68.865  -4.819  -5.022
  286    HA   CYS  30           HA       CYS  30  70.463  -6.962  -6.243
  287   1HB   CYS  30           HB2      CYS  30  70.328  -6.393  -3.263
  288   2HB   CYS  30           HB1      CYS  30  71.002  -7.860  -3.972
  289    HG   CYS  30           HG       CYS  30  72.312  -5.056  -4.067
  290    HA   PRO  31           HA       PRO  31  66.426  -8.806  -5.643
  291   1HB   PRO  31           HB2      PRO  31  67.033 -11.354  -6.428
  292   2HB   PRO  31           HB1      PRO  31  66.870 -10.013  -7.577
  293   1HG   PRO  31           HG2      PRO  31  69.336 -11.389  -6.643
  294   2HG   PRO  31           HG1      PRO  31  69.054 -10.492  -8.143
  295   1HD   PRO  31           HD2      PRO  31  70.410  -9.540  -5.809
  296   2HD   PRO  31           HD1      PRO  31  69.960  -8.590  -7.240
  297    H    LYS  32           HN       LYS  32  68.865  -9.101  -3.507
  298    HA   LYS  32           HA       LYS  32  67.600 -11.352  -2.048
  299   1HB   LYS  32           HB2      LYS  32  69.887 -11.683  -1.021
  300   2HB   LYS  32           HB1      LYS  32  69.809 -12.017  -2.751
  301   1HG   LYS  32           HG2      LYS  32  70.969 -10.076  -3.321
  302   2HG   LYS  32           HG1      LYS  32  70.506  -9.241  -1.841
  303   1HD   LYS  32           HD2      LYS  32  71.925 -11.283  -0.777
  304   2HD   LYS  32           HD1      LYS  32  72.753 -11.122  -2.326
  305   1HE   LYS  32           HE2      LYS  32  72.771  -8.573  -1.787
  306   2HE   LYS  32           HE1      LYS  32  72.456  -9.084  -0.129
  307   1HZ   LYS  32           HZ2      LYS  32  74.420 -10.517  -0.263
  308   2HZ   LYS  32           HZ1      LYS  32  74.741  -9.934  -1.826
  309   3HZ   LYS  32           HZ3      LYS  32  74.814  -8.881  -0.498
  310    HA   PRO  33           HA       PRO  33  67.527  -7.480   0.580
  311   1HB   PRO  33           HB2      PRO  33  64.814  -7.371   0.998
  312   2HB   PRO  33           HB1      PRO  33  65.633  -6.546  -0.339
  313   1HG   PRO  33           HG2      PRO  33  63.962  -9.012  -0.396
  314   2HG   PRO  33           HG1      PRO  33  64.254  -7.823  -1.676
  315   1HD   PRO  33           HD2      PRO  33  65.486 -10.364  -1.475
  316   2HD   PRO  33           HD1      PRO  33  66.008  -9.031  -2.526
  317    H    SER  34           HN       SER  34  67.242  -7.509   2.883
  318    HA   SER  34           HA       SER  34  66.937 -10.201   4.037
  319   1HB   SER  34           HB2      SER  34  67.577  -8.831   6.165
  320   2HB   SER  34           HB1      SER  34  68.810  -9.151   4.948
  321    HG   SER  34           HG       SER  34  68.305  -6.859   5.803
  322    H    LEU  35           HN       LEU  35  65.428 -10.695   5.694
  323    HA   LEU  35           HA       LEU  35  62.847  -9.462   5.479
  324   1HB   LEU  35           HB2      LEU  35  64.133 -11.381   7.393
  325   2HB   LEU  35           HB1      LEU  35  62.603 -10.629   7.853
  326    HG   LEU  35           HG       LEU  35  62.780 -11.684   5.090
  327   1HD1  LEU  35          HD13      LEU  35  62.641 -13.462   7.544
  328   2HD1  LEU  35          HD12      LEU  35  62.210 -13.992   5.917
  329   3HD1  LEU  35          HD11      LEU  35  63.867 -13.505   6.276
  330   1HD2  LEU  35          HD21      LEU  35  60.771 -10.589   6.307
  331   2HD2  LEU  35          HD23      LEU  35  60.464 -12.077   5.412
  332   3HD2  LEU  35          HD22      LEU  35  60.631 -12.122   7.167
  333    H    GLN  36           HN       GLN  36  65.707  -8.739   7.283
  334    HA   GLN  36           HA       GLN  36  64.449  -7.003   9.263
  335   1HB   GLN  36           HB2      GLN  36  67.194  -7.768   8.481
  336   2HB   GLN  36           HB1      GLN  36  67.046  -6.097   9.026
  337   1HG   GLN  36           HG2      GLN  36  65.788  -6.970  11.043
  338   2HG   GLN  36           HG1      GLN  36  66.242  -8.597  10.533
  339   1HE2  GLN  36          HE22      GLN  36  69.325  -6.083  11.616
  340   2HE2  GLN  36          HE21      GLN  36  67.997  -5.441  10.775
  341    H    GLN  37           HN       GLN  37  65.951  -6.642   6.092
  342    HA   GLN  37           HA       GLN  37  65.801  -3.781   5.945
  343   1HB   GLN  37           HB2      GLN  37  67.155  -5.254   4.407
  344   2HB   GLN  37           HB1      GLN  37  65.644  -5.737   3.635
  345   1HG   GLN  37           HG2      GLN  37  65.162  -3.363   3.116
  346   2HG   GLN  37           HG1      GLN  37  66.697  -2.899   3.848
  347   1HE2  GLN  37          HE22      GLN  37  66.698  -4.774   0.194
  348   2HE2  GLN  37          HE21      GLN  37  65.314  -4.850   1.174
  349    H    ILE  38           HN       ILE  38  63.447  -6.353   5.444
  350    HA   ILE  38           HA       ILE  38  61.537  -4.649   4.078
  351    HB   ILE  38           HB       ILE  38  61.310  -7.382   5.373
  352   1HG1  ILE  38          HG12      ILE  38  62.428  -7.232   3.178
  353   2HG1  ILE  38          HG11      ILE  38  60.879  -8.059   3.026
  354   1HG2  ILE  38          HG22      ILE  38  59.103  -5.697   4.124
  355   2HG2  ILE  38          HG21      ILE  38  58.979  -7.440   4.361
  356   3HG2  ILE  38          HG23      ILE  38  59.133  -6.369   5.755
  357   1HD1  ILE  38          HD12      ILE  38  60.223  -5.371   2.662
  358   2HD1  ILE  38          HD11      ILE  38  61.763  -5.542   1.822
  359   3HD1  ILE  38          HD13      ILE  38  60.400  -6.570   1.382
  360    H    THR  39           HN       THR  39  62.291  -5.487   7.386
  361    HA   THR  39           HA       THR  39  59.947  -4.340   8.614
  362    HB   THR  39           HB       THR  39  62.746  -4.477   9.781
  363    HG1  THR  39           HG1      THR  39  62.486  -6.546   9.894
  364   1HG2  THR  39          HG21      THR  39  59.974  -4.415  11.001
  365   2HG2  THR  39          HG23      THR  39  61.455  -4.699  11.915
  366   3HG2  THR  39          HG22      THR  39  61.202  -3.153  11.106
  367    H    HIS  40           HN       HIS  40  63.062  -3.089   7.558
  368    HA   HIS  40           HA       HIS  40  62.581  -0.374   8.537
  369   1HB   HIS  40           HB2      HIS  40  64.608  -1.322   6.493
  370   2HB   HIS  40           HB1      HIS  40  64.656   0.183   7.414
  371    HD1  HIS  40           HD1      HIS  40  66.516  -2.659   7.439
  372    HD2  HIS  40           HD2      HIS  40  64.171  -0.962  10.440
  373    HE1  HIS  40           HE1      HIS  40  67.380  -3.583   9.634
  374    H    ILE  41           HN       ILE  41  61.764  -2.210   5.712
  375    HA   ILE  41           HA       ILE  41  61.411   0.037   3.926
  376    HB   ILE  41           HB       ILE  41  61.010  -2.857   3.890
  377   1HG1  ILE  41          HG12      ILE  41  61.099  -1.945   1.266
  378   2HG1  ILE  41          HG11      ILE  41  61.955  -0.691   2.156
  379   1HG2  ILE  41          HG21      ILE  41  58.612  -2.256   3.731
  380   2HG2  ILE  41          HG23      ILE  41  58.979  -1.245   2.333
  381   3HG2  ILE  41          HG22      ILE  41  59.220  -2.990   2.247
  382   1HD1  ILE  41          HD13      ILE  41  62.572  -3.598   2.653
  383   2HD1  ILE  41          HD12      ILE  41  63.310  -2.743   1.298
  384   3HD1  ILE  41          HD11      ILE  41  63.585  -2.186   2.948
  385    H    ALA  42           HN       ALA  42  59.369  -1.775   6.181
  386    HA   ALA  42           HA       ALA  42  56.933  -0.396   5.631
  387   1HB   ALA  42           HB2      ALA  42  57.227  -2.574   6.945
  388   2HB   ALA  42           HB1      ALA  42  57.706  -1.563   8.308
  389   3HB   ALA  42           HB3      ALA  42  56.087  -1.412   7.623
  390    H    ASN  43           HN       ASN  43  59.369   0.075   8.173
  391    HA   ASN  43           HA       ASN  43  58.210   2.476   9.228
  392   1HB   ASN  43           HB2      ASN  43  60.173   0.939  10.121
  393   2HB   ASN  43           HB1      ASN  43  61.182   2.045   9.190
  394   1HD2  ASN  43          HD22      ASN  43  59.945   3.214  12.784
  395   2HD2  ASN  43          HD21      ASN  43  59.970   1.601  12.255
  396    H    GLN  44           HN       GLN  44  59.934   1.752   6.321
  397    HA   GLN  44           HA       GLN  44  60.988   4.373   5.784
  398   1HB   GLN  44           HB2      GLN  44  60.943   1.763   4.559
  399   2HB   GLN  44           HB1      GLN  44  60.637   3.001   3.354
  400   1HG   GLN  44           HG2      GLN  44  62.939   3.134   5.316
  401   2HG   GLN  44           HG1      GLN  44  63.082   2.376   3.733
  402   1HE2  GLN  44          HE22      GLN  44  64.163   5.870   3.225
  403   2HE2  GLN  44          HE21      GLN  44  64.746   4.485   4.014
  404    H    LEU  45           HN       LEU  45  57.922   2.727   5.039
  405    HA   LEU  45           HA       LEU  45  56.951   5.367   4.043
  406   1HB   LEU  45           HB2      LEU  45  55.763   4.424   2.226
  407   2HB   LEU  45           HB1      LEU  45  57.362   3.698   2.174
  408    HG   LEU  45           HG       LEU  45  55.027   2.342   3.525
  409   1HD1  LEU  45          HD11      LEU  45  54.949   2.957   0.899
  410   2HD1  LEU  45          HD13      LEU  45  55.933   1.496   0.820
  411   3HD1  LEU  45          HD12      LEU  45  54.326   1.440   1.535
  412   1HD2  LEU  45          HD21      LEU  45  57.834   1.698   2.759
  413   2HD2  LEU  45          HD23      LEU  45  56.920   1.222   4.188
  414   3HD2  LEU  45          HD22      LEU  45  56.639   0.405   2.652
  415    H    GLY  46           HN       GLY  46  56.684   3.908   6.655
  416   1HA   GLY  46           HA2      GLY  46  55.035   3.434   8.256
  417   2HA   GLY  46           HA1      GLY  46  54.258   4.838   7.544
  418    H    LEU  47           HN       LEU  47  54.661   1.796   5.761
  419    HA   LEU  47           HA       LEU  47  51.686   1.570   5.761
  420   1HB   LEU  47           HB2      LEU  47  51.740   0.623   3.660
  421   2HB   LEU  47           HB1      LEU  47  53.236   1.533   3.562
  422    HG   LEU  47           HG       LEU  47  52.943  -1.406   4.212
  423   1HD1  LEU  47          HD11      LEU  47  52.909  -0.248   1.761
  424   2HD1  LEU  47          HD13      LEU  47  54.643  -0.473   1.976
  425   3HD1  LEU  47          HD12      LEU  47  53.557  -1.857   2.060
  426   1HD2  LEU  47          HD21      LEU  47  55.153   0.477   4.613
  427   2HD2  LEU  47          HD23      LEU  47  54.839  -1.061   5.396
  428   3HD2  LEU  47          HD22      LEU  47  55.599  -1.013   3.808
  429    H    GLU  48           HN       GLU  48  51.035  -0.915   5.467
  430    HA   GLU  48           HA       GLU  48  52.058  -2.268   7.882
  431   1HB   GLU  48           HB2      GLU  48  49.546  -2.009   7.203
  432   2HB   GLU  48           HB1      GLU  48  49.884  -3.329   6.083
  433   1HG   GLU  48           HG2      GLU  48  49.425  -4.691   7.836
  434   2HG   GLU  48           HG1      GLU  48  51.030  -4.252   8.415
  435    H    LYS  49           HN       LYS  49  53.098  -4.272   7.771
  436    HA   LYS  49           HA       LYS  49  54.767  -4.835   5.571
  437   1HB   LYS  49           HB2      LYS  49  53.801  -6.559   7.851
  438   2HB   LYS  49           HB1      LYS  49  54.952  -7.152   6.652
  439   1HG   LYS  49           HG2      LYS  49  56.653  -5.872   7.462
  440   2HG   LYS  49           HG1      LYS  49  55.600  -4.493   7.774
  441   1HD   LYS  49           HD2      LYS  49  54.648  -5.870   9.725
  442   2HD   LYS  49           HD1      LYS  49  56.040  -6.930   9.506
  443   1HE   LYS  49           HE2      LYS  49  57.075  -4.298   9.499
  444   2HE   LYS  49           HE1      LYS  49  55.911  -4.358  10.822
  445   1HZ   LYS  49           HZ2      LYS  49  57.036  -6.539  11.423
  446   2HZ   LYS  49           HZ1      LYS  49  58.295  -6.050  10.393
  447   3HZ   LYS  49           HZ3      LYS  49  57.895  -5.109  11.747
  448    H    ASP  50           HN       ASP  50  51.412  -5.645   6.011
  449    HA   ASP  50           HA       ASP  50  51.375  -7.888   4.179
  450   1HB   ASP  50           HB2      ASP  50  49.630  -7.463   5.932
  451   2HB   ASP  50           HB1      ASP  50  49.072  -6.088   4.978
  452    H    VAL  51           HN       VAL  51  50.772  -4.368   3.825
  453    HA   VAL  51           HA       VAL  51  50.044  -4.713   1.006
  454    HB   VAL  51           HB       VAL  51  49.088  -2.861   2.344
  455   1HG1  VAL  51          HG13      VAL  51  51.893  -2.429   2.967
  456   2HG1  VAL  51          HG12      VAL  51  51.142  -0.949   2.370
  457   3HG1  VAL  51          HG11      VAL  51  50.464  -1.783   3.768
  458   1HG2  VAL  51          HG22      VAL  51  49.635  -2.774  -0.216
  459   2HG2  VAL  51          HG21      VAL  51  49.155  -1.288   0.605
  460   3HG2  VAL  51          HG23      VAL  51  50.858  -1.596   0.263
  461    H    VAL  52           HN       VAL  52  52.967  -4.308   2.829
  462    HA   VAL  52           HA       VAL  52  54.511  -3.306   0.566
  463    HB   VAL  52           HB       VAL  52  54.888  -3.094   3.226
  464   1HG1  VAL  52          HG13      VAL  52  55.372  -5.625   3.315
  465   2HG1  VAL  52          HG12      VAL  52  56.913  -5.217   2.561
  466   3HG1  VAL  52          HG11      VAL  52  56.496  -4.541   4.137
  467   1HG2  VAL  52          HG21      VAL  52  56.130  -2.198   1.048
  468   2HG2  VAL  52          HG23      VAL  52  56.826  -2.004   2.655
  469   3HG2  VAL  52          HG22      VAL  52  57.379  -3.309   1.608
  470    NH1  ARG  53           NH1      ARG  53  54.845 -12.894   4.092
  471    NH2  ARG  53           NH2      ARG  53  52.968 -13.795   3.214
  472    H    ARG  53           HN       ARG  53  53.666  -6.415   1.940
  473    HA   ARG  53           HA       ARG  53  55.703  -7.913   0.494
  474   1HB   ARG  53           HB2      ARG  53  54.205  -8.547   2.624
  475   2HB   ARG  53           HB1      ARG  53  53.166  -9.222   1.370
  476   1HG   ARG  53           HG2      ARG  53  55.734 -10.045   0.626
  477   2HG   ARG  53           HG1      ARG  53  55.727 -10.207   2.382
  478   1HD   ARG  53           HD2      ARG  53  53.549 -11.314   0.590
  479   2HD   ARG  53           HD1      ARG  53  54.927 -12.260   1.154
  480    HE   ARG  53           HE       ARG  53  52.934 -11.029   3.019
  481   1HH1  ARG  53          HH11      ARG  53  55.479 -12.125   4.177
  482   2HH1  ARG  53          HH12      ARG  53  55.017 -13.741   4.595
  483   1HH2  ARG  53          HH21      ARG  53  52.162 -13.716   2.627
  484   2HH2  ARG  53          HH22      ARG  53  53.139 -14.642   3.718
  485    H    VAL  54           HN       VAL  54  52.218  -7.271   0.040
  486    HA   VAL  54           HA       VAL  54  51.990  -8.783  -2.406
  487    HB   VAL  54           HB       VAL  54  50.339  -6.405  -1.489
  488   1HG1  VAL  54          HG12      VAL  54  50.004  -8.531  -3.597
  489   2HG1  VAL  54          HG11      VAL  54  48.588  -7.794  -2.847
  490   3HG1  VAL  54          HG13      VAL  54  49.741  -6.792  -3.727
  491   1HG2  VAL  54          HG21      VAL  54  50.676  -8.652  -0.042
  492   2HG2  VAL  54          HG23      VAL  54  49.126  -7.816  -0.132
  493   3HG2  VAL  54          HG22      VAL  54  49.429  -9.224  -1.150
  494    CH2  TRP  55           CH2      TRP  55  58.621  -1.634  -4.355
  495    H    TRP  55           HN       TRP  55  52.865  -5.434  -1.686
  496    HA   TRP  55           HA       TRP  55  52.848  -4.540  -4.437
  497   1HB   TRP  55           HB2      TRP  55  52.693  -2.881  -2.688
  498   2HB   TRP  55           HB1      TRP  55  54.162  -3.470  -1.916
  499    HD1  TRP  55           HD1      TRP  55  52.943  -1.169  -4.682
  500    HE1  TRP  55           HE1      TRP  55  54.950   0.039  -5.681
  501    HE3  TRP  55           HE3      TRP  55  56.762  -3.770  -2.495
  502    HZ2  TRP  55           HZ2      TRP  55  57.824  -0.107  -5.649
  503    HZ3  TRP  55           HZ3      TRP  55  59.114  -3.222  -2.992
  504    HH2  TRP  55           HH2      TRP  55  59.650  -1.402  -4.573
  505    H    PHE  56           HN       PHE  56  55.309  -6.012  -2.331
  506    HA   PHE  56           HA       PHE  56  57.322  -5.744  -4.454
  507   1HB   PHE  56           HB2      PHE  56  57.809  -5.709  -1.902
  508   2HB   PHE  56           HB1      PHE  56  57.698  -7.467  -2.019
  509    HD1  PHE  56           HD2      PHE  56  59.088  -4.824  -4.307
  510    HD2  PHE  56           HD1      PHE  56  59.847  -8.417  -2.084
  511    HE1  PHE  56           HE2      PHE  56  61.372  -4.907  -5.236
  512    HE2  PHE  56           HE1      PHE  56  62.141  -8.506  -3.025
  513    HZ   PHE  56           HZ       PHE  56  62.897  -6.745  -4.605
  514    H    CYS  57           HN       CYS  57  54.776  -7.884  -3.812
  515    HA   CYS  57           HA       CYS  57  55.993 -10.362  -4.658
  516   1HB   CYS  57           HB2      CYS  57  53.759 -10.167  -3.477
  517   2HB   CYS  57           HB1      CYS  57  53.093  -9.520  -4.976
  518    HG   CYS  57           HG       CYS  57  54.496 -12.186  -5.427
  519    H    ASN  58           HN       ASN  58  54.109  -7.830  -6.299
  520    HA   ASN  58           HA       ASN  58  54.411  -8.962  -8.944
  521   1HB   ASN  58           HB2      ASN  58  52.690  -7.204  -8.184
  522   2HB   ASN  58           HB1      ASN  58  54.000  -6.029  -8.305
  523   1HD2  ASN  58          HD22      ASN  58  53.142  -5.633 -11.705
  524   2HD2  ASN  58          HD21      ASN  58  53.335  -4.896 -10.189
  525    NH1  ARG  59           NH2      ARG  59  56.285  -4.662 -11.094
  526    NH2  ARG  59           NH1      ARG  59  56.670  -2.454 -11.392
  527    H    ARG  59           HN       ARG  59  56.151  -6.522  -7.029
  528    HA   ARG  59           HA       ARG  59  58.054  -5.799  -9.062
  529   1HB   ARG  59           HB2      ARG  59  57.584  -5.171  -6.312
  530   2HB   ARG  59           HB1      ARG  59  59.276  -5.651  -6.455
  531   1HG   ARG  59           HG2      ARG  59  58.931  -3.213  -6.797
  532   2HG   ARG  59           HG1      ARG  59  59.639  -4.004  -8.203
  533   1HD   ARG  59           HD2      ARG  59  56.688  -3.941  -8.212
  534   2HD   ARG  59           HD1      ARG  59  57.448  -2.354  -8.291
  535    HE   ARG  59           HE       ARG  59  58.831  -3.803 -10.184
  536   1HH1  ARG  59          HH21      ARG  59  56.501  -5.524 -10.637
  537   2HH1  ARG  59          HH22      ARG  59  55.558  -4.627 -11.780
  538   1HH2  ARG  59          HH11      ARG  59  57.181  -1.626 -11.164
  539   2HH2  ARG  59          HH12      ARG  59  55.941  -2.420 -12.076
  540    NH1  ARG  60           NH2      ARG  60  59.635 -13.137  -1.722
  541    NH2  ARG  60           NH1      ARG  60  58.493 -14.365  -3.238
  542    H    ARG  60           HN       ARG  60  57.716  -8.667  -7.168
  543    HA   ARG  60           HA       ARG  60  60.530  -9.463  -7.366
  544   1HB   ARG  60           HB2      ARG  60  58.017 -10.613  -6.245
  545   2HB   ARG  60           HB1      ARG  60  59.263 -11.758  -6.740
  546   1HG   ARG  60           HG2      ARG  60  60.873 -10.797  -5.266
  547   2HG   ARG  60           HG1      ARG  60  59.863  -9.381  -4.972
  548   1HD   ARG  60           HD2      ARG  60  59.446 -10.647  -3.057
  549   2HD   ARG  60           HD1      ARG  60  58.124 -11.158  -4.107
  550    HE   ARG  60           HE       ARG  60  60.319 -12.896  -4.578
  551   1HH1  ARG  60          HH21      ARG  60  60.232 -12.364  -1.506
  552   2HH1  ARG  60          HH22      ARG  60  59.318 -13.742  -0.992
  553   1HH2  ARG  60          HH11      ARG  60  58.215 -14.532  -4.183
  554   2HH2  ARG  60          HH12      ARG  60  58.175 -14.970  -2.508
  555    H    GLN  61           HN       GLN  61  57.445 -10.262  -8.929
  556    HA   GLN  61           HA       GLN  61  58.946 -11.802 -11.001
  557   1HB   GLN  61           HB2      GLN  61  55.992 -11.777 -10.297
  558   2HB   GLN  61           HB1      GLN  61  56.708 -12.727 -11.599
  559   1HG   GLN  61           HG2      GLN  61  58.284 -13.665  -9.762
  560   2HG   GLN  61           HG1      GLN  61  57.097 -13.025  -8.625
  561   1HE2  GLN  61          HE22      GLN  61  55.028 -15.830  -9.043
  562   2HE2  GLN  61          HE21      GLN  61  55.609 -14.597  -8.031
  563    H    LYS  62           HN       LYS  62  59.493  -9.363 -11.492
  564    HA   LYS  62           HA       LYS  62  57.448  -7.903 -12.980
  565   1HB   LYS  62           HB2      LYS  62  59.357  -6.401 -13.566
  566   2HB   LYS  62           HB1      LYS  62  59.207  -6.664 -11.830
  567   1HG   LYS  62           HG2      LYS  62  61.241  -7.637 -11.708
  568   2HG   LYS  62           HG1      LYS  62  60.893  -8.699 -13.072
  569   1HD   LYS  62           HD2      LYS  62  61.304  -6.657 -14.569
  570   2HD   LYS  62           HD1      LYS  62  61.989  -5.882 -13.139
  571   1HE   LYS  62           HE2      LYS  62  62.904  -8.564 -14.212
  572   2HE   LYS  62           HE1      LYS  62  63.703  -7.034 -14.573
  573   1HZ   LYS  62           HZ3      LYS  62  63.219  -7.978 -11.807
  574   2HZ   LYS  62           HZ2      LYS  62  64.643  -8.334 -12.663
  575   3HZ   LYS  62           HZ1      LYS  62  64.238  -6.721 -12.316
  576    H    GLY  63           HN       GLY  63  59.773 -10.392 -13.682
  577   1HA   GLY  63           HA2      GLY  63  58.777 -10.805 -16.322
  578   2HA   GLY  63           HA1      GLY  63  60.305  -9.929 -16.415
  579    H    LYS  64           HN       LYS  64  58.799 -12.943 -15.359
  580    HA   LYS  64           HA       LYS  64  61.483 -14.228 -15.502
  581   1HB   LYS  64           HB2      LYS  64  60.080 -13.821 -13.121
  582   2HB   LYS  64           HB1      LYS  64  59.723 -15.494 -13.541
  583   1HG   LYS  64           HG2      LYS  64  62.556 -14.582 -13.801
  584   2HG   LYS  64           HG1      LYS  64  61.924 -14.834 -12.173
  585   1HD   LYS  64           HD2      LYS  64  62.596 -16.987 -12.585
  586   2HD   LYS  64           HD1      LYS  64  61.006 -17.082 -13.342
  587   1HE   LYS  64           HE2      LYS  64  61.870 -16.985 -15.492
  588   2HE   LYS  64           HE1      LYS  64  63.308 -16.099 -14.986
  589   1HZ   LYS  64           HZ3      LYS  64  62.765 -18.930 -14.282
  590   2HZ   LYS  64           HZ2      LYS  64  63.735 -18.443 -15.589
  591   3HZ   LYS  64           HZ1      LYS  64  64.195 -18.064 -13.998
  592    NH1  ARG  65           NH2      ARG  65  59.117 -21.996 -19.045
  593    NH2  ARG  65           NH1      ARG  65  59.802 -22.615 -16.982
  594    H    ARG  65           HN       ARG  65  58.144 -15.299 -14.866
  595    HA   ARG  65           HA       ARG  65  58.295 -16.923 -17.357
  596   1HB   ARG  65           HB2      ARG  65  58.840 -18.313 -15.309
  597   2HB   ARG  65           HB1      ARG  65  57.201 -17.990 -14.742
  598   1HG   ARG  65           HG2      ARG  65  56.228 -19.305 -16.367
  599   2HG   ARG  65           HG1      ARG  65  57.514 -18.995 -17.534
  600   1HD   ARG  65           HD2      ARG  65  59.014 -20.357 -15.898
  601   2HD   ARG  65           HD1      ARG  65  57.487 -20.940 -15.235
  602    HE   ARG  65           HE       ARG  65  56.968 -21.738 -17.591
  603   1HH1  ARG  65          HH21      ARG  65  58.444 -21.554 -19.637
  604   2HH1  ARG  65          HH22      ARG  65  59.939 -22.405 -19.440
  605   1HH2  ARG  65          HH11      ARG  65  59.654 -22.647 -15.993
  606   2HH2  ARG  65          HH12      ARG  65  60.625 -23.023 -17.377
  607    H    SER  66           HN       SER  66  56.893 -14.407 -16.673
  608    HA   SER  66           HA       SER  66  54.071 -15.363 -16.959
  609   1HB   SER  66           HB2      SER  66  54.351 -14.135 -14.871
  610   2HB   SER  66           HB1      SER  66  55.127 -12.803 -15.721
  611    HG   SER  66           HG       SER  66  52.611 -13.019 -15.230
  612    H    SER  67           HN       SER  67  55.067 -15.445 -19.298
  613    HA   SER  67           HA       SER  67  54.052 -13.084 -20.710
  614   1HB   SER  67           HB2      SER  67  56.939 -13.597 -20.371
  615   2HB   SER  67           HB1      SER  67  56.441 -13.335 -22.040
  616    HG   SER  67           HG       SER  67  56.021 -11.655 -19.792
   
  Start of MODEL          11
 Raw file had  616 H/Q atoms
  Start of MODEL   11
    1   1H    MET   1           HT1      MET   1  36.708  -4.215  12.852
    2   2H    MET   1           HT3      MET   1  35.259  -4.114  11.978
    3   3H    MET   1           HT2      MET   1  36.302  -5.434  11.741
    4    HA   MET   1           HA       MET   1  36.652  -4.048   9.897
    5   1HB   MET   1           HB2      MET   1  35.618  -2.072  11.388
    6   2HB   MET   1           HB1      MET   1  37.326  -1.674  11.573
    7   1HG   MET   1           HG2      MET   1  36.903  -0.524   9.620
    8   2HG   MET   1           HG1      MET   1  37.318  -2.093   8.931
    9   1HE   MET   1           HE3      MET   1  36.338  -2.810   7.225
   10   2HE   MET   1           HE2      MET   1  34.673  -2.673   6.664
   11   3HE   MET   1           HE1      MET   1  35.737  -1.270   6.597
   12    H    GLU   2           HN       GLU   2  38.600  -4.901   9.348
   13    HA   GLU   2           HA       GLU   2  40.898  -4.543  11.210
   14   1HB   GLU   2           HB2      GLU   2  40.208  -6.526   9.074
   15   2HB   GLU   2           HB1      GLU   2  41.910  -6.229   9.430
   16   1HG   GLU   2           HG2      GLU   2  40.087  -6.637  11.754
   17   2HG   GLU   2           HG1      GLU   2  40.476  -8.054  10.778
   18    H    THR   3           HN       THR   3  40.345  -4.520   7.661
   19    HA   THR   3           HA       THR   3  41.803  -1.982   7.426
   20    HB   THR   3           HB       THR   3  43.677  -3.538   7.465
   21    HG1  THR   3           HG1      THR   3  44.559  -2.888   5.588
   22   1HG2  THR   3          HG22      THR   3  42.148  -5.490   6.727
   23   2HG2  THR   3          HG21      THR   3  42.498  -4.957   5.083
   24   3HG2  THR   3          HG23      THR   3  43.810  -5.483   6.138
   25    H    LEU   4           HN       LEU   4  41.746  -1.188   5.149
   26    HA   LEU   4           HA       LEU   4  39.840  -2.595   3.369
   27   1HB   LEU   4           HB2      LEU   4  38.484  -0.542   3.077
   28   2HB   LEU   4           HB1      LEU   4  38.417  -1.133   4.735
   29    HG   LEU   4           HG       LEU   4  40.656   0.608   4.622
   30   1HD1  LEU   4          HD12      LEU   4  39.660   1.485   2.506
   31   2HD1  LEU   4          HD11      LEU   4  38.189   1.879   3.396
   32   3HD1  LEU   4          HD13      LEU   4  39.703   2.693   3.791
   33   1HD2  LEU   4          HD22      LEU   4  38.875   0.127   6.447
   34   2HD2  LEU   4          HD21      LEU   4  39.506   1.770   6.332
   35   3HD2  LEU   4          HD23      LEU   4  37.925   1.383   5.653
   36    H    VAL   5           HN       VAL   5  39.751  -1.422   1.191
   37    HA   VAL   5           HA       VAL   5  41.953   0.405   0.589
   38    HB   VAL   5           HB       VAL   5  43.167  -1.721   0.654
   39   1HG1  VAL   5          HG11      VAL   5  40.835  -2.880  -0.122
   40   2HG1  VAL   5          HG13      VAL   5  41.714  -2.879  -1.651
   41   3HG1  VAL   5          HG12      VAL   5  42.406  -3.672  -0.236
   42   1HG2  VAL   5          HG22      VAL   5  43.252   0.083  -1.389
   43   2HG2  VAL   5          HG21      VAL   5  44.352  -1.287  -1.249
   44   3HG2  VAL   5          HG23      VAL   5  42.929  -1.402  -2.283
   45    H    GLN   6           HN       GLN   6  40.203   1.685  -0.196
   46    HA   GLN   6           HA       GLN   6  39.009   0.694  -2.756
   47   1HB   GLN   6           HB2      GLN   6  37.076   2.205  -2.236
   48   2HB   GLN   6           HB1      GLN   6  37.260   0.890  -1.075
   49   1HG   GLN   6           HG2      GLN   6  37.701   2.311   0.632
   50   2HG   GLN   6           HG1      GLN   6  38.809   3.274  -0.343
   51   1HE2  GLN   6          HE22      GLN   6  35.099   4.655   0.321
   52   2HE2  GLN   6          HE21      GLN   6  35.746   3.317   1.141
   53    H    ALA   7           HN       ALA   7  38.450   2.547  -4.258
   54    HA   ALA   7           HA       ALA   7  40.739   4.259  -4.602
   55   1HB   ALA   7           HB2      ALA   7  39.016   3.310  -6.359
   56   2HB   ALA   7           HB1      ALA   7  38.132   4.790  -5.985
   57   3HB   ALA   7           HB3      ALA   7  39.772   4.881  -6.627
   58    NH1  ARG   8           NH1      ARG   8  35.200   8.488   2.516
   59    NH2  ARG   8           NH2      ARG   8  36.828   9.622   3.598
   60    H    ARG   8           HN       ARG   8  41.016   5.806  -3.014
   61    HA   ARG   8           HA       ARG   8  39.064   7.975  -2.911
   62   1HB   ARG   8           HB2      ARG   8  38.600   6.054  -1.098
   63   2HB   ARG   8           HB1      ARG   8  39.841   6.952  -0.221
   64   1HG   ARG   8           HG2      ARG   8  38.519   9.051  -0.642
   65   2HG   ARG   8           HG1      ARG   8  37.237   8.047  -1.318
   66   1HD   ARG   8           HD2      ARG   8  36.690   7.119   0.737
   67   2HD   ARG   8           HD1      ARG   8  38.309   7.357   1.392
   68    HE   ARG   8           HE       ARG   8  37.333   9.935   1.008
   69   1HH1  ARG   8          HH11      ARG   8  34.848   8.061   1.682
   70   2HH1  ARG   8          HH12      ARG   8  34.653   8.474   3.353
   71   1HH2  ARG   8          HH21      ARG   8  37.725  10.065   3.594
   72   2HH2  ARG   8          HH22      ARG   8  36.281   9.608   4.435
   73    H    LYS   9           HN       LYS   9  41.866   6.736  -1.044
   74    HA   LYS   9           HA       LYS   9  43.116   9.405  -1.394
   75   1HB   LYS   9           HB2      LYS   9  42.623   8.650   0.973
   76   2HB   LYS   9           HB1      LYS   9  43.801   7.360   0.725
   77   1HG   LYS   9           HG2      LYS   9  45.546   9.017   0.238
   78   2HG   LYS   9           HG1      LYS   9  44.377  10.323   0.427
   79   1HD   LYS   9           HD2      LYS   9  43.979   9.508   2.787
   80   2HD   LYS   9           HD1      LYS   9  45.336   8.402   2.565
   81   1HE   LYS   9           HE2      LYS   9  46.895  10.083   2.625
   82   2HE   LYS   9           HE1      LYS   9  45.825  11.245   1.843
   83   1HZ   LYS   9           HZ2      LYS   9  44.515  11.045   4.056
   84   2HZ   LYS   9           HZ1      LYS   9  45.997  10.495   4.678
   85   3HZ   LYS   9           HZ3      LYS   9  45.893  12.036   3.977
   86    NH1  ARG  10           NH1      ARG  10  44.729   3.532  -7.984
   87    NH2  ARG  10           NH2      ARG  10  46.797   3.773  -8.864
   88    H    ARG  10           HN       ARG  10  43.911   8.674  -3.507
   89    HA   ARG  10           HA       ARG  10  46.329   6.985  -3.238
   90   1HB   ARG  10           HB2      ARG  10  44.186   5.985  -4.450
   91   2HB   ARG  10           HB1      ARG  10  44.784   6.950  -5.800
   92   1HG   ARG  10           HG2      ARG  10  46.836   5.344  -4.387
   93   2HG   ARG  10           HG1      ARG  10  45.625   4.413  -5.268
   94   1HD   ARG  10           HD2      ARG  10  47.109   6.738  -6.509
   95   2HD   ARG  10           HD1      ARG  10  47.691   5.077  -6.608
   96    HE   ARG  10           HE       ARG  10  45.334   6.169  -7.996
   97   1HH1  ARG  10          HH11      ARG  10  43.968   3.898  -7.449
   98   2HH1  ARG  10          HH12      ARG  10  44.665   2.618  -8.384
   99   1HH2  ARG  10          HH21      ARG  10  47.620   4.322  -9.002
  100   2HH2  ARG  10          HH22      ARG  10  46.733   2.858  -9.263
  101    H    LYS  11           HN       LYS  11  47.170   9.287  -2.990
  102    HA   LYS  11           HA       LYS  11  47.978  10.284  -5.641
  103   1HB   LYS  11           HB2      LYS  11  46.106  11.615  -3.888
  104   2HB   LYS  11           HB1      LYS  11  47.562  12.595  -4.043
  105   1HG   LYS  11           HG2      LYS  11  47.318  12.824  -6.362
  106   2HG   LYS  11           HG1      LYS  11  46.293  11.394  -6.493
  107   1HD   LYS  11           HD2      LYS  11  45.241  13.574  -4.777
  108   2HD   LYS  11           HD1      LYS  11  45.319  13.928  -6.503
  109   1HE   LYS  11           HE2      LYS  11  43.290  12.880  -6.536
  110   2HE   LYS  11           HE1      LYS  11  44.279  11.420  -6.577
  111   1HZ   LYS  11           HZ2      LYS  11  43.582  12.643  -3.993
  112   2HZ   LYS  11           HZ1      LYS  11  42.443  11.671  -4.795
  113   3HZ   LYS  11           HZ3      LYS  11  43.946  11.023  -4.352
  114    NH1  ARG  12           NH2      ARG  12  55.090  14.796  -6.053
  115    NH2  ARG  12           NH1      ARG  12  55.209  16.773  -4.965
  116    H    ARG  12           HN       ARG  12  49.405  12.503  -4.781
  117    HA   ARG  12           HA       ARG  12  51.620  11.208  -3.282
  118   1HB   ARG  12           HB2      ARG  12  52.924  13.206  -4.024
  119   2HB   ARG  12           HB1      ARG  12  52.219  12.319  -5.376
  120   1HG   ARG  12           HG2      ARG  12  50.457  13.926  -5.627
  121   2HG   ARG  12           HG1      ARG  12  50.866  14.707  -4.099
  122   1HD   ARG  12           HD2      ARG  12  52.635  14.608  -6.560
  123   2HD   ARG  12           HD1      ARG  12  51.718  16.011  -6.013
  124    HE   ARG  12           HE       ARG  12  53.193  15.589  -3.823
  125   1HH1  ARG  12          HH21      ARG  12  54.584  13.965  -6.286
  126   2HH1  ARG  12          HH22      ARG  12  56.007  14.944  -6.422
  127   1HH2  ARG  12          HH11      ARG  12  54.795  17.456  -4.363
  128   2HH2  ARG  12          HH12      ARG  12  56.126  16.921  -5.334
  129    H    THR  13           HN       THR  13  49.441  11.743  -1.655
  130    HA   THR  13           HA       THR  13  49.749  14.347  -0.357
  131    HB   THR  13           HB       THR  13  48.286  11.877   0.629
  132    HG1  THR  13           HG1      THR  13  46.485  12.881  -0.333
  133   1HG2  THR  13          HG23      THR  13  48.451  14.739   1.483
  134   2HG2  THR  13          HG22      THR  13  46.907  13.905   1.649
  135   3HG2  THR  13          HG21      THR  13  48.338  13.281   2.468
  136    H    SER  14           HN       SER  14  50.804  11.030   0.159
  137    HA   SER  14           HA       SER  14  52.806  12.034   2.089
  138   1HB   SER  14           HB2      SER  14  50.790   9.858   2.648
  139   2HB   SER  14           HB1      SER  14  52.325   9.939   3.510
  140    HG   SER  14           HG       SER  14  50.600  11.069   4.564
  141    H    ILE  15           HN       ILE  15  52.730  10.985  -0.704
  142    HA   ILE  15           HA       ILE  15  55.011   9.168  -0.432
  143    HB   ILE  15           HB       ILE  15  52.453   8.296  -1.806
  144   1HG1  ILE  15          HG12      ILE  15  52.628   7.811   0.627
  145   2HG1  ILE  15          HG11      ILE  15  52.667   6.335  -0.330
  146   1HG2  ILE  15          HG22      ILE  15  55.284   7.569  -2.312
  147   2HG2  ILE  15          HG21      ILE  15  54.192   6.199  -2.112
  148   3HG2  ILE  15          HG23      ILE  15  53.878   7.404  -3.362
  149   1HD1  ILE  15          HD13      ILE  15  55.364   7.247  -0.077
  150   2HD1  ILE  15          HD12      ILE  15  54.636   7.289   1.529
  151   3HD1  ILE  15          HD11      ILE  15  54.641   5.790   0.601
  152    H    GLU  16           HN       GLU  16  55.779  11.305  -1.292
  153    HA   GLU  16           HA       GLU  16  55.106  12.167  -3.933
  154   1HB   GLU  16           HB2      GLU  16  57.706  12.565  -2.421
  155   2HB   GLU  16           HB1      GLU  16  57.154  13.506  -3.808
  156   1HG   GLU  16           HG2      GLU  16  55.217  14.300  -2.532
  157   2HG   GLU  16           HG1      GLU  16  55.708  13.323  -1.148
  158    H    ASN  17           HN       ASN  17  56.467  11.879  -5.845
  159    HA   ASN  17           HA       ASN  17  57.182   9.160  -6.303
  160   1HB   ASN  17           HB2      ASN  17  57.475  11.720  -7.806
  161   2HB   ASN  17           HB1      ASN  17  58.497  10.375  -8.311
  162   1HD2  ASN  17          HD22      ASN  17  54.481  10.236  -9.007
  163   2HD2  ASN  17          HD21      ASN  17  55.159  11.505  -8.105
  164    NH1  ARG  18           NH2      ARG  18  62.831  17.164  -6.792
  165    NH2  ARG  18           NH1      ARG  18  60.676  17.834  -6.666
  166    H    ARG  18           HN       ARG  18  59.018  11.876  -5.098
  167    HA   ARG  18           HA       ARG  18  61.601  10.556  -5.482
  168   1HB   ARG  18           HB2      ARG  18  60.911  12.940  -3.732
  169   2HB   ARG  18           HB1      ARG  18  62.524  12.455  -4.257
  170   1HG   ARG  18           HG2      ARG  18  61.902  12.855  -6.600
  171   2HG   ARG  18           HG1      ARG  18  60.270  13.302  -6.102
  172   1HD   ARG  18           HD2      ARG  18  61.458  15.056  -4.589
  173   2HD   ARG  18           HD1      ARG  18  62.853  14.781  -5.632
  174    HE   ARG  18           HE       ARG  18  60.502  15.285  -7.220
  175   1HH1  ARG  18          HH21      ARG  18  63.509  16.430  -6.810
  176   2HH1  ARG  18          HH22      ARG  18  63.124  18.118  -6.857
  177   1HH2  ARG  18          HH11      ARG  18  59.703  17.614  -6.586
  178   2HH2  ARG  18          HH12      ARG  18  60.969  18.788  -6.731
  179    H    VAL  19           HN       VAL  19  59.117  10.696  -3.010
  180    HA   VAL  19           HA       VAL  19  60.812   9.779  -0.871
  181    HB   VAL  19           HB       VAL  19  58.294  10.808  -0.882
  182   1HG1  VAL  19          HG11      VAL  19  57.913   7.815  -0.580
  183   2HG1  VAL  19          HG13      VAL  19  56.803   9.008   0.071
  184   3HG1  VAL  19          HG12      VAL  19  57.060   8.909  -1.669
  185   1HG2  VAL  19          HG23      VAL  19  59.898  10.627   1.001
  186   2HG2  VAL  19          HG22      VAL  19  58.260  10.203   1.501
  187   3HG2  VAL  19          HG21      VAL  19  59.449   8.934   1.204
  188    NH1  ARG  20           NH1      ARG  20  55.569   2.617  -6.833
  189    NH2  ARG  20           NH2      ARG  20  53.828   3.732  -5.920
  190    H    ARG  20           HN       ARG  20  58.623   8.114  -3.125
  191    HA   ARG  20           HA       ARG  20  59.101   5.500  -2.054
  192   1HB   ARG  20           HB2      ARG  20  57.493   6.539  -4.051
  193   2HB   ARG  20           HB1      ARG  20  58.661   5.583  -4.960
  194   1HG   ARG  20           HG2      ARG  20  57.949   3.593  -4.052
  195   2HG   ARG  20           HG1      ARG  20  57.505   4.333  -2.514
  196   1HD   ARG  20           HD2      ARG  20  55.456   3.697  -3.607
  197   2HD   ARG  20           HD1      ARG  20  55.580   5.453  -3.719
  198    HE   ARG  20           HE       ARG  20  56.524   4.992  -6.079
  199   1HH1  ARG  20          HH11      ARG  20  56.554   2.508  -6.965
  200   2HH1  ARG  20          HH12      ARG  20  54.932   1.979  -7.266
  201   1HH2  ARG  20          HH21      ARG  20  53.478   4.477  -5.353
  202   2HH2  ARG  20          HH22      ARG  20  53.193   3.094  -6.356
  203    CH2  TRP  21           CH2      TRP  21  60.099   2.099  -7.766
  204    H    TRP  21           HN       TRP  21  60.680   7.171  -4.798
  205    HA   TRP  21           HA       TRP  21  62.532   4.954  -5.019
  206   1HB   TRP  21           HB2      TRP  21  62.007   7.390  -6.553
  207   2HB   TRP  21           HB1      TRP  21  63.739   7.060  -6.395
  208    HD1  TRP  21           HD1      TRP  21  64.277   5.894  -8.684
  209    HE1  TRP  21           HE1      TRP  21  63.467   3.709  -9.803
  210    HE3  TRP  21           HE3      TRP  21  60.320   4.748  -5.677
  211    HZ2  TRP  21           HZ2      TRP  21  61.404   1.726  -9.430
  212    HZ3  TRP  21           HZ3      TRP  21  58.970   2.740  -6.040
  213    HH2  TRP  21           HH2      TRP  21  59.512   1.207  -7.923
  214    H    SER  22           HN       SER  22  62.268   7.501  -2.820
  215    HA   SER  22           HA       SER  22  65.104   7.786  -2.236
  216   1HB   SER  22           HB2      SER  22  63.579   9.549  -1.466
  217   2HB   SER  22           HB1      SER  22  62.625   8.370  -0.574
  218    HG   SER  22           HG       SER  22  63.984   8.597   0.997
  219    H    LEU  23           HN       LEU  23  62.337   5.835  -1.201
  220    HA   LEU  23           HA       LEU  23  63.502   4.295   0.889
  221   1HB   LEU  23           HB2      LEU  23  61.639   3.328  -1.316
  222   2HB   LEU  23           HB1      LEU  23  61.921   2.507   0.200
  223    HG   LEU  23           HG       LEU  23  60.919   5.327   0.256
  224   1HD1  LEU  23          HD11      LEU  23  59.619   3.654  -1.357
  225   2HD1  LEU  23          HD13      LEU  23  58.997   3.022   0.167
  226   3HD1  LEU  23          HD12      LEU  23  58.729   4.712  -0.261
  227   1HD2  LEU  23          HD23      LEU  23  61.582   4.086   2.339
  228   2HD2  LEU  23          HD22      LEU  23  59.874   4.525   2.324
  229   3HD2  LEU  23          HD21      LEU  23  60.362   2.870   1.960
  230    H    GLU  24           HN       GLU  24  63.498   3.927  -2.620
  231    HA   GLU  24           HA       GLU  24  64.963   1.518  -2.878
  232   1HB   GLU  24           HB2      GLU  24  63.885   3.108  -4.682
  233   2HB   GLU  24           HB1      GLU  24  65.505   3.803  -4.750
  234   1HG   GLU  24           HG2      GLU  24  66.246   1.270  -4.906
  235   2HG   GLU  24           HG1      GLU  24  64.596   1.044  -5.487
  236    H    THR  25           HN       THR  25  66.320   4.836  -2.946
  237    HA   THR  25           HA       THR  25  69.041   4.078  -3.064
  238    HB   THR  25           HB       THR  25  69.341   6.372  -1.817
  239    HG1  THR  25           HG1      THR  25  67.515   7.578  -1.739
  240   1HG2  THR  25          HG23      THR  25  69.667   6.001  -4.236
  241   2HG2  THR  25          HG22      THR  25  67.929   6.163  -4.493
  242   3HG2  THR  25          HG21      THR  25  68.870   7.545  -3.931
  243    H    MET  26           HN       MET  26  66.830   4.016  -0.359
  244    HA   MET  26           HA       MET  26  69.003   3.850   1.622
  245   1HB   MET  26           HB2      MET  26  65.995   3.596   1.833
  246   2HB   MET  26           HB1      MET  26  67.083   3.447   3.214
  247   1HG   MET  26           HG2      MET  26  67.956   5.705   2.797
  248   2HG   MET  26           HG1      MET  26  66.915   5.858   1.381
  249   1HE   MET  26           HE3      MET  26  67.655   6.261   4.714
  250   2HE   MET  26           HE2      MET  26  66.774   7.778   4.556
  251   3HE   MET  26           HE1      MET  26  66.204   6.550   5.683
  252    H    PHE  27           HN       PHE  27  66.975   1.622  -0.180
  253    HA   PHE  27           HA       PHE  27  67.737  -0.641   1.557
  254   1HB   PHE  27           HB2      PHE  27  65.842  -0.315  -0.767
  255   2HB   PHE  27           HB1      PHE  27  66.364  -1.915  -0.253
  256    HD1  PHE  27           HD1      PHE  27  66.172  -2.477   2.274
  257    HD2  PHE  27           HD2      PHE  27  64.099   0.774   0.389
  258    HE1  PHE  27           HE1      PHE  27  64.570  -2.399   4.164
  259    HE2  PHE  27           HE2      PHE  27  62.499   0.854   2.275
  260    HZ   PHE  27           HZ       PHE  27  62.735  -0.732   4.162
  261    H    LEU  28           HN       LEU  28  68.974   0.880  -1.262
  262    HA   LEU  28           HA       LEU  28  70.174  -1.606  -2.290
  263   1HB   LEU  28           HB2      LEU  28  70.377   1.256  -3.260
  264   2HB   LEU  28           HB1      LEU  28  71.052  -0.149  -4.091
  265    HG   LEU  28           HG       LEU  28  68.121   0.153  -3.377
  266   1HD1  LEU  28          HD11      LEU  28  69.590   0.644  -5.982
  267   2HD1  LEU  28          HD13      LEU  28  67.837   0.498  -5.848
  268   3HD1  LEU  28          HD12      LEU  28  68.676   1.823  -5.041
  269   1HD2  LEU  28          HD22      LEU  28  69.706  -1.844  -5.014
  270   2HD2  LEU  28          HD21      LEU  28  68.725  -2.163  -3.583
  271   3HD2  LEU  28          HD23      LEU  28  67.950  -1.711  -5.101
  272    H    LYS  29           HN       LYS  29  70.989  -0.185   0.369
  273    HA   LYS  29           HA       LYS  29  73.892   0.098  -0.275
  274   1HB   LYS  29           HB2      LYS  29  74.151   1.350   1.760
  275   2HB   LYS  29           HB1      LYS  29  72.724   1.993   0.956
  276   1HG   LYS  29           HG2      LYS  29  71.271   0.643   2.425
  277   2HG   LYS  29           HG1      LYS  29  72.696  -0.036   3.218
  278   1HD   LYS  29           HD2      LYS  29  73.384   2.241   3.912
  279   2HD   LYS  29           HD1      LYS  29  71.925   2.898   3.168
  280   1HE   LYS  29           HE2      LYS  29  70.563   1.421   4.663
  281   2HE   LYS  29           HE1      LYS  29  72.053   0.930   5.469
  282   1HZ   LYS  29           HZ2      LYS  29  72.469   3.275   5.986
  283   2HZ   LYS  29           HZ1      LYS  29  70.978   3.692   5.286
  284   3HZ   LYS  29           HZ3      LYS  29  71.018   2.719   6.674
  285    H    CYS  30           HN       CYS  30  71.600  -1.510   1.866
  286    HA   CYS  30           HA       CYS  30  73.550  -3.701   2.235
  287   1HB   CYS  30           HB2      CYS  30  71.987  -2.382   4.477
  288   2HB   CYS  30           HB1      CYS  30  72.964  -3.841   4.643
  289    HG   CYS  30           HG       CYS  30  74.326  -1.199   3.690
  290    HA   PRO  31           HA       PRO  31  69.606  -5.707   1.356
  291   1HB   PRO  31           HB2      PRO  31  70.591  -8.239   1.039
  292   2HB   PRO  31           HB1      PRO  31  70.760  -6.984  -0.202
  293   1HG   PRO  31           HG2      PRO  31  72.823  -8.108   1.616
  294   2HG   PRO  31           HG1      PRO  31  73.027  -7.303   0.053
  295   1HD   PRO  31           HD2      PRO  31  73.417  -6.153   2.647
  296   2HD   PRO  31           HD1      PRO  31  73.475  -5.311   1.084
  297    H    LYS  32           HN       LYS  32  70.817  -5.473   4.238
  298    HA   LYS  32           HA       LYS  32  69.588  -7.954   5.310
  299   1HB   LYS  32           HB2      LYS  32  71.107  -7.558   7.302
  300   2HB   LYS  32           HB1      LYS  32  71.929  -7.979   5.800
  301   1HG   LYS  32           HG2      LYS  32  72.808  -5.858   5.521
  302   2HG   LYS  32           HG1      LYS  32  71.461  -5.076   6.350
  303   1HD   LYS  32           HD2      LYS  32  73.135  -6.890   8.005
  304   2HD   LYS  32           HD1      LYS  32  73.900  -5.390   7.480
  305   1HE   LYS  32           HE2      LYS  32  71.626  -4.309   8.274
  306   2HE   LYS  32           HE1      LYS  32  71.505  -5.778   9.243
  307   1HZ   LYS  32           HZ2      LYS  32  73.934  -5.205   9.862
  308   2HZ   LYS  32           HZ1      LYS  32  73.516  -3.636   9.362
  309   3HZ   LYS  32           HZ3      LYS  32  72.663  -4.377  10.627
  310    HA   PRO  33           HA       PRO  33  67.527  -4.116   7.240
  311   1HB   PRO  33           HB2      PRO  33  65.153  -4.046   5.863
  312   2HB   PRO  33           HB1      PRO  33  66.577  -3.099   5.398
  313   1HG   PRO  33           HG2      PRO  33  65.475  -5.574   4.146
  314   2HG   PRO  33           HG1      PRO  33  66.389  -4.249   3.405
  315   1HD   PRO  33           HD2      PRO  33  67.462  -6.757   4.103
  316   2HD   PRO  33           HD1      PRO  33  68.391  -5.279   3.774
  317    H    SER  34           HN       SER  34  66.163  -4.521   8.985
  318    HA   SER  34           HA       SER  34  65.077  -7.242   9.276
  319   1HB   SER  34           HB2      SER  34  65.541  -4.948  11.156
  320   2HB   SER  34           HB1      SER  34  64.545  -6.323  11.625
  321    HG   SER  34           HG       SER  34  66.885  -6.419  12.102
  322    H    LEU  35           HN       LEU  35  62.854  -7.591   9.975
  323    HA   LEU  35           HA       LEU  35  60.912  -6.055   8.519
  324   1HB   LEU  35           HB2      LEU  35  60.510  -7.822  10.960
  325   2HB   LEU  35           HB1      LEU  35  59.234  -7.261   9.879
  326    HG   LEU  35           HG       LEU  35  61.094  -8.362   8.138
  327   1HD1  LEU  35          HD13      LEU  35  61.203  -9.710  10.789
  328   2HD1  LEU  35          HD12      LEU  35  61.104 -10.759   9.375
  329   3HD1  LEU  35          HD11      LEU  35  62.431  -9.608   9.528
  330   1HD2  LEU  35          HD21      LEU  35  58.570  -8.560   8.180
  331   2HD2  LEU  35          HD23      LEU  35  59.409 -10.054   7.763
  332   3HD2  LEU  35          HD22      LEU  35  58.754  -9.833   9.386
  333    H    GLN  36           HN       GLN  36  62.474  -5.678  11.595
  334    HA   GLN  36           HA       GLN  36  60.558  -3.834  12.778
  335   1HB   GLN  36           HB2      GLN  36  63.457  -4.513  13.282
  336   2HB   GLN  36           HB1      GLN  36  62.714  -3.129  14.086
  337   1HG   GLN  36           HG2      GLN  36  60.806  -4.974  14.555
  338   2HG   GLN  36           HG1      GLN  36  62.213  -6.035  14.471
  339   1HE2  GLN  36          HE22      GLN  36  62.079  -3.202  17.456
  340   2HE2  GLN  36          HE21      GLN  36  61.221  -2.925  16.019
  341    H    GLN  37           HN       GLN  37  63.482  -3.582  10.813
  342    HA   GLN  37           HA       GLN  37  63.626  -0.726  10.707
  343   1HB   GLN  37           HB2      GLN  37  65.447  -2.312   9.969
  344   2HB   GLN  37           HB1      GLN  37  64.475  -2.680   8.544
  345   1HG   GLN  37           HG2      GLN  37  64.526  -0.329   7.862
  346   2HG   GLN  37           HG1      GLN  37  65.419   0.097   9.323
  347   1HE2  GLN  37          HE22      GLN  37  68.441  -1.605   8.150
  348   2HE2  GLN  37          HE21      GLN  37  67.518  -1.458   9.567
  349    H    ILE  38           HN       ILE  38  61.678  -3.103   8.973
  350    HA   ILE  38           HA       ILE  38  60.811  -1.297   6.901
  351    HB   ILE  38           HB       ILE  38  59.849  -3.974   7.910
  352   1HG1  ILE  38          HG12      ILE  38  61.697  -3.872   6.288
  353   2HG1  ILE  38          HG11      ILE  38  60.271  -4.594   5.547
  354   1HG2  ILE  38          HG22      ILE  38  58.275  -2.031   6.226
  355   2HG2  ILE  38          HG21      ILE  38  58.152  -3.760   5.900
  356   3HG2  ILE  38          HG23      ILE  38  57.702  -3.127   7.483
  357   1HD1  ILE  38          HD11      ILE  38  59.737  -2.155   4.764
  358   2HD1  ILE  38          HD13      ILE  38  61.437  -1.850   5.110
  359   3HD1  ILE  38          HD12      ILE  38  60.987  -3.058   3.911
  360    H    THR  39           HN       THR  39  59.753  -2.037  10.157
  361    HA   THR  39           HA       THR  39  57.257  -0.605  10.082
  362    HB   THR  39           HB       THR  39  58.881  -0.620  12.592
  363    HG1  THR  39           HG1      THR  39  57.761  -2.929  11.384
  364   1HG2  THR  39          HG22      THR  39  56.017  -1.053  11.768
  365   2HG2  THR  39          HG21      THR  39  56.580  -1.549  13.364
  366   3HG2  THR  39          HG23      THR  39  56.676   0.145  12.882
  367    H    HIS  40           HN       HIS  40  60.498   0.365  11.206
  368    HA   HIS  40           HA       HIS  40  59.865   3.133  11.631
  369   1HB   HIS  40           HB2      HIS  40  61.946   1.872  12.436
  370   2HB   HIS  40           HB1      HIS  40  62.569   2.062  10.798
  371    HD1  HIS  40           HD1      HIS  40  63.913   4.124  10.459
  372    HD2  HIS  40           HD2      HIS  40  61.119   4.615  13.515
  373    HE1  HIS  40           HE1      HIS  40  64.287   6.442  11.408
  374    H    ILE  41           HN       ILE  41  60.393   1.258   8.766
  375    HA   ILE  41           HA       ILE  41  61.169   3.410   7.016
  376    HB   ILE  41           HB       ILE  41  60.562   0.580   6.839
  377   1HG1  ILE  41          HG12      ILE  41  61.823   1.281   4.487
  378   2HG1  ILE  41          HG11      ILE  41  62.278   2.599   5.565
  379   1HG2  ILE  41          HG23      ILE  41  58.503   1.268   5.660
  380   2HG2  ILE  41          HG22      ILE  41  59.475   2.221   4.539
  381   3HG2  ILE  41          HG21      ILE  41  59.639   0.466   4.574
  382   1HD1  ILE  41          HD13      ILE  41  62.486  -0.278   6.442
  383   2HD1  ILE  41          HD12      ILE  41  63.784   0.499   5.538
  384   3HD1  ILE  41          HD11      ILE  41  63.303   1.134   7.111
  385    H    ALA  42           HN       ALA  42  58.115   1.908   7.967
  386    HA   ALA  42           HA       ALA  42  56.358   3.405   6.329
  387   1HB   ALA  42           HB2      ALA  42  56.038   1.368   8.085
  388   2HB   ALA  42           HB1      ALA  42  55.438   2.707   9.064
  389   3HB   ALA  42           HB3      ALA  42  54.693   2.351   7.506
  390    H    ASN  43           HN       ASN  43  57.242   3.974   9.740
  391    HA   ASN  43           HA       ASN  43  55.981   6.541   9.909
  392   1HB   ASN  43           HB2      ASN  43  58.429   5.547  11.407
  393   2HB   ASN  43           HB1      ASN  43  57.402   6.898  11.885
  394   1HD2  ASN  43          HD22      ASN  43  56.385   3.263  13.124
  395   2HD2  ASN  43          HD21      ASN  43  57.937   3.701  12.592
  396    H    GLN  44           HN       GLN  44  58.879   5.427   8.375
  397    HA   GLN  44           HA       GLN  44  60.289   7.932   8.304
  398   1HB   GLN  44           HB2      GLN  44  60.670   5.219   7.384
  399   2HB   GLN  44           HB1      GLN  44  61.165   6.367   6.150
  400   1HG   GLN  44           HG2      GLN  44  62.102   6.335   9.037
  401   2HG   GLN  44           HG1      GLN  44  63.042   5.797   7.647
  402   1HE2  GLN  44          HE22      GLN  44  62.832   9.752   8.513
  403   2HE2  GLN  44          HE21      GLN  44  62.055   8.591   9.477
  404    H    LEU  45           HN       LEU  45  57.908   6.406   6.151
  405    HA   LEU  45           HA       LEU  45  57.930   8.956   4.608
  406   1HB   LEU  45           HB2      LEU  45  57.757   7.865   2.518
  407   2HB   LEU  45           HB1      LEU  45  59.033   7.019   3.379
  408    HG   LEU  45           HG       LEU  45  56.182   6.037   3.390
  409   1HD1  LEU  45          HD12      LEU  45  57.791   6.248   1.102
  410   2HD1  LEU  45          HD11      LEU  45  58.003   4.581   1.638
  411   3HD1  LEU  45          HD13      LEU  45  56.389   5.201   1.302
  412   1HD2  LEU  45          HD22      LEU  45  58.859   5.090   4.271
  413   2HD2  LEU  45          HD21      LEU  45  57.276   4.837   5.004
  414   3HD2  LEU  45          HD23      LEU  45  57.760   3.881   3.606
  415    H    GLY  46           HN       GLY  46  56.178   7.826   6.796
  416   1HA   GLY  46           HA2      GLY  46  53.900   7.677   7.330
  417   2HA   GLY  46           HA1      GLY  46  53.785   9.053   6.244
  418    H    LEU  47           HN       LEU  47  54.641   5.805   5.106
  419    HA   LEU  47           HA       LEU  47  52.091   5.836   3.559
  420   1HB   LEU  47           HB2      LEU  47  53.123   4.721   1.842
  421   2HB   LEU  47           HB1      LEU  47  54.549   5.447   2.548
  422    HG   LEU  47           HG       LEU  47  53.561   2.627   2.967
  423   1HD1  LEU  47          HD12      LEU  47  54.985   3.608   0.873
  424   2HD1  LEU  47          HD11      LEU  47  56.295   3.215   1.986
  425   3HD1  LEU  47          HD13      LEU  47  55.164   1.962   1.479
  426   1HD2  LEU  47          HD22      LEU  47  55.468   4.278   4.481
  427   2HD2  LEU  47          HD21      LEU  47  54.565   2.861   4.991
  428   3HD2  LEU  47          HD23      LEU  47  56.047   2.678   4.055
  429    H    GLU  48           HN       GLU  48  51.375   3.417   3.062
  430    HA   GLU  48           HA       GLU  48  50.800   2.207   5.696
  431   1HB   GLU  48           HB2      GLU  48  49.171   2.636   3.588
  432   2HB   GLU  48           HB1      GLU  48  49.751   1.025   3.166
  433   1HG   GLU  48           HG2      GLU  48  49.013   0.133   5.294
  434   2HG   GLU  48           HG1      GLU  48  48.599   1.748   5.873
  435    H    LYS  49           HN       LYS  49  51.488   0.093   6.199
  436    HA   LYS  49           HA       LYS  49  53.959  -0.810   5.163
  437   1HB   LYS  49           HB2      LYS  49  52.606  -1.479   7.330
  438   2HB   LYS  49           HB1      LYS  49  52.028  -2.791   6.303
  439   1HG   LYS  49           HG2      LYS  49  54.968  -2.177   6.443
  440   2HG   LYS  49           HG1      LYS  49  54.209  -3.145   7.706
  441   1HD   LYS  49           HD2      LYS  49  53.190  -4.296   5.418
  442   2HD   LYS  49           HD1      LYS  49  54.820  -3.853   4.912
  443   1HE   LYS  49           HE2      LYS  49  55.276  -5.912   5.849
  444   2HE   LYS  49           HE1      LYS  49  55.440  -4.906   7.288
  445   1HZ   LYS  49           HZ1      LYS  49  52.801  -5.979   6.567
  446   2HZ   LYS  49           HZ3      LYS  49  53.925  -6.994   7.331
  447   3HZ   LYS  49           HZ2      LYS  49  53.414  -5.566   8.097
  448    H    ASP  50           HN       ASP  50  50.754  -1.239   3.887
  449    HA   ASP  50           HA       ASP  50  51.302  -3.624   2.351
  450   1HB   ASP  50           HB2      ASP  50  49.010  -2.677   3.017
  451   2HB   ASP  50           HB1      ASP  50  49.220  -1.544   1.681
  452    H    VAL  51           HN       VAL  51  51.558  -0.120   1.639
  453    HA   VAL  51           HA       VAL  51  52.225  -0.687  -1.167
  454    HB   VAL  51           HB       VAL  51  51.053   1.404  -0.549
  455   1HG1  VAL  51          HG11      VAL  51  53.197   1.547   1.397
  456   2HG1  VAL  51          HG13      VAL  51  53.132   3.025   0.441
  457   3HG1  VAL  51          HG12      VAL  51  51.705   2.478   1.318
  458   1HG2  VAL  51          HG23      VAL  51  53.075   1.101  -2.379
  459   2HG2  VAL  51          HG22      VAL  51  52.064   2.540  -2.246
  460   3HG2  VAL  51          HG21      VAL  51  53.644   2.497  -1.462
  461    H    VAL  52           HN       VAL  52  53.907  -0.305   1.859
  462    HA   VAL  52           HA       VAL  52  56.499   0.212   0.672
  463    HB   VAL  52           HB       VAL  52  55.488   0.586   3.155
  464   1HG1  VAL  52          HG12      VAL  52  55.544  -1.959   3.525
  465   2HG1  VAL  52          HG11      VAL  52  57.297  -1.783   3.613
  466   3HG1  VAL  52          HG13      VAL  52  56.266  -0.945   4.774
  467   1HG2  VAL  52          HG22      VAL  52  57.792   1.157   1.894
  468   2HG2  VAL  52          HG21      VAL  52  57.544   1.472   3.611
  469   3HG2  VAL  52          HG23      VAL  52  58.403   0.021   3.097
  470    NH1  ARG  53           NH2      ARG  53  55.399 -10.374   0.971
  471    NH2  ARG  53           NH1      ARG  53  57.318 -10.266   2.159
  472    H    ARG  53           HN       ARG  53  54.628  -2.637   1.513
  473    HA   ARG  53           HA       ARG  53  56.896  -4.464   1.207
  474   1HB   ARG  53           HB2      ARG  53  54.588  -4.721   2.543
  475   2HB   ARG  53           HB1      ARG  53  54.090  -5.454   1.018
  476   1HG   ARG  53           HG2      ARG  53  56.730  -6.275   2.146
  477   2HG   ARG  53           HG1      ARG  53  55.278  -6.892   2.934
  478   1HD   ARG  53           HD2      ARG  53  54.579  -8.055   1.035
  479   2HD   ARG  53           HD1      ARG  53  55.497  -7.018  -0.057
  480    HE   ARG  53           HE       ARG  53  57.536  -8.206   0.641
  481   1HH1  ARG  53          HH21      ARG  53  54.738  -9.950   0.353
  482   2HH1  ARG  53          HH22      ARG  53  55.252 -11.309   1.295
  483   1HH2  ARG  53          HH11      ARG  53  58.128  -9.758   2.453
  484   2HH2  ARG  53          HH12      ARG  53  57.171 -11.202   2.480
  485    H    VAL  54           HN       VAL  54  54.109  -3.449  -0.767
  486    HA   VAL  54           HA       VAL  54  54.552  -5.275  -2.931
  487    HB   VAL  54           HB       VAL  54  53.382  -2.475  -3.064
  488   1HG1  VAL  54          HG11      VAL  54  53.381  -4.863  -4.900
  489   2HG1  VAL  54          HG13      VAL  54  52.042  -3.716  -4.934
  490   3HG1  VAL  54          HG12      VAL  54  53.681  -3.169  -5.287
  491   1HG2  VAL  54          HG23      VAL  54  52.456  -4.363  -1.410
  492   2HG2  VAL  54          HG22      VAL  54  51.362  -3.322  -2.318
  493   3HG2  VAL  54          HG21      VAL  54  51.712  -4.951  -2.895
  494    CH2  TRP  55           CH2      TRP  55  62.784   0.525  -1.939
  495    H    TRP  55           HN       TRP  55  55.772  -1.954  -2.375
  496    HA   TRP  55           HA       TRP  55  57.261  -1.901  -4.847
  497   1HB   TRP  55           HB2      TRP  55  56.851   0.232  -3.826
  498   2HB   TRP  55           HB1      TRP  55  57.509  -0.300  -2.281
  499    HD1  TRP  55           HD1      TRP  55  58.671   0.593  -5.872
  500    HE1  TRP  55           HE1      TRP  55  61.179   1.182  -5.766
  501    HE3  TRP  55           HE3      TRP  55  59.681  -0.502  -0.978
  502    HZ2  TRP  55           HZ2      TRP  55  63.294   1.197  -3.912
  503    HZ3  TRP  55           HZ3      TRP  55  61.976  -0.212  -0.095
  504    HH2  TRP  55           HH2      TRP  55  63.779   0.657  -1.545
  505    H    PHE  56           HN       PHE  56  58.001  -3.002  -1.525
  506    HA   PHE  56           HA       PHE  56  60.734  -3.613  -2.361
  507   1HB   PHE  56           HB2      PHE  56  59.760  -2.995   0.101
  508   2HB   PHE  56           HB1      PHE  56  59.832  -4.756   0.213
  509    HD1  PHE  56           HD1      PHE  56  61.972  -2.270  -1.585
  510    HD2  PHE  56           HD2      PHE  56  61.814  -5.366   1.375
  511    HE1  PHE  56           HE1      PHE  56  64.420  -2.134  -1.341
  512    HE2  PHE  56           HE2      PHE  56  64.286  -5.245   1.610
  513    HZ   PHE  56           HZ       PHE  56  65.575  -3.627   0.229
  514    H    CYS  57           HN       CYS  57  57.922  -5.126  -3.021
  515    HA   CYS  57           HA       CYS  57  58.829  -7.875  -2.562
  516   1HB   CYS  57           HB2      CYS  57  56.350  -6.675  -3.198
  517   2HB   CYS  57           HB1      CYS  57  56.800  -7.561  -4.654
  518    HG   CYS  57           HG       CYS  57  56.787  -9.762  -3.331
  519    H    ASN  58           HN       ASN  58  58.645  -5.498  -5.150
  520    HA   ASN  58           HA       ASN  58  60.013  -7.253  -7.076
  521   1HB   ASN  58           HB2      ASN  58  58.313  -5.194  -7.446
  522   2HB   ASN  58           HB1      ASN  58  59.841  -4.315  -7.540
  523   1HD2  ASN  58          HD22      ASN  58  58.895  -5.747 -10.929
  524   2HD2  ASN  58          HD21      ASN  58  58.027  -4.814  -9.808
  525    NH1  ARG  59           NH1      ARG  59  63.984  -2.042  -7.894
  526    NH2  ARG  59           NH2      ARG  59  66.033  -2.986  -7.980
  527    H    ARG  59           HN       ARG  59  60.808  -4.563  -4.892
  528    HA   ARG  59           HA       ARG  59  63.503  -4.187  -5.867
  529   1HB   ARG  59           HB2      ARG  59  61.887  -3.023  -3.786
  530   2HB   ARG  59           HB1      ARG  59  63.403  -3.543  -3.062
  531   1HG   ARG  59           HG2      ARG  59  63.099  -1.746  -5.477
  532   2HG   ARG  59           HG1      ARG  59  63.606  -1.264  -3.866
  533   1HD   ARG  59           HD2      ARG  59  65.724  -2.049  -4.142
  534   2HD   ARG  59           HD1      ARG  59  65.197  -3.458  -5.058
  535    HE   ARG  59           HE       ARG  59  65.928  -0.848  -6.178
  536   1HH1  ARG  59          HH11      ARG  59  63.312  -1.470  -7.425
  537   2HH1  ARG  59          HH12      ARG  59  63.757  -2.460  -8.774
  538   1HH2  ARG  59          HH21      ARG  59  66.935  -3.139  -7.576
  539   2HH2  ARG  59          HH22      ARG  59  65.804  -3.398  -8.862
  540    NH1  ARG  60           NH2      ARG  60  61.213 -10.753   2.231
  541    NH2  ARG  60           NH1      ARG  60  63.432 -11.114   2.447
  542    H    ARG  60           HN       ARG  60  61.973  -6.506  -3.741
  543    HA   ARG  60           HA       ARG  60  64.442  -7.443  -2.515
  544   1HB   ARG  60           HB2      ARG  60  61.580  -8.211  -2.523
  545   2HB   ARG  60           HB1      ARG  60  62.711  -9.544  -2.292
  546   1HG   ARG  60           HG2      ARG  60  63.830  -8.178  -0.490
  547   2HG   ARG  60           HG1      ARG  60  62.514  -7.013  -0.639
  548   1HD   ARG  60           HD2      ARG  60  61.032  -8.360   0.439
  549   2HD   ARG  60           HD1      ARG  60  61.635  -9.818  -0.349
  550    HE   ARG  60           HE       ARG  60  63.375  -8.647   1.731
  551   1HH1  ARG  60          HH21      ARG  60  60.454 -10.186   1.909
  552   2HH1  ARG  60          HH22      ARG  60  61.027 -11.609   2.713
  553   1HH2  ARG  60          HH11      ARG  60  64.376 -10.824   2.291
  554   2HH2  ARG  60          HH12      ARG  60  63.245 -11.970   2.929
  555    H    GLN  61           HN       GLN  61  62.281  -8.676  -5.080
  556    HA   GLN  61           HA       GLN  61  64.438 -10.525  -5.948
  557   1HB   GLN  61           HB2      GLN  61  62.095 -11.397  -5.651
  558   2HB   GLN  61           HB1      GLN  61  61.582 -10.325  -6.954
  559   1HG   GLN  61           HG2      GLN  61  62.002 -12.264  -8.157
  560   2HG   GLN  61           HG1      GLN  61  63.582 -11.484  -8.252
  561   1HE2  GLN  61          HE22      GLN  61  63.132 -14.861  -5.984
  562   2HE2  GLN  61          HE21      GLN  61  61.764 -14.051  -6.579
  563    H    LYS  62           HN       LYS  62  65.268  -8.094  -6.427
  564    HA   LYS  62           HA       LYS  62  64.384  -7.087  -9.035
  565   1HB   LYS  62           HB2      LYS  62  66.193  -5.418  -8.688
  566   2HB   LYS  62           HB1      LYS  62  65.090  -5.505  -7.316
  567   1HG   LYS  62           HG2      LYS  62  66.839  -5.923  -5.966
  568   2HG   LYS  62           HG1      LYS  62  67.119  -7.433  -6.830
  569   1HD   LYS  62           HD2      LYS  62  68.702  -6.460  -8.271
  570   2HD   LYS  62           HD1      LYS  62  68.129  -4.823  -7.945
  571   1HE   LYS  62           HE2      LYS  62  68.856  -5.385  -5.472
  572   2HE   LYS  62           HE1      LYS  62  69.877  -6.587  -6.261
  573   1HZ   LYS  62           HZ1      LYS  62  69.824  -3.711  -6.990
  574   2HZ   LYS  62           HZ3      LYS  62  70.962  -4.404  -5.940
  575   3HZ   LYS  62           HZ2      LYS  62  70.900  -4.893  -7.566
  576    H    GLY  63           HN       GLY  63  66.880  -9.184  -7.772
  577   1HA   GLY  63           HA2      GLY  63  67.657 -10.691  -9.776
  578   2HA   GLY  63           HA1      GLY  63  68.293  -9.165 -10.392
  579    H    LYS  64           HN       LYS  64  68.264 -10.738  -7.177
  580    HA   LYS  64           HA       LYS  64  71.141 -10.017  -6.900
  581   1HB   LYS  64           HB2      LYS  64  68.864 -10.186  -5.073
  582   2HB   LYS  64           HB1      LYS  64  70.250 -11.090  -4.466
  583   1HG   LYS  64           HG2      LYS  64  71.581  -9.204  -4.289
  584   2HG   LYS  64           HG1      LYS  64  70.732  -8.356  -5.582
  585   1HD   LYS  64           HD2      LYS  64  69.819  -7.203  -3.826
  586   2HD   LYS  64           HD1      LYS  64  68.716  -8.578  -3.794
  587   1HE   LYS  64           HE2      LYS  64  71.283  -8.428  -2.189
  588   2HE   LYS  64           HE1      LYS  64  69.691  -8.031  -1.546
  589   1HZ   LYS  64           HZ1      LYS  64  68.997 -10.309  -2.286
  590   2HZ   LYS  64           HZ3      LYS  64  70.636 -10.648  -2.560
  591   3HZ   LYS  64           HZ2      LYS  64  70.100 -10.268  -0.994
  592    NH1  ARG  65           NH1      ARG  65  66.181 -17.836  -6.672
  593    NH2  ARG  65           NH2      ARG  65  65.223 -17.681  -8.716
  594    H    ARG  65           HN       ARG  65  70.348 -12.213  -8.597
  595    HA   ARG  65           HA       ARG  65  71.971 -14.325  -7.371
  596   1HB   ARG  65           HB2      ARG  65  70.173 -16.075  -7.838
  597   2HB   ARG  65           HB1      ARG  65  69.875 -15.029  -6.450
  598   1HG   ARG  65           HG2      ARG  65  68.509 -13.547  -8.003
  599   2HG   ARG  65           HG1      ARG  65  68.637 -14.830  -9.207
  600   1HD   ARG  65           HD2      ARG  65  67.761 -15.646  -6.484
  601   2HD   ARG  65           HD1      ARG  65  66.610 -14.708  -7.436
  602    HE   ARG  65           HE       ARG  65  67.645 -16.775  -9.095
  603   1HH1  ARG  65          HH11      ARG  65  66.916 -17.590  -6.040
  604   2HH1  ARG  65          HH12      ARG  65  65.446 -18.443  -6.372
  605   1HH2  ARG  65          HH21      ARG  65  65.225 -17.318  -9.647
  606   2HH2  ARG  65          HH22      ARG  65  64.486 -18.289  -8.418
  607    H    SER  66           HN       SER  66  73.221 -13.565  -9.265
  608    HA   SER  66           HA       SER  66  72.410 -15.061 -11.706
  609   1HB   SER  66           HB2      SER  66  71.749 -12.825 -12.263
  610   2HB   SER  66           HB1      SER  66  73.226 -12.148 -11.581
  611    HG   SER  66           HG       SER  66  73.297 -12.332 -13.875
  612    H    SER  67           HN       SER  67  74.213 -15.757 -12.977
  613    HA   SER  67           HA       SER  67  76.847 -15.507 -11.577
  614   1HB   SER  67           HB2      SER  67  77.313 -17.705 -12.890
  615   2HB   SER  67           HB1      SER  67  76.291 -17.789 -11.459
  616    HG   SER  67           HG       SER  67  74.564 -18.088 -12.694
   
  Start of MODEL          12
 Raw file had  616 H/Q atoms
  Start of MODEL   12
    1   1H    MET   1           HT3      MET   1  48.014   9.297  19.507
    2   2H    MET   1           HT2      MET   1  49.241   8.871  20.603
    3   3H    MET   1           HT1      MET   1  47.826   9.630  21.160
    4    HA   MET   1           HA       MET   1  48.420  11.685  20.364
    5   1HB   MET   1           HB2      MET   1  50.944  10.186  21.110
    6   2HB   MET   1           HB1      MET   1  50.891  11.936  20.894
    7   1HG   MET   1           HG2      MET   1  48.790  11.677  22.541
    8   2HG   MET   1           HG1      MET   1  49.699  10.255  23.051
    9   1HE   MET   1           HE1      MET   1  49.028  13.750  23.160
   10   2HE   MET   1           HE3      MET   1  50.414  14.613  23.842
   11   3HE   MET   1           HE2      MET   1  50.403  14.164  22.139
   12    H    GLU   2           HN       GLU   2  50.542   9.241  18.842
   13    HA   GLU   2           HA       GLU   2  50.445  10.883  16.349
   14   1HB   GLU   2           HB2      GLU   2  52.863   9.491  17.539
   15   2HB   GLU   2           HB1      GLU   2  52.815  10.191  15.920
   16   1HG   GLU   2           HG2      GLU   2  51.885  12.285  17.406
   17   2HG   GLU   2           HG1      GLU   2  52.995  11.533  18.553
   18    H    THR   3           HN       THR   3  48.938   8.473  17.266
   19    HA   THR   3           HA       THR   3  50.001   6.346  15.493
   20    HB   THR   3           HB       THR   3  47.449   6.212  17.100
   21    HG1  THR   3           HG1      THR   3  48.697   5.487  18.812
   22   1HG2  THR   3          HG23      THR   3  49.359   4.291  15.816
   23   2HG2  THR   3          HG22      THR   3  48.438   3.772  17.228
   24   3HG2  THR   3          HG21      THR   3  47.597   4.308  15.773
   25    H    LEU   4           HN       LEU   4  49.272   6.162  13.439
   26    HA   LEU   4           HA       LEU   4  47.090   7.882  12.509
   27   1HB   LEU   4           HB2      LEU   4  49.314   6.420  11.326
   28   2HB   LEU   4           HB1      LEU   4  47.828   6.137  10.425
   29    HG   LEU   4           HG       LEU   4  49.058   8.108   9.566
   30   1HD1  LEU   4          HD12      LEU   4  46.519   7.945   9.571
   31   2HD1  LEU   4          HD11      LEU   4  46.537   9.003  10.981
   32   3HD1  LEU   4          HD13      LEU   4  47.174   9.577   9.440
   33   1HD2  LEU   4          HD21      LEU   4  49.898   8.655  11.990
   34   2HD2  LEU   4          HD23      LEU   4  49.568   9.985  10.878
   35   3HD2  LEU   4          HD22      LEU   4  48.389   9.559  12.118
   36    H    VAL   5           HN       VAL   5  45.028   7.222  12.827
   37    HA   VAL   5           HA       VAL   5  44.430   4.299  12.749
   38    HB   VAL   5           HB       VAL   5  42.650   6.540  13.751
   39   1HG1  VAL   5          HG13      VAL   5  42.553   3.543  13.726
   40   2HG1  VAL   5          HG12      VAL   5  41.814   4.407  15.075
   41   3HG1  VAL   5          HG11      VAL   5  41.259   4.705  13.427
   42   1HG2  VAL   5          HG21      VAL   5  44.813   6.369  15.022
   43   2HG2  VAL   5          HG23      VAL   5  43.398   5.967  15.996
   44   3HG2  VAL   5          HG22      VAL   5  44.427   4.682  15.364
   45    H    GLN   6           HN       GLN   6  44.819   6.059  10.366
   46    HA   GLN   6           HA       GLN   6  42.124   5.642   9.139
   47   1HB   GLN   6           HB2      GLN   6  44.014   7.985   8.871
   48   2HB   GLN   6           HB1      GLN   6  42.800   7.635   7.640
   49   1HG   GLN   6           HG2      GLN   6  41.023   7.755   9.345
   50   2HG   GLN   6           HG1      GLN   6  42.231   8.087  10.586
   51   1HE2  GLN   6          HE22      GLN   6  41.277  11.474   9.824
   52   2HE2  GLN   6          HE21      GLN   6  40.912  10.171  10.849
   53    H    ALA   7           HN       ALA   7  44.417   3.848   9.185
   54    HA   ALA   7           HA       ALA   7  45.724   4.041   6.589
   55   1HB   ALA   7           HB1      ALA   7  46.736   3.023   8.708
   56   2HB   ALA   7           HB3      ALA   7  45.686   1.636   8.416
   57   3HB   ALA   7           HB2      ALA   7  46.915   2.077   7.230
   58    NH1  ARG   8           NH2      ARG   8  41.097   7.138   2.379
   59    NH2  ARG   8           NH1      ARG   8  39.343   7.870   3.602
   60    H    ARG   8           HN       ARG   8  43.776   4.027   5.231
   61    HA   ARG   8           HA       ARG   8  42.060   1.674   5.244
   62   1HB   ARG   8           HB2      ARG   8  42.242   4.192   3.631
   63   2HB   ARG   8           HB1      ARG   8  41.321   2.833   2.988
   64   1HG   ARG   8           HG2      ARG   8  39.614   3.205   4.416
   65   2HG   ARG   8           HG1      ARG   8  40.702   3.276   5.802
   66   1HD   ARG   8           HD2      ARG   8  39.637   5.426   5.639
   67   2HD   ARG   8           HD1      ARG   8  41.298   5.633   5.082
   68    HE   ARG   8           HE       ARG   8  39.322   5.074   2.971
   69   1HH1  ARG   8          HH21      ARG   8  41.672   6.388   2.052
   70   2HH1  ARG   8          HH22      ARG   8  41.289   8.077   2.093
   71   1HH2  ARG   8          HH11      ARG   8  38.574   7.681   4.213
   72   2HH2  ARG   8          HH12      ARG   8  39.535   8.809   3.316
   73    H    LYS   9           HN       LYS   9  41.783   0.405   3.151
   74    HA   LYS   9           HA       LYS   9  44.452  -0.301   2.113
   75   1HB   LYS   9           HB2      LYS   9  42.669  -1.978   3.063
   76   2HB   LYS   9           HB1      LYS   9  41.952  -1.825   1.459
   77   1HG   LYS   9           HG2      LYS   9  44.293  -2.319   0.533
   78   2HG   LYS   9           HG1      LYS   9  44.717  -2.812   2.174
   79   1HD   LYS   9           HD2      LYS   9  44.030  -4.833   1.202
   80   2HD   LYS   9           HD1      LYS   9  42.566  -4.287   2.021
   81   1HE   LYS   9           HE2      LYS   9  41.821  -3.235  -0.126
   82   2HE   LYS   9           HE1      LYS   9  43.226  -3.945  -0.919
   83   1HZ   LYS   9           HZ1      LYS   9  41.422  -5.660   0.644
   84   2HZ   LYS   9           HZ3      LYS   9  40.972  -5.194  -0.923
   85   3HZ   LYS   9           HZ2      LYS   9  42.413  -6.060  -0.677
   86    NH1  ARG  10           NH1      ARG  10  38.038   3.897  -2.424
   87    NH2  ARG  10           NH2      ARG  10  36.737   2.128  -2.957
   88    H    ARG  10           HN       ARG  10  43.277   2.125   1.167
   89    HA   ARG  10           HA       ARG  10  43.380   1.619  -1.691
   90   1HB   ARG  10           HB2      ARG  10  40.811   1.879  -0.323
   91   2HB   ARG  10           HB1      ARG  10  41.018   3.123  -1.555
   92   1HG   ARG  10           HG2      ARG  10  41.447   1.467  -3.256
   93   2HG   ARG  10           HG1      ARG  10  41.500   0.175  -2.055
   94   1HD   ARG  10           HD2      ARG  10  39.323  -0.019  -2.903
   95   2HD   ARG  10           HD1      ARG  10  39.081   0.971  -1.463
   96    HE   ARG  10           HE       ARG  10  39.393   2.253  -4.143
   97   1HH1  ARG  10          HH11      ARG  10  38.941   4.324  -2.373
   98   2HH1  ARG  10          HH12      ARG  10  37.230   4.400  -2.119
   99   1HH2  ARG  10          HH21      ARG  10  36.642   1.199  -3.314
  100   2HH2  ARG  10          HH22      ARG  10  35.928   2.631  -2.652
  101    H    LYS  11           HN       LYS  11  44.890   3.142   0.250
  102    HA   LYS  11           HA       LYS  11  44.169   5.944  -0.123
  103   1HB   LYS  11           HB2      LYS  11  45.338   4.842   1.932
  104   2HB   LYS  11           HB1      LYS  11  46.806   5.007   0.966
  105   1HG   LYS  11           HG2      LYS  11  46.609   7.368   0.866
  106   2HG   LYS  11           HG1      LYS  11  44.929   7.330   1.404
  107   1HD   LYS  11           HD2      LYS  11  45.821   6.290   3.578
  108   2HD   LYS  11           HD1      LYS  11  47.419   6.798   3.030
  109   1HE   LYS  11           HE2      LYS  11  46.627   9.125   2.852
  110   2HE   LYS  11           HE1      LYS  11  45.025   8.623   3.393
  111   1HZ   LYS  11           HZ3      LYS  11  47.509   8.233   4.966
  112   2HZ   LYS  11           HZ2      LYS  11  46.443   9.538   5.179
  113   3HZ   LYS  11           HZ1      LYS  11  45.919   7.951   5.484
  114    NH1  ARG  12           NH1      ARG  12  43.759   3.248  -8.018
  115    NH2  ARG  12           NH2      ARG  12  45.762   2.558  -8.808
  116    H    ARG  12           HN       ARG  12  44.424   6.566  -2.250
  117    HA   ARG  12           HA       ARG  12  47.098   6.070  -3.510
  118   1HB   ARG  12           HB2      ARG  12  44.883   5.280  -4.634
  119   2HB   ARG  12           HB1      ARG  12  44.652   6.988  -5.012
  120   1HG   ARG  12           HG2      ARG  12  46.727   7.076  -6.234
  121   2HG   ARG  12           HG1      ARG  12  47.180   5.461  -5.688
  122   1HD   ARG  12           HD2      ARG  12  44.602   5.819  -7.176
  123   2HD   ARG  12           HD1      ARG  12  46.115   5.797  -8.080
  124    HE   ARG  12           HE       ARG  12  46.147   3.570  -6.328
  125   1HH1  ARG  12          HH11      ARG  12  43.224   3.793  -7.373
  126   2HH1  ARG  12          HH12      ARG  12  43.296   2.687  -8.704
  127   1HH2  ARG  12          HH21      ARG  12  46.761   2.573  -8.768
  128   2HH2  ARG  12          HH22      ARG  12  45.298   1.997  -9.494
  129    H    THR  13           HN       THR  13  45.548   8.423  -1.785
  130    HA   THR  13           HA       THR  13  46.174  10.721  -3.467
  131    HB   THR  13           HB       THR  13  45.708  11.963  -1.280
  132    HG1  THR  13           HG1      THR  13  45.512  10.803   0.436
  133   1HG2  THR  13          HG21      THR  13  44.014  11.519  -3.078
  134   2HG2  THR  13          HG23      THR  13  43.550  10.055  -2.208
  135   3HG2  THR  13          HG22      THR  13  43.316  11.635  -1.462
  136    H    SER  14           HN       SER  14  47.756   8.785  -1.008
  137    HA   SER  14           HA       SER  14  50.146  10.541  -1.281
  138   1HB   SER  14           HB2      SER  14  49.277  10.814   0.977
  139   2HB   SER  14           HB1      SER  14  49.190   9.068   1.188
  140    HG   SER  14           HG       SER  14  51.565  10.532   0.646
  141    H    ILE  15           HN       ILE  15  49.210   8.023  -2.645
  142    HA   ILE  15           HA       ILE  15  51.795   6.675  -2.532
  143    HB   ILE  15           HB       ILE  15  49.221   5.203  -1.852
  144   1HG1  ILE  15          HG12      ILE  15  50.446   6.282   0.035
  145   2HG1  ILE  15          HG11      ILE  15  50.431   4.528   0.167
  146   1HG2  ILE  15          HG22      ILE  15  51.425   4.193  -3.378
  147   2HG2  ILE  15          HG21      ILE  15  51.513   3.455  -1.783
  148   3HG2  ILE  15          HG23      ILE  15  50.047   3.296  -2.749
  149   1HD1  ILE  15          HD12      ILE  15  52.710   4.490  -0.919
  150   2HD1  ILE  15          HD11      ILE  15  52.726   6.249  -0.828
  151   3HD1  ILE  15          HD13      ILE  15  52.687   5.290   0.648
  152    H    GLU  16           HN       GLU  16  51.109   8.165  -4.531
  153    HA   GLU  16           HA       GLU  16  49.541   6.827  -6.566
  154   1HB   GLU  16           HB2      GLU  16  50.961   9.376  -6.259
  155   2HB   GLU  16           HB1      GLU  16  51.124   8.698  -7.879
  156   1HG   GLU  16           HG2      GLU  16  48.690   8.498  -8.073
  157   2HG   GLU  16           HG1      GLU  16  48.490   9.095  -6.425
  158    H    ASN  17           HN       ASN  17  50.943   6.785  -8.850
  159    HA   ASN  17           HA       ASN  17  52.642   4.501  -8.587
  160   1HB   ASN  17           HB2      ASN  17  51.864   6.358 -10.783
  161   2HB   ASN  17           HB1      ASN  17  53.344   5.428 -11.020
  162   1HD2  ASN  17          HD22      ASN  17  51.650   2.282 -11.218
  163   2HD2  ASN  17          HD21      ASN  17  53.144   3.016 -10.884
  164    NH1  ARG  18           NH1      ARG  18  53.144  12.079 -10.113
  165    NH2  ARG  18           NH2      ARG  18  53.219  14.077  -9.057
  166    H    ARG  18           HN       ARG  18  53.262   7.935  -8.467
  167    HA   ARG  18           HA       ARG  18  56.120   7.741  -8.914
  168   1HB   ARG  18           HB2      ARG  18  56.161  10.065  -7.987
  169   2HB   ARG  18           HB1      ARG  18  54.990   9.872  -9.292
  170   1HG   ARG  18           HG2      ARG  18  53.157   9.763  -7.752
  171   2HG   ARG  18           HG1      ARG  18  54.242   9.591  -6.373
  172   1HD   ARG  18           HD2      ARG  18  54.131  11.831  -6.133
  173   2HD   ARG  18           HD1      ARG  18  55.058  11.968  -7.627
  174    HE   ARG  18           HE       ARG  18  52.084  12.119  -7.444
  175   1HH1  ARG  18          HH11      ARG  18  53.058  11.083 -10.078
  176   2HH1  ARG  18          HH12      ARG  18  53.258  12.540 -10.994
  177   1HH2  ARG  18          HH21      ARG  18  53.190  14.611  -8.213
  178   2HH2  ARG  18          HH22      ARG  18  53.332  14.538  -9.937
  179    H    VAL  19           HN       VAL  19  54.002   7.409  -6.129
  180    HA   VAL  19           HA       VAL  19  56.017   7.757  -4.118
  181    HB   VAL  19           HB       VAL  19  53.323   7.448  -3.955
  182   1HG1  VAL  19          HG12      VAL  19  54.465   4.718  -3.213
  183   2HG1  VAL  19          HG11      VAL  19  52.904   5.291  -2.712
  184   3HG1  VAL  19          HG13      VAL  19  53.220   5.052  -4.413
  185   1HG2  VAL  19          HG23      VAL  19  55.316   8.049  -2.268
  186   2HG2  VAL  19          HG22      VAL  19  53.677   7.747  -1.696
  187   3HG2  VAL  19          HG21      VAL  19  54.891   6.470  -1.609
  188    NH1  ARG  20           NH2      ARG  20  53.999   0.070  -9.316
  189    NH2  ARG  20           NH1      ARG  20  51.773   0.127  -8.924
  190    H    ARG  20           HN       ARG  20  54.713   4.868  -5.672
  191    HA   ARG  20           HA       ARG  20  56.326   2.949  -4.398
  192   1HB   ARG  20           HB2      ARG  20  55.011   3.055  -7.098
  193   2HB   ARG  20           HB1      ARG  20  56.028   1.682  -6.659
  194   1HG   ARG  20           HG2      ARG  20  54.639   1.459  -4.550
  195   2HG   ARG  20           HG1      ARG  20  53.534   2.647  -5.242
  196   1HD   ARG  20           HD2      ARG  20  54.271  -0.044  -6.427
  197   2HD   ARG  20           HD1      ARG  20  52.703   0.424  -5.767
  198    HE   ARG  20           HE       ARG  20  53.069   2.284  -7.741
  199   1HH1  ARG  20          HH21      ARG  20  54.927   0.359  -9.082
  200   2HH1  ARG  20          HH22      ARG  20  53.848  -0.553 -10.083
  201   1HH2  ARG  20          HH11      ARG  20  50.996   0.460  -8.388
  202   2HH2  ARG  20          HH12      ARG  20  51.621  -0.496  -9.691
  203    CH2  TRP  21           CH2      TRP  21  58.070  -0.621  -9.608
  204    H    TRP  21           HN       TRP  21  56.985   4.610  -7.495
  205    HA   TRP  21           HA       TRP  21  59.598   3.374  -7.571
  206   1HB   TRP  21           HB2      TRP  21  58.040   5.102  -9.367
  207   2HB   TRP  21           HB1      TRP  21  59.775   5.455  -9.384
  208    HD1  TRP  21           HD1      TRP  21  60.678   4.128 -11.436
  209    HE1  TRP  21           HE1      TRP  21  60.654   1.636 -12.120
  210    HE3  TRP  21           HE3      TRP  21  57.377   2.272  -8.011
  211    HZ2  TRP  21           HZ2      TRP  21  59.405  -0.824 -11.276
  212    HZ3  TRP  21           HZ3      TRP  21  56.811  -0.100  -7.931
  213    HH2  TRP  21           HH2      TRP  21  57.825  -1.672  -9.574
  214    H    SER  22           HN       SER  22  58.335   5.957  -5.809
  215    HA   SER  22           HA       SER  22  60.772   7.496  -5.513
  216   1HB   SER  22           HB2      SER  22  58.080   7.641  -4.525
  217   2HB   SER  22           HB1      SER  22  59.158   7.586  -3.133
  218    HG   SER  22           HG       SER  22  59.633   9.575  -3.573
  219    H    LEU  23           HN       LEU  23  59.171   4.732  -3.975
  220    HA   LEU  23           HA       LEU  23  60.981   4.221  -1.824
  221   1HB   LEU  23           HB2      LEU  23  59.550   2.212  -3.610
  222   2HB   LEU  23           HB1      LEU  23  60.280   1.838  -2.072
  223    HG   LEU  23           HG       LEU  23  58.228   3.998  -2.114
  224   1HD1  LEU  23          HD13      LEU  23  57.599   1.735  -3.455
  225   2HD1  LEU  23          HD12      LEU  23  57.277   1.181  -1.813
  226   3HD1  LEU  23          HD11      LEU  23  56.426   2.587  -2.451
  227   1HD2  LEU  23          HD23      LEU  23  59.151   1.795  -0.249
  228   2HD2  LEU  23          HD22      LEU  23  59.218   3.538   0.013
  229   3HD2  LEU  23          HD21      LEU  23  57.667   2.700   0.051
  230    H    GLU  24           HN       GLU  24  60.933   3.306  -5.226
  231    HA   GLU  24           HA       GLU  24  63.217   1.658  -5.386
  232   1HB   GLU  24           HB2      GLU  24  61.476   2.485  -7.205
  233   2HB   GLU  24           HB1      GLU  24  62.736   3.671  -7.546
  234   1HG   GLU  24           HG2      GLU  24  64.290   1.505  -7.453
  235   2HG   GLU  24           HG1      GLU  24  62.781   0.705  -7.893
  236    H    THR  25           HN       THR  25  63.147   5.207  -5.917
  237    HA   THR  25           HA       THR  25  65.948   5.513  -6.261
  238    HB   THR  25           HB       THR  25  64.428   7.680  -4.876
  239    HG1  THR  25           HG1      THR  25  63.323   8.120  -6.790
  240   1HG2  THR  25          HG23      THR  25  66.805   7.794  -5.857
  241   2HG2  THR  25          HG22      THR  25  66.022   7.761  -7.437
  242   3HG2  THR  25          HG21      THR  25  65.687   9.079  -6.314
  243    H    MET  26           HN       MET  26  64.031   5.172  -3.344
  244    HA   MET  26           HA       MET  26  66.163   6.093  -1.567
  245   1HB   MET  26           HB2      MET  26  63.555   4.638  -1.080
  246   2HB   MET  26           HB1      MET  26  64.651   5.116   0.216
  247   1HG   MET  26           HG2      MET  26  64.511   7.481  -0.646
  248   2HG   MET  26           HG1      MET  26  63.256   6.940  -1.760
  249   1HE   MET  26           HE1      MET  26  64.627   7.371   1.493
  250   2HE   MET  26           HE3      MET  26  63.413   8.555   1.995
  251   3HE   MET  26           HE2      MET  26  63.430   6.948   2.715
  252    H    PHE  27           HN       PHE  27  65.153   2.997  -2.891
  253    HA   PHE  27           HA       PHE  27  66.905   1.515  -1.041
  254   1HB   PHE  27           HB2      PHE  27  64.888   0.717  -3.138
  255   2HB   PHE  27           HB1      PHE  27  66.041  -0.451  -2.507
  256    HD1  PHE  27           HD1      PHE  27  66.253  -0.607   0.096
  257    HD2  PHE  27           HD2      PHE  27  62.915   1.160  -1.943
  258    HE1  PHE  27           HE1      PHE  27  64.864  -0.873   2.134
  259    HE2  PHE  27           HE2      PHE  27  61.525   0.891   0.088
  260    HZ   PHE  27           HZ       PHE  27  62.498  -0.121   2.128
  261    H    LEU  28           HN       LEU  28  67.189   2.972  -4.136
  262    HA   LEU  28           HA       LEU  28  69.245   1.065  -5.041
  263   1HB   LEU  28           HB2      LEU  28  68.102   3.553  -6.331
  264   2HB   LEU  28           HB1      LEU  28  69.302   2.498  -7.081
  265    HG   LEU  28           HG       LEU  28  66.579   1.585  -6.106
  266   1HD1  LEU  28          HD11      LEU  28  67.556   2.626  -8.718
  267   2HD1  LEU  28          HD13      LEU  28  66.488   1.222  -8.766
  268   3HD1  LEU  28          HD12      LEU  28  65.947   2.716  -8.000
  269   1HD2  LEU  28          HD21      LEU  28  68.938   0.230  -7.378
  270   2HD2  LEU  28          HD23      LEU  28  67.919  -0.321  -6.048
  271   3HD2  LEU  28          HD22      LEU  28  67.312  -0.374  -7.703
  272    H    LYS  29           HN       LYS  29  69.627   2.953  -2.666
  273    HA   LYS  29           HA       LYS  29  72.022   4.417  -3.685
  274   1HB   LYS  29           HB2      LYS  29  71.905   5.760  -1.643
  275   2HB   LYS  29           HB1      LYS  29  70.334   5.782  -2.438
  276   1HG   LYS  29           HG2      LYS  29  69.702   3.823  -0.892
  277   2HG   LYS  29           HG1      LYS  29  71.158   4.218   0.019
  278   1HD   LYS  29           HD2      LYS  29  70.002   6.694  -0.256
  279   2HD   LYS  29           HD1      LYS  29  68.583   5.655  -0.128
  280   1HE   LYS  29           HE2      LYS  29  70.866   5.283   1.789
  281   2HE   LYS  29           HE1      LYS  29  69.705   6.583   2.058
  282   1HZ   LYS  29           HZ1      LYS  29  67.988   4.707   1.659
  283   2HZ   LYS  29           HZ3      LYS  29  69.273   3.676   2.061
  284   3HZ   LYS  29           HZ2      LYS  29  68.743   4.845   3.174
  285    H    CYS  30           HN       CYS  30  70.848   2.183  -1.235
  286    HA   CYS  30           HA       CYS  30  73.574   1.078  -0.969
  287   1HB   CYS  30           HB2      CYS  30  71.768   1.799   1.360
  288   2HB   CYS  30           HB1      CYS  30  73.303   0.942   1.489
  289    HG   CYS  30           HG       CYS  30  74.299   3.209   1.631
  290    HA   PRO  31           HA       PRO  31  70.863  -2.510  -1.307
  291   1HB   PRO  31           HB2      PRO  31  72.827  -4.406  -1.446
  292   2HB   PRO  31           HB1      PRO  31  72.416  -3.354  -2.812
  293   1HG   PRO  31           HG2      PRO  31  74.801  -3.272  -1.039
  294   2HG   PRO  31           HG1      PRO  31  74.610  -2.658  -2.689
  295   1HD   PRO  31           HD2      PRO  31  74.528  -1.132  -0.268
  296   2HD   PRO  31           HD1      PRO  31  74.174  -0.552  -1.909
  297    H    LYS  32           HN       LYS  32  71.994  -1.448   1.438
  298    HA   LYS  32           HA       LYS  32  71.884  -4.066   2.833
  299   1HB   LYS  32           HB2      LYS  32  73.325  -3.012   4.567
  300   2HB   LYS  32           HB1      LYS  32  74.101  -3.080   2.983
  301   1HG   LYS  32           HG2      LYS  32  74.068  -0.808   2.721
  302   2HG   LYS  32           HG1      LYS  32  72.493  -0.640   3.499
  303   1HD   LYS  32           HD2      LYS  32  73.417  -0.648   5.660
  304   2HD   LYS  32           HD1      LYS  32  74.920  -1.394   5.116
  305   1HE   LYS  32           HE2      LYS  32  75.100   0.817   3.662
  306   2HE   LYS  32           HE1      LYS  32  74.039   1.460   4.915
  307   1HZ   LYS  32           HZ2      LYS  32  76.434  -0.071   5.674
  308   2HZ   LYS  32           HZ1      LYS  32  76.591   1.560   5.223
  309   3HZ   LYS  32           HZ3      LYS  32  75.609   1.136   6.540
  310    HA   PRO  33           HA       PRO  33  68.670  -1.047   4.598
  311   1HB   PRO  33           HB2      PRO  33  66.363  -2.088   3.535
  312   2HB   PRO  33           HB1      PRO  33  67.266  -0.760   2.785
  313   1HG   PRO  33           HG2      PRO  33  67.125  -3.630   1.978
  314   2HG   PRO  33           HG1      PRO  33  67.398  -2.193   0.978
  315   1HD   PRO  33           HD2      PRO  33  69.403  -3.980   1.830
  316   2HD   PRO  33           HD1      PRO  33  69.665  -2.338   1.203
  317    H    SER  34           HN       SER  34  67.992  -1.714   6.617
  318    HA   SER  34           HA       SER  34  67.971  -4.568   7.271
  319   1HB   SER  34           HB2      SER  34  67.928  -2.010   8.777
  320   2HB   SER  34           HB1      SER  34  67.169  -3.399   9.551
  321    HG   SER  34           HG       SER  34  69.820  -3.191   8.551
  322    H    LEU  35           HN       LEU  35  66.117  -5.709   8.048
  323    HA   LEU  35           HA       LEU  35  63.644  -5.004   6.789
  324   1HB   LEU  35           HB2      LEU  35  62.698  -6.906   7.852
  325   2HB   LEU  35           HB1      LEU  35  64.387  -7.336   7.615
  326    HG   LEU  35           HG       LEU  35  63.335  -6.160  10.196
  327   1HD1  LEU  35          HD13      LEU  35  63.754  -9.068   9.449
  328   2HD1  LEU  35          HD12      LEU  35  63.369  -8.478  11.066
  329   3HD1  LEU  35          HD11      LEU  35  62.200  -8.295   9.758
  330   1HD2  LEU  35          HD22      LEU  35  65.891  -7.558   9.364
  331   2HD2  LEU  35          HD21      LEU  35  65.720  -5.918   9.990
  332   3HD2  LEU  35          HD23      LEU  35  65.448  -7.300  11.052
  333    H    GLN  36           HN       GLN  36  65.164  -4.013   9.746
  334    HA   GLN  36           HA       GLN  36  62.746  -3.027  11.063
  335   1HB   GLN  36           HB2      GLN  36  65.187  -3.458  12.043
  336   2HB   GLN  36           HB1      GLN  36  65.444  -1.790  11.526
  337   1HG   GLN  36           HG2      GLN  36  63.513  -1.055  12.841
  338   2HG   GLN  36           HG1      GLN  36  63.183  -2.720  13.321
  339   1HE2  GLN  36          HE22      GLN  36  66.315  -0.711  15.049
  340   2HE2  GLN  36          HE21      GLN  36  65.612  -0.107  13.627
  341    H    GLN  37           HN       GLN  37  65.251  -1.775   8.933
  342    HA   GLN  37           HA       GLN  37  64.291   0.924   8.779
  343   1HB   GLN  37           HB2      GLN  37  66.548   0.060   7.962
  344   2HB   GLN  37           HB1      GLN  37  65.692  -0.612   6.575
  345   1HG   GLN  37           HG2      GLN  37  64.896   1.597   5.936
  346   2HG   GLN  37           HG1      GLN  37  65.614   2.308   7.381
  347   1HE2  GLN  37          HE22      GLN  37  67.919   1.651   4.120
  348   2HE2  GLN  37          HE21      GLN  37  66.252   1.328   4.116
  349    H    ILE  38           HN       ILE  38  63.224  -2.119   7.392
  350    HA   ILE  38           HA       ILE  38  61.642  -0.941   5.272
  351    HB   ILE  38           HB       ILE  38  61.714  -3.692   6.553
  352   1HG1  ILE  38          HG12      ILE  38  63.431  -3.118   4.875
  353   2HG1  ILE  38          HG11      ILE  38  62.337  -4.348   4.246
  354   1HG2  ILE  38          HG22      ILE  38  59.552  -2.496   4.844
  355   2HG2  ILE  38          HG21      ILE  38  60.057  -4.145   4.475
  356   3HG2  ILE  38          HG23      ILE  38  59.437  -3.751   6.079
  357   1HD1  ILE  38          HD11      ILE  38  61.194  -1.825   3.577
  358   2HD1  ILE  38          HD13      ILE  38  62.907  -1.740   3.166
  359   3HD1  ILE  38          HD12      ILE  38  61.898  -3.011   2.480
  360    H    THR  39           HN       THR  39  61.183  -1.772   8.644
  361    HA   THR  39           HA       THR  39  58.345  -1.317   8.772
  362    HB   THR  39           HB       THR  39  60.242  -0.661  11.031
  363    HG1  THR  39           HG1      THR  39  59.427  -3.221  10.122
  364   1HG2  THR  39          HG23      THR  39  57.816  -0.294  11.337
  365   2HG2  THR  39          HG22      THR  39  57.514  -1.979  10.914
  366   3HG2  THR  39          HG21      THR  39  58.407  -1.585  12.383
  367    H    HIS  40           HN       HIS  40  61.192   0.739   9.008
  368    HA   HIS  40           HA       HIS  40  59.750   3.201   9.581
  369   1HB   HIS  40           HB2      HIS  40  62.541   2.481   8.746
  370   2HB   HIS  40           HB1      HIS  40  62.009   4.154   8.578
  371    HD1  HIS  40           HD1      HIS  40  63.017   1.622  11.096
  372    HD2  HIS  40           HD2      HIS  40  61.284   5.414  11.095
  373    HE1  HIS  40           HE1      HIS  40  63.151   2.472  13.479
  374    H    ILE  41           HN       ILE  41  60.494   1.365   6.714
  375    HA   ILE  41           HA       ILE  41  60.115   3.497   4.811
  376    HB   ILE  41           HB       ILE  41  60.578   0.597   4.785
  377   1HG1  ILE  41          HG12      ILE  41  61.422   1.614   2.365
  378   2HG1  ILE  41          HG11      ILE  41  61.448   3.043   3.396
  379   1HG2  ILE  41          HG22      ILE  41  58.645   1.746   2.781
  380   2HG2  ILE  41          HG21      ILE  41  59.709   0.405   2.355
  381   3HG2  ILE  41          HG23      ILE  41  58.541   0.224   3.664
  382   1HD1  ILE  41          HD12      ILE  41  62.665   0.446   4.326
  383   2HD1  ILE  41          HD11      ILE  41  63.576   1.559   3.309
  384   3HD1  ILE  41          HD13      ILE  41  63.000   2.081   4.892
  385    H    ALA  42           HN       ALA  42  58.001   1.019   6.231
  386    HA   ALA  42           HA       ALA  42  55.658   1.696   4.777
  387   1HB   ALA  42           HB2      ALA  42  56.235  -0.324   6.429
  388   2HB   ALA  42           HB1      ALA  42  55.408   0.722   7.583
  389   3HB   ALA  42           HB3      ALA  42  54.569   0.174   6.132
  390    H    ASN  43           HN       ASN  43  56.681   2.638   8.049
  391    HA   ASN  43           HA       ASN  43  54.580   4.539   8.451
  392   1HB   ASN  43           HB2      ASN  43  56.511   3.545  10.052
  393   2HB   ASN  43           HB1      ASN  43  57.257   5.087   9.632
  394   1HD2  ASN  43          HD22      ASN  43  53.786   5.087  11.834
  395   2HD2  ASN  43          HD21      ASN  43  54.198   3.711  10.929
  396    H    GLN  44           HN       GLN  44  57.424   4.560   6.477
  397    HA   GLN  44           HA       GLN  44  57.778   7.411   6.348
  398   1HB   GLN  44           HB2      GLN  44  58.981   5.030   5.194
  399   2HB   GLN  44           HB1      GLN  44  58.889   6.351   4.037
  400   1HG   GLN  44           HG2      GLN  44  60.028   6.609   6.834
  401   2HG   GLN  44           HG1      GLN  44  61.006   6.326   5.394
  402   1HE2  GLN  44          HE22      GLN  44  60.012  10.077   6.266
  403   2HE2  GLN  44          HE21      GLN  44  59.968   8.791   7.374
  404    H    LEU  45           HN       LEU  45  55.877   5.084   4.460
  405    HA   LEU  45           HA       LEU  45  54.778   7.450   2.995
  406   1HB   LEU  45           HB2      LEU  45  54.612   6.243   0.963
  407   2HB   LEU  45           HB1      LEU  45  56.216   5.894   1.589
  408    HG   LEU  45           HG       LEU  45  53.894   4.057   2.141
  409   1HD1  LEU  45          HD11      LEU  45  54.773   4.654  -0.422
  410   2HD1  LEU  45          HD13      LEU  45  55.741   3.243   0.011
  411   3HD1  LEU  45          HD12      LEU  45  53.981   3.158   0.064
  412   1HD2  LEU  45          HD22      LEU  45  56.852   4.087   2.451
  413   2HD2  LEU  45          HD21      LEU  45  55.619   3.359   3.480
  414   3HD2  LEU  45          HD23      LEU  45  56.116   2.551   1.994
  415    H    GLY  46           HN       GLY  46  53.891   5.681   5.418
  416   1HA   GLY  46           HA2      GLY  46  51.846   5.001   6.316
  417   2HA   GLY  46           HA1      GLY  46  51.133   6.138   5.181
  418    H    LEU  47           HN       LEU  47  52.952   3.370   3.961
  419    HA   LEU  47           HA       LEU  47  50.366   2.312   2.922
  420   1HB   LEU  47           HB2      LEU  47  51.418   1.538   1.041
  421   2HB   LEU  47           HB1      LEU  47  52.587   2.776   1.450
  422    HG   LEU  47           HG       LEU  47  52.777  -0.185   2.025
  423   1HD1  LEU  47          HD12      LEU  47  53.380   1.092  -0.271
  424   2HD1  LEU  47          HD11      LEU  47  54.894   1.336   0.598
  425   3HD1  LEU  47          HD13      LEU  47  54.298  -0.297   0.309
  426   1HD2  LEU  47          HD22      LEU  47  54.111   2.088   3.288
  427   2HD2  LEU  47          HD21      LEU  47  54.001   0.419   3.820
  428   3HD2  LEU  47          HD23      LEU  47  55.229   0.894   2.652
  429    H    GLU  48           HN       GLU  48  50.478  -0.227   2.657
  430    HA   GLU  48           HA       GLU  48  50.922  -1.275   5.378
  431   1HB   GLU  48           HB2      GLU  48  48.854  -1.680   3.714
  432   2HB   GLU  48           HB1      GLU  48  49.883  -3.011   3.184
  433   1HG   GLU  48           HG2      GLU  48  49.925  -3.989   5.346
  434   2HG   GLU  48           HG1      GLU  48  49.308  -2.523   6.109
  435    H    LYS  49           HN       LYS  49  52.256  -3.091   5.757
  436    HA   LYS  49           HA       LYS  49  54.709  -3.181   4.323
  437   1HB   LYS  49           HB2      LYS  49  53.424  -5.016   6.339
  438   2HB   LYS  49           HB1      LYS  49  54.976  -5.418   5.605
  439   1HG   LYS  49           HG2      LYS  49  56.074  -3.904   6.875
  440   2HG   LYS  49           HG1      LYS  49  54.905  -2.638   6.502
  441   1HD   LYS  49           HD2      LYS  49  53.428  -3.367   8.249
  442   2HD   LYS  49           HD1      LYS  49  54.356  -4.845   8.502
  443   1HE   LYS  49           HE2      LYS  49  55.929  -2.358   8.753
  444   2HE   LYS  49           HE1      LYS  49  54.674  -2.558   9.974
  445   1HZ   LYS  49           HZ3      LYS  49  55.620  -4.948  10.109
  446   2HZ   LYS  49           HZ2      LYS  49  57.007  -4.256   9.414
  447   3HZ   LYS  49           HZ1      LYS  49  56.424  -3.684  10.905
  448    H    ASP  50           HN       ASP  50  51.675  -4.658   3.576
  449    HA   ASP  50           HA       ASP  50  52.741  -6.936   2.151
  450   1HB   ASP  50           HB2      ASP  50  50.048  -5.587   2.259
  451   2HB   ASP  50           HB1      ASP  50  50.367  -6.881   1.103
  452    H    VAL  51           HN       VAL  51  51.928  -3.582   1.219
  453    HA   VAL  51           HA       VAL  51  52.411  -4.267  -1.620
  454    HB   VAL  51           HB       VAL  51  50.648  -2.641  -1.105
  455   1HG1  VAL  51          HG12      VAL  51  52.761  -1.511   0.581
  456   2HG1  VAL  51          HG11      VAL  51  51.922  -0.299  -0.385
  457   3HG1  VAL  51          HG13      VAL  51  51.012  -1.344   0.705
  458   1HG2  VAL  51          HG21      VAL  51  51.920  -2.402  -3.223
  459   2HG2  VAL  51          HG23      VAL  51  51.361  -0.841  -2.621
  460   3HG2  VAL  51          HG22      VAL  51  53.047  -1.315  -2.411
  461    H    VAL  52           HN       VAL  52  54.102  -2.935   1.123
  462    HA   VAL  52           HA       VAL  52  56.285  -1.818  -0.438
  463    HB   VAL  52           HB       VAL  52  55.368  -1.468   2.138
  464   1HG1  VAL  52          HG12      VAL  52  56.434  -3.605   2.870
  465   2HG1  VAL  52          HG11      VAL  52  58.001  -2.917   2.444
  466   3HG1  VAL  52          HG13      VAL  52  57.034  -2.182   3.722
  467   1HG2  VAL  52          HG21      VAL  52  56.894  -0.073   0.562
  468   2HG2  VAL  52          HG23      VAL  52  57.024   0.162   2.304
  469   3HG2  VAL  52          HG22      VAL  52  58.219  -0.819   1.457
  470    NH1  ARG  53           NH1      ARG  53  53.866  -9.553   2.795
  471    NH2  ARG  53           NH2      ARG  53  54.987 -11.459   3.261
  472    H    ARG  53           HN       ARG  53  55.459  -4.946   0.905
  473    HA   ARG  53           HA       ARG  53  58.186  -6.004   0.636
  474   1HB   ARG  53           HB2      ARG  53  56.250  -6.744   2.282
  475   2HB   ARG  53           HB1      ARG  53  55.781  -7.768   0.925
  476   1HG   ARG  53           HG2      ARG  53  58.406  -8.299   0.926
  477   2HG   ARG  53           HG1      ARG  53  58.227  -7.878   2.629
  478   1HD   ARG  53           HD2      ARG  53  56.617  -9.969   1.135
  479   2HD   ARG  53           HD1      ARG  53  57.885 -10.287   2.317
  480    HE   ARG  53           HE       ARG  53  56.284  -8.922   3.901
  481   1HH1  ARG  53          HH11      ARG  53  53.864  -8.564   2.642
  482   2HH1  ARG  53          HH12      ARG  53  53.011 -10.068   2.745
  483   1HH2  ARG  53          HH21      ARG  53  55.844 -11.932   3.465
  484   2HH2  ARG  53          HH22      ARG  53  54.131 -11.973   3.212
  485    H    VAL  54           HN       VAL  54  55.073  -6.324  -1.084
  486    HA   VAL  54           HA       VAL  54  55.977  -8.214  -3.036
  487    HB   VAL  54           HB       VAL  54  53.885  -6.037  -3.376
  488   1HG1  VAL  54          HG12      VAL  54  54.670  -7.220  -5.457
  489   2HG1  VAL  54          HG11      VAL  54  54.141  -8.738  -4.731
  490   3HG1  VAL  54          HG13      VAL  54  52.963  -7.477  -5.094
  491   1HG2  VAL  54          HG23      VAL  54  53.813  -7.839  -1.395
  492   2HG2  VAL  54          HG22      VAL  54  52.356  -7.379  -2.276
  493   3HG2  VAL  54          HG21      VAL  54  53.206  -8.866  -2.693
  494    CH2  TRP  55           CH2      TRP  55  61.590   0.233  -4.029
  495    H    TRP  55           HN       TRP  55  55.961  -4.634  -3.079
  496    HA   TRP  55           HA       TRP  55  57.137  -4.480  -5.705
  497   1HB   TRP  55           HB2      TRP  55  56.064  -2.487  -4.888
  498   2HB   TRP  55           HB1      TRP  55  57.034  -2.491  -3.416
  499    HD1  TRP  55           HD1      TRP  55  57.448  -1.978  -7.241
  500    HE1  TRP  55           HE1      TRP  55  59.543  -0.528  -7.621
  501    HE3  TRP  55           HE3      TRP  55  59.196  -1.604  -2.450
  502    HZ2  TRP  55           HZ2      TRP  55  61.646   0.623  -6.140
  503    HZ3  TRP  55           HZ3      TRP  55  61.277  -0.346  -1.991
  504    HH2  TRP  55           HH2      TRP  55  62.490   0.786  -3.817
  505    H    PHE  56           HN       PHE  56  58.546  -4.453  -2.392
  506    HA   PHE  56           HA       PHE  56  61.207  -4.321  -3.552
  507   1HB   PHE  56           HB2      PHE  56  60.327  -3.594  -1.091
  508   2HB   PHE  56           HB1      PHE  56  61.021  -5.177  -0.724
  509    HD1  PHE  56           HD2      PHE  56  61.940  -2.483  -3.149
  510    HD2  PHE  56           HD1      PHE  56  63.223  -4.929   0.123
  511    HE1  PHE  56           HE2      PHE  56  64.194  -1.507  -3.329
  512    HE2  PHE  56           HE1      PHE  56  65.504  -3.967  -0.071
  513    HZ   PHE  56           HZ       PHE  56  65.974  -2.260  -1.819
  514    H    CYS  57           HN       CYS  57  59.093  -6.810  -3.521
  515    HA   CYS  57           HA       CYS  57  61.005  -8.927  -2.824
  516   1HB   CYS  57           HB2      CYS  57  58.168  -8.778  -3.715
  517   2HB   CYS  57           HB1      CYS  57  59.065 -10.186  -4.282
  518    HG   CYS  57           HG       CYS  57  58.560  -9.507  -1.277
  519    H    ASN  58           HN       ASN  58  59.728  -7.245  -5.635
  520    HA   ASN  58           HA       ASN  58  61.417  -8.820  -7.474
  521   1HB   ASN  58           HB2      ASN  58  60.456  -7.344  -9.228
  522   2HB   ASN  58           HB1      ASN  58  59.201  -8.123  -8.267
  523   1HD2  ASN  58          HD22      ASN  58  57.769  -5.008  -7.513
  524   2HD2  ASN  58          HD21      ASN  58  57.549  -6.649  -7.885
  525    NH1  ARG  59           NH2      ARG  59  63.382  -1.525  -9.807
  526    NH2  ARG  59           NH1      ARG  59  65.610  -1.160  -9.733
  527    H    ARG  59           HN       ARG  59  61.479  -5.777  -5.713
  528    HA   ARG  59           HA       ARG  59  63.662  -4.634  -7.295
  529   1HB   ARG  59           HB2      ARG  59  61.898  -3.651  -5.248
  530   2HB   ARG  59           HB1      ARG  59  63.543  -3.456  -4.658
  531   1HG   ARG  59           HG2      ARG  59  62.466  -2.437  -7.292
  532   2HG   ARG  59           HG1      ARG  59  62.875  -1.475  -5.877
  533   1HD   ARG  59           HD2      ARG  59  64.915  -1.236  -6.820
  534   2HD   ARG  59           HD1      ARG  59  65.201  -2.899  -6.313
  535    HE   ARG  59           HE       ARG  59  64.820  -3.614  -8.570
  536   1HH1  ARG  59          HH21      ARG  59  62.571  -2.006  -9.474
  537   2HH1  ARG  59          HH22      ARG  59  63.296  -0.843 -10.533
  538   1HH2  ARG  59          HH11      ARG  59  66.508  -1.360  -9.341
  539   2HH2  ARG  59          HH12      ARG  59  65.523  -0.482 -10.462
  540    NH1  ARG  60           NH2      ARG  60  64.612 -12.241  -0.260
  541    NH2  ARG  60           NH1      ARG  60  63.142 -10.909   0.827
  542    H    ARG  60           HN       ARG  60  63.386  -6.824  -4.586
  543    HA   ARG  60           HA       ARG  60  66.168  -6.393  -3.741
  544   1HB   ARG  60           HB2      ARG  60  65.742  -8.185  -2.125
  545   2HB   ARG  60           HB1      ARG  60  64.433  -7.007  -2.084
  546   1HG   ARG  60           HG2      ARG  60  63.117  -8.503  -3.610
  547   2HG   ARG  60           HG1      ARG  60  64.400  -9.701  -3.477
  548   1HD   ARG  60           HD2      ARG  60  62.934  -8.545  -1.095
  549   2HD   ARG  60           HD1      ARG  60  62.491 -10.066  -1.872
  550    HE   ARG  60           HE       ARG  60  65.293  -9.806  -0.963
  551   1HH1  ARG  60          HH21      ARG  60  65.297 -12.369  -0.978
  552   2HH1  ARG  60          HH22      ARG  60  64.368 -13.003   0.339
  553   1HH2  ARG  60          HH11      ARG  60  62.703 -10.018   0.941
  554   2HH2  ARG  60          HH12      ARG  60  62.895 -11.669   1.428
  555    H    GLN  61           HN       GLN  61  64.386  -8.606  -5.804
  556    HA   GLN  61           HA       GLN  61  66.914 -10.133  -6.256
  557   1HB   GLN  61           HB2      GLN  61  64.041 -10.948  -6.781
  558   2HB   GLN  61           HB1      GLN  61  65.458 -11.947  -7.102
  559   1HG   GLN  61           HG2      GLN  61  65.763 -11.109  -4.433
  560   2HG   GLN  61           HG1      GLN  61  64.051 -11.501  -4.591
  561   1HE2  GLN  61          HE22      GLN  61  64.603 -14.985  -4.903
  562   2HE2  GLN  61          HE21      GLN  61  63.467 -13.725  -4.951
  563    H    LYS  62           HN       LYS  62  66.948  -7.790  -7.571
  564    HA   LYS  62           HA       LYS  62  65.852  -8.247 -10.294
  565   1HB   LYS  62           HB2      LYS  62  66.948  -5.875  -8.824
  566   2HB   LYS  62           HB1      LYS  62  66.969  -5.878 -10.588
  567   1HG   LYS  62           HG2      LYS  62  64.414  -6.798  -9.984
  568   2HG   LYS  62           HG1      LYS  62  64.706  -5.571  -8.753
  569   1HD   LYS  62           HD2      LYS  62  63.726  -4.470 -10.671
  570   2HD   LYS  62           HD1      LYS  62  65.424  -4.002 -10.591
  571   1HE   LYS  62           HE2      LYS  62  65.410  -6.356 -12.123
  572   2HE   LYS  62           HE1      LYS  62  64.016  -5.438 -12.691
  573   1HZ   LYS  62           HZ1      LYS  62  65.695  -3.478 -12.640
  574   2HZ   LYS  62           HZ3      LYS  62  66.860  -4.707 -12.725
  575   3HZ   LYS  62           HZ2      LYS  62  65.693  -4.559 -13.951
  576    H    GLY  63           HN       GLY  63  68.083  -9.875  -9.276
  577   1HA   GLY  63           HA2      GLY  63  70.099 -10.726 -10.121
  578   2HA   GLY  63           HA1      GLY  63  69.793  -9.768 -11.569
  579    H    LYS  64           HN       LYS  64  70.446  -8.878  -8.158
  580    HA   LYS  64           HA       LYS  64  72.389  -6.860  -9.139
  581   1HB   LYS  64           HB2      LYS  64  70.511  -6.514  -7.304
  582   2HB   LYS  64           HB1      LYS  64  71.729  -7.222  -6.241
  583   1HG   LYS  64           HG2      LYS  64  73.193  -5.449  -6.502
  584   2HG   LYS  64           HG1      LYS  64  72.585  -5.047  -8.109
  585   1HD   LYS  64           HD2      LYS  64  70.500  -4.185  -7.110
  586   2HD   LYS  64           HD1      LYS  64  71.106  -4.584  -5.502
  587   1HE   LYS  64           HE2      LYS  64  72.964  -3.026  -5.769
  588   2HE   LYS  64           HE1      LYS  64  72.473  -2.684  -7.428
  589   1HZ   LYS  64           HZ3      LYS  64  70.234  -2.078  -6.312
  590   2HZ   LYS  64           HZ2      LYS  64  71.175  -1.904  -4.908
  591   3HZ   LYS  64           HZ1      LYS  64  71.511  -0.962  -6.281
  592    NH1  ARG  65           NH2      ARG  65  70.941 -13.862  -2.246
  593    NH2  ARG  65           NH1      ARG  65  71.819 -12.533  -0.643
  594    H    ARG  65           HN       ARG  65  72.192  -9.734  -7.102
  595    HA   ARG  65           HA       ARG  65  75.180  -9.769  -7.036
  596   1HB   ARG  65           HB2      ARG  65  74.965 -11.065  -4.914
  597   2HB   ARG  65           HB1      ARG  65  74.285  -9.444  -4.785
  598   1HG   ARG  65           HG2      ARG  65  72.120 -10.211  -4.652
  599   2HG   ARG  65           HG1      ARG  65  72.443 -11.615  -5.669
  600   1HD   ARG  65           HD2      ARG  65  73.167 -12.902  -3.907
  601   2HD   ARG  65           HD1      ARG  65  73.819 -11.520  -3.028
  602    HE   ARG  65           HE       ARG  65  71.101 -11.086  -2.923
  603   1HH1  ARG  65          HH21      ARG  65  70.697 -14.020  -3.203
  604   2HH1  ARG  65          HH22      ARG  65  70.756 -14.566  -1.560
  605   1HH2  ARG  65          HH11      ARG  65  72.248 -11.672  -0.371
  606   2HH2  ARG  65          HH12      ARG  65  71.633 -13.238   0.042
  607    H    SER  66           HN       SER  66  73.811 -10.829  -9.215
  608    HA   SER  66           HA       SER  66  73.759 -13.770  -8.739
  609   1HB   SER  66           HB2      SER  66  72.430 -11.934 -10.655
  610   2HB   SER  66           HB1      SER  66  72.938 -13.487 -11.313
  611    HG   SER  66           HG       SER  66  70.908 -13.747 -10.447
  612    H    SER  67           HN       SER  67  75.298 -15.071  -9.657
  613    HA   SER  67           HA       SER  67  77.104 -13.915 -11.724
  614   1HB   SER  67           HB2      SER  67  79.002 -15.114 -10.424
  615   2HB   SER  67           HB1      SER  67  78.432 -13.565  -9.809
  616    HG   SER  67           HG       SER  67  78.454 -15.918  -8.591
   
  Start of MODEL          13
 Raw file had  616 H/Q atoms
  Start of MODEL   13
    1   1H    MET   1           HT3      MET   1  41.847   8.206  13.271
    2   2H    MET   1           HT2      MET   1  41.557   6.640  13.861
    3   3H    MET   1           HT1      MET   1  42.967   6.968  12.972
    4    HA   MET   1           HA       MET   1  41.668   5.951  11.389
    5   1HB   MET   1           HB2      MET   1  39.223   6.458  11.189
    6   2HB   MET   1           HB1      MET   1  39.653   5.739  12.741
    7   1HG   MET   1           HG2      MET   1  39.572   7.866  13.848
    8   2HG   MET   1           HG1      MET   1  39.460   8.729  12.314
    9   1HE   MET   1           HE3      MET   1  37.996   6.281  14.730
   10   2HE   MET   1           HE2      MET   1  37.409   7.844  15.291
   11   3HE   MET   1           HE1      MET   1  36.262   6.630  14.733
   12    H    GLU   2           HN       GLU   2  43.268   8.327  11.354
   13    HA   GLU   2           HA       GLU   2  42.247   9.532   8.885
   14   1HB   GLU   2           HB2      GLU   2  41.291  10.805  10.978
   15   2HB   GLU   2           HB1      GLU   2  42.922  11.470  11.081
   16   1HG   GLU   2           HG2      GLU   2  42.749  12.214   8.719
   17   2HG   GLU   2           HG1      GLU   2  41.095  11.603   8.664
   18    H    THR   3           HN       THR   3  44.554   7.950   9.599
   19    HA   THR   3           HA       THR   3  46.768   9.936   9.354
   20    HB   THR   3           HB       THR   3  46.939   6.984  10.030
   21    HG1  THR   3           HG1      THR   3  47.120   9.243  11.732
   22   1HG2  THR   3          HG23      THR   3  48.937   8.285   9.014
   23   2HG2  THR   3          HG22      THR   3  48.990   9.125  10.564
   24   3HG2  THR   3          HG21      THR   3  49.214   7.377  10.500
   25    H    LEU   4           HN       LEU   4  46.077  10.172   7.045
   26    HA   LEU   4           HA       LEU   4  47.601   8.308   5.353
   27   1HB   LEU   4           HB2      LEU   4  45.661   7.962   3.803
   28   2HB   LEU   4           HB1      LEU   4  45.438   7.198   5.376
   29    HG   LEU   4           HG       LEU   4  44.388   9.698   5.831
   30   1HD1  LEU   4          HD12      LEU   4  44.712   9.970   3.245
   31   2HD1  LEU   4          HD11      LEU   4  43.289   8.933   3.139
   32   3HD1  LEU   4          HD13      LEU   4  43.191  10.480   3.979
   33   1HD2  LEU   4          HD21      LEU   4  43.476   7.321   6.255
   34   2HD2  LEU   4          HD23      LEU   4  42.293   8.588   5.933
   35   3HD2  LEU   4          HD22      LEU   4  42.739   7.454   4.658
   36    H    VAL   5           HN       VAL   5  47.081   9.155   2.896
   37    HA   VAL   5           HA       VAL   5  46.826  12.104   2.869
   38    HB   VAL   5           HB       VAL   5  49.264  10.688   1.744
   39   1HG1  VAL   5          HG13      VAL   5  48.452  12.772   0.573
   40   2HG1  VAL   5          HG12      VAL   5  48.690  13.646   2.087
   41   3HG1  VAL   5          HG11      VAL   5  50.069  12.918   1.263
   42   1HG2  VAL   5          HG23      VAL   5  48.795  12.245   4.292
   43   2HG2  VAL   5          HG22      VAL   5  49.546  10.662   4.101
   44   3HG2  VAL   5          HG21      VAL   5  50.401  12.112   3.576
   45    H    GLN   6           HN       GLN   6  44.911  11.627   1.644
   46    HA   GLN   6           HA       GLN   6  45.373  10.402  -1.037
   47   1HB   GLN   6           HB2      GLN   6  43.516   9.616   0.630
   48   2HB   GLN   6           HB1      GLN   6  42.662  11.062   0.090
   49   1HG   GLN   6           HG2      GLN   6  43.106  10.247  -2.299
   50   2HG   GLN   6           HG1      GLN   6  43.569   8.707  -1.573
   51   1HE2  GLN   6          HE22      GLN   6  40.108   8.477  -0.111
   52   2HE2  GLN   6          HE21      GLN   6  41.658   8.625   0.564
   53    H    ALA   7           HN       ALA   7  46.386  12.450  -1.765
   54    HA   ALA   7           HA       ALA   7  44.821  14.887  -1.845
   55   1HB   ALA   7           HB2      ALA   7  47.490  14.283  -2.196
   56   2HB   ALA   7           HB1      ALA   7  46.965  14.627  -3.844
   57   3HB   ALA   7           HB3      ALA   7  46.749  15.837  -2.578
   58    NH1  ARG   8           NH1      ARG   8  45.433  18.435  -9.568
   59    NH2  ARG   8           NH2      ARG   8  46.419  19.403  -7.779
   60    H    ARG   8           HN       ARG   8  45.986  12.760  -4.479
   61    HA   ARG   8           HA       ARG   8  43.383  13.091  -5.828
   62   1HB   ARG   8           HB2      ARG   8  46.046  13.456  -7.230
   63   2HB   ARG   8           HB1      ARG   8  44.447  13.603  -7.960
   64   1HG   ARG   8           HG2      ARG   8  43.951  15.491  -6.405
   65   2HG   ARG   8           HG1      ARG   8  45.601  15.382  -5.791
   66   1HD   ARG   8           HD2      ARG   8  46.523  15.939  -7.946
   67   2HD   ARG   8           HD1      ARG   8  44.942  15.806  -8.717
   68    HE   ARG   8           HE       ARG   8  44.653  17.767  -6.733
   69   1HH1  ARG   8          HH11      ARG   8  44.868  17.708  -9.957
   70   2HH1  ARG   8          HH12      ARG   8  45.807  19.149 -10.160
   71   1HH2  ARG   8          HH21      ARG   8  46.610  19.418  -6.797
   72   2HH2  ARG   8          HH22      ARG   8  46.794  20.117  -8.371
   73    H    LYS   9           HN       LYS   9  42.705  11.157  -6.698
   74    HA   LYS   9           HA       LYS   9  44.486   8.849  -6.389
   75   1HB   LYS   9           HB2      LYS   9  41.793   9.182  -5.985
   76   2HB   LYS   9           HB1      LYS   9  41.818   8.406  -7.569
   77   1HG   LYS   9           HG2      LYS   9  43.620   6.849  -6.331
   78   2HG   LYS   9           HG1      LYS   9  42.680   7.341  -4.921
   79   1HD   LYS   9           HD2      LYS   9  40.702   6.377  -5.745
   80   2HD   LYS   9           HD1      LYS   9  41.295   6.354  -7.407
   81   1HE   LYS   9           HE2      LYS   9  42.987   4.651  -6.752
   82   2HE   LYS   9           HE1      LYS   9  42.314   4.636  -5.123
   83   1HZ   LYS   9           HZ2      LYS   9  40.108   4.229  -6.509
   84   2HZ   LYS   9           HZ1      LYS   9  41.220   3.550  -7.600
   85   3HZ   LYS   9           HZ3      LYS   9  41.117   2.954  -6.016
   86    NH1  ARG  10           NH2      ARG  10  41.325  11.670 -12.429
   87    NH2  ARG  10           NH1      ARG  10  40.571  13.051 -10.805
   88    H    ARG  10           HN       ARG  10  45.482  10.462  -8.383
   89    HA   ARG  10           HA       ARG  10  44.492   9.492 -10.964
   90   1HB   ARG  10           HB2      ARG  10  46.293  11.637 -10.031
   91   2HB   ARG  10           HB1      ARG  10  46.788  10.873 -11.541
   92   1HG   ARG  10           HG2      ARG  10  45.326  12.727 -12.083
   93   2HG   ARG  10           HG1      ARG  10  44.452  11.230 -12.406
   94   1HD   ARG  10           HD2      ARG  10  43.322  11.402 -10.229
   95   2HD   ARG  10           HD1      ARG  10  44.214  12.880  -9.872
   96    HE   ARG  10           HE       ARG  10  42.985  13.955 -11.750
   97   1HH1  ARG  10          HH21      ARG  10  42.076  11.323 -12.991
   98   2HH1  ARG  10          HH22      ARG  10  40.402  11.306 -12.549
   99   1HH2  ARG  10          HH11      ARG  10  40.744  13.761 -10.123
  100   2HH2  ARG  10          HH12      ARG  10  39.647  12.687 -10.924
  101    H    LYS  11           HN       LYS  11  47.943   9.795 -10.172
  102    HA   LYS  11           HA       LYS  11  48.363   6.928 -10.070
  103   1HB   LYS  11           HB2      LYS  11  49.767   6.837 -12.133
  104   2HB   LYS  11           HB1      LYS  11  48.069   7.161 -12.483
  105   1HG   LYS  11           HG2      LYS  11  48.493   9.500 -12.812
  106   2HG   LYS  11           HG1      LYS  11  50.129   9.356 -12.167
  107   1HD   LYS  11           HD2      LYS  11  49.154   7.954 -14.673
  108   2HD   LYS  11           HD1      LYS  11  50.069   9.461 -14.670
  109   1HE   LYS  11           HE2      LYS  11  51.655   7.949 -13.072
  110   2HE   LYS  11           HE1      LYS  11  50.980   6.694 -14.111
  111   1HZ   LYS  11           HZ2      LYS  11  51.994   9.173 -15.319
  112   2HZ   LYS  11           HZ1      LYS  11  53.099   7.979 -14.831
  113   3HZ   LYS  11           HZ3      LYS  11  51.905   7.610 -15.978
  114    NH1  ARG  12           NH1      ARG  12  56.256  10.712  -8.021
  115    NH2  ARG  12           NH2      ARG  12  56.252  12.933  -8.439
  116    H    ARG  12           HN       ARG  12  49.039   8.790  -8.206
  117    HA   ARG  12           HA       ARG  12  51.974   8.602  -8.199
  118   1HB   ARG  12           HB2      ARG  12  50.553  11.112  -8.772
  119   2HB   ARG  12           HB1      ARG  12  51.672  11.249  -7.415
  120   1HG   ARG  12           HG2      ARG  12  53.259   9.896  -9.102
  121   2HG   ARG  12           HG1      ARG  12  52.238  10.704 -10.291
  122   1HD   ARG  12           HD2      ARG  12  53.943  12.277  -9.956
  123   2HD   ARG  12           HD1      ARG  12  52.690  12.841  -8.850
  124    HE   ARG  12           HE       ARG  12  53.972  11.798  -7.005
  125   1HH1  ARG  12          HH11      ARG  12  55.764   9.875  -7.781
  126   2HH1  ARG  12          HH12      ARG  12  57.242  10.683  -8.181
  127   1HH2  ARG  12          HH21      ARG  12  55.758  13.799  -8.519
  128   2HH2  ARG  12          HH22      ARG  12  57.239  12.905  -8.598
  129    H    THR  13           HN       THR  13  49.028   9.730  -6.525
  130    HA   THR  13           HA       THR  13  50.336   9.763  -3.920
  131    HB   THR  13           HB       THR  13  47.368   9.677  -4.542
  132    HG1  THR  13           HG1      THR  13  49.091  11.898  -4.172
  133   1HG2  THR  13          HG23      THR  13  48.619   9.403  -2.127
  134   2HG2  THR  13          HG22      THR  13  48.423  11.154  -2.212
  135   3HG2  THR  13          HG21      THR  13  47.013  10.102  -2.335
  136    H    SER  14           HN       SER  14  48.497   7.465  -5.838
  137    HA   SER  14           HA       SER  14  48.243   5.547  -3.635
  138   1HB   SER  14           HB2      SER  14  47.825   5.103  -6.607
  139   2HB   SER  14           HB1      SER  14  47.245   4.079  -5.296
  140    HG   SER  14           HG       SER  14  45.960   6.031  -6.388
  141    H    ILE  15           HN       ILE  15  49.048   3.171  -4.494
  142    HA   ILE  15           HA       ILE  15  51.971   3.474  -4.693
  143    HB   ILE  15           HB       ILE  15  50.217   1.040  -4.280
  144   1HG1  ILE  15          HG12      ILE  15  50.254   2.616  -2.387
  145   2HG1  ILE  15          HG11      ILE  15  51.134   1.145  -1.977
  146   1HG2  ILE  15          HG21      ILE  15  53.242   1.306  -4.230
  147   2HG2  ILE  15          HG23      ILE  15  52.349  -0.117  -3.694
  148   3HG2  ILE  15          HG22      ILE  15  52.298   0.370  -5.388
  149   1HD1  ILE  15          HD13      ILE  15  53.260   2.346  -2.692
  150   2HD1  ILE  15          HD12      ILE  15  52.303   3.825  -2.777
  151   3HD1  ILE  15          HD11      ILE  15  52.494   2.988  -1.241
  152    H    GLU  16           HN       GLU  16  52.096   4.235  -6.877
  153    HA   GLU  16           HA       GLU  16  51.040   2.766  -9.093
  154   1HB   GLU  16           HB2      GLU  16  52.308   5.197  -8.790
  155   2HB   GLU  16           HB1      GLU  16  53.547   4.228  -9.587
  156   1HG   GLU  16           HG2      GLU  16  51.233   3.563 -10.981
  157   2HG   GLU  16           HG1      GLU  16  51.029   5.285 -10.660
  158    H    ASN  17           HN       ASN  17  52.242   1.350 -10.512
  159    HA   ASN  17           HA       ASN  17  53.798  -0.614  -9.170
  160   1HB   ASN  17           HB2      ASN  17  52.521  -0.805 -11.415
  161   2HB   ASN  17           HB1      ASN  17  53.972  -0.118 -12.146
  162   1HD2  ASN  17          HD22      ASN  17  54.325  -3.807 -10.342
  163   2HD2  ASN  17          HD21      ASN  17  53.217  -2.685  -9.712
  164    NH1  ARG  18           NH2      ARG  18  60.219   3.891 -14.833
  165    NH2  ARG  18           NH1      ARG  18  60.929   4.247 -12.716
  166    H    ARG  18           HN       ARG  18  54.704   2.389 -10.678
  167    HA   ARG  18           HA       ARG  18  57.550   1.705 -10.793
  168   1HB   ARG  18           HB2      ARG  18  55.845   4.012 -11.552
  169   2HB   ARG  18           HB1      ARG  18  57.478   4.422 -11.026
  170   1HG   ARG  18           HG2      ARG  18  58.350   2.696 -12.645
  171   2HG   ARG  18           HG1      ARG  18  56.704   2.520 -13.257
  172   1HD   ARG  18           HD2      ARG  18  57.569   4.120 -14.718
  173   2HD   ARG  18           HD1      ARG  18  56.815   5.138 -13.491
  174    HE   ARG  18           HE       ARG  18  58.964   5.945 -13.000
  175   1HH1  ARG  18          HH21      ARG  18  59.525   4.004 -15.544
  176   2HH1  ARG  18          HH22      ARG  18  61.062   3.392 -15.032
  177   1HH2  ARG  18          HH11      ARG  18  60.778   4.634 -11.806
  178   2HH2  ARG  18          HH12      ARG  18  61.772   3.749 -12.915
  179    H    VAL  19           HN       VAL  19  55.313   3.272  -8.567
  180    HA   VAL  19           HA       VAL  19  57.353   4.487  -6.946
  181    HB   VAL  19           HB       VAL  19  54.669   4.817  -7.005
  182   1HG1  VAL  19          HG13      VAL  19  55.169   3.044  -4.585
  183   2HG1  VAL  19          HG12      VAL  19  53.767   4.079  -4.788
  184   3HG1  VAL  19          HG11      VAL  19  54.035   2.741  -5.904
  185   1HG2  VAL  19          HG22      VAL  19  56.589   6.151  -5.920
  186   2HG2  VAL  19          HG21      VAL  19  55.001   6.284  -5.162
  187   3HG2  VAL  19          HG23      VAL  19  56.233   5.240  -4.453
  188    NH1  ARG  20           NH1      ARG  20  52.820  -4.322  -5.617
  189    NH2  ARG  20           NH2      ARG  20  51.575  -3.228  -7.154
  190    H    ARG  20           HN       ARG  20  55.600   1.395  -6.678
  191    HA   ARG  20           HA       ARG  20  56.904   0.593  -4.262
  192   1HB   ARG  20           HB2      ARG  20  56.272  -1.742  -4.924
  193   2HB   ARG  20           HB1      ARG  20  54.923  -0.612  -4.984
  194   1HG   ARG  20           HG2      ARG  20  55.120  -0.412  -7.394
  195   2HG   ARG  20           HG1      ARG  20  56.596  -1.372  -7.394
  196   1HD   ARG  20           HD2      ARG  20  54.695  -2.760  -8.063
  197   2HD   ARG  20           HD1      ARG  20  55.346  -3.308  -6.519
  198    HE   ARG  20           HE       ARG  20  53.266  -1.448  -5.979
  199   1HH1  ARG  20          HH11      ARG  20  53.630  -4.368  -5.032
  200   2HH1  ARG  20          HH12      ARG  20  52.158  -5.071  -5.613
  201   1HH2  ARG  20          HH21      ARG  20  51.431  -2.435  -7.748
  202   2HH2  ARG  20          HH22      ARG  20  50.912  -3.977  -7.151
  203    CH2  TRP  21           CH2      TRP  21  58.739  -5.690  -6.260
  204    H    TRP  21           HN       TRP  21  57.825   0.085  -7.667
  205    HA   TRP  21           HA       TRP  21  60.205  -1.327  -6.767
  206   1HB   TRP  21           HB2      TRP  21  58.951  -0.843  -9.363
  207   2HB   TRP  21           HB1      TRP  21  60.703  -0.609  -9.427
  208    HD1  TRP  21           HD1      TRP  21  61.498  -2.908 -10.425
  209    HE1  TRP  21           HE1      TRP  21  61.369  -5.350  -9.587
  210    HE3  TRP  21           HE3      TRP  21  58.200  -2.365  -6.576
  211    HZ2  TRP  21           HZ2      TRP  21  60.035  -6.857  -7.511
  212    HZ3  TRP  21           HZ3      TRP  21  57.530  -4.265  -5.181
  213    HH2  TRP  21           HH2      TRP  21  58.453  -6.527  -5.640
  214    H    SER  22           HN       SER  22  59.279   1.917  -6.914
  215    HA   SER  22           HA       SER  22  61.893   3.096  -7.282
  216   1HB   SER  22           HB2      SER  22  59.575   4.288  -7.398
  217   2HB   SER  22           HB1      SER  22  59.657   4.297  -5.639
  218    HG   SER  22           HG       SER  22  61.734   5.335  -5.896
  219    H    LEU  23           HN       LEU  23  59.883   1.868  -4.635
  220    HA   LEU  23           HA       LEU  23  61.510   2.538  -2.388
  221   1HB   LEU  23           HB2      LEU  23  59.948  -0.039  -2.860
  222   2HB   LEU  23           HB1      LEU  23  60.528   0.524  -1.310
  223    HG   LEU  23           HG       LEU  23  58.725   2.321  -2.878
  224   1HD1  LEU  23          HD13      LEU  23  57.902  -0.193  -2.691
  225   2HD1  LEU  23          HD12      LEU  23  57.587   0.252  -1.015
  226   3HD1  LEU  23          HD11      LEU  23  56.791   1.126  -2.324
  227   1HD2  LEU  23          HD22      LEU  23  59.862   2.891  -0.653
  228   2HD2  LEU  23          HD21      LEU  23  58.107   3.072  -0.681
  229   3HD2  LEU  23          HD23      LEU  23  58.835   1.656   0.076
  230    H    GLU  24           HN       GLU  24  61.496  -0.205  -4.603
  231    HA   GLU  24           HA       GLU  24  63.594  -1.739  -3.492
  232   1HB   GLU  24           HB2      GLU  24  62.016  -2.183  -5.541
  233   2HB   GLU  24           HB1      GLU  24  63.327  -1.462  -6.474
  234   1HG   GLU  24           HG2      GLU  24  64.685  -3.262  -6.192
  235   2HG   GLU  24           HG1      GLU  24  64.225  -3.463  -4.501
  236    H    THR  25           HN       THR  25  63.979   0.630  -6.178
  237    HA   THR  25           HA       THR  25  66.803   0.476  -6.273
  238    HB   THR  25           HB       THR  25  65.536   1.579  -8.040
  239    HG1  THR  25           HG1      THR  25  67.159   2.849  -8.370
  240   1HG2  THR  25          HG22      THR  25  64.807   3.489  -5.820
  241   2HG2  THR  25          HG21      THR  25  64.654   3.924  -7.524
  242   3HG2  THR  25          HG23      THR  25  63.728   2.574  -6.871
  243    H    MET  26           HN       MET  26  64.739   2.029  -3.923
  244    HA   MET  26           HA       MET  26  66.895   3.779  -2.936
  245   1HB   MET  26           HB2      MET  26  64.344   4.249  -2.884
  246   2HB   MET  26           HB1      MET  26  64.326   3.185  -1.478
  247   1HG   MET  26           HG2      MET  26  66.171   4.626  -0.497
  248   2HG   MET  26           HG1      MET  26  65.882   5.760  -1.816
  249   1HE   MET  26           HE1      MET  26  64.558   7.228  -2.060
  250   2HE   MET  26           HE3      MET  26  62.957   7.541  -1.376
  251   3HE   MET  26           HE2      MET  26  64.403   8.066  -0.518
  252    H    PHE  27           HN       PHE  27  65.546   0.625  -2.155
  253    HA   PHE  27           HA       PHE  27  67.028   0.514   0.392
  254   1HB   PHE  27           HB2      PHE  27  64.995  -1.288  -0.927
  255   2HB   PHE  27           HB1      PHE  27  65.985  -1.861   0.410
  256    HD1  PHE  27           HD2      PHE  27  66.136  -0.352   2.513
  257    HD2  PHE  27           HD1      PHE  27  63.068   0.005  -0.471
  258    HE1  PHE  27           HE2      PHE  27  64.709   0.872   4.126
  259    HE2  PHE  27           HE1      PHE  27  61.643   1.235   1.141
  260    HZ   PHE  27           HZ       PHE  27  62.469   1.656   3.441
  261    H    LEU  28           HN       LEU  28  67.637  -0.295  -2.869
  262    HA   LEU  28           HA       LEU  28  69.445  -2.511  -2.159
  263   1HB   LEU  28           HB2      LEU  28  68.761  -1.275  -4.836
  264   2HB   LEU  28           HB1      LEU  28  69.764  -2.711  -4.603
  265    HG   LEU  28           HG       LEU  28  66.919  -2.450  -3.590
  266   1HD1  LEU  28          HD11      LEU  28  68.046  -3.422  -6.181
  267   2HD1  LEU  28          HD13      LEU  28  66.682  -4.296  -5.483
  268   3HD1  LEU  28          HD12      LEU  28  66.529  -2.580  -5.861
  269   1HD2  LEU  28          HD22      LEU  28  68.998  -4.624  -3.598
  270   2HD2  LEU  28          HD21      LEU  28  67.963  -4.085  -2.276
  271   3HD2  LEU  28          HD23      LEU  28  67.285  -5.043  -3.593
  272    H    LYS  29           HN       LYS  29  69.923   0.436  -1.431
  273    HA   LYS  29           HA       LYS  29  72.573   0.763  -2.756
  274   1HB   LYS  29           HB2      LYS  29  72.497   3.096  -1.990
  275   2HB   LYS  29           HB1      LYS  29  71.031   2.723  -2.890
  276   1HG   LYS  29           HG2      LYS  29  69.889   2.260  -0.679
  277   2HG   LYS  29           HG1      LYS  29  71.335   2.870   0.125
  278   1HD   LYS  29           HD2      LYS  29  69.695   4.670  -0.065
  279   2HD   LYS  29           HD1      LYS  29  71.072   5.021  -1.108
  280   1HE   LYS  29           HE2      LYS  29  68.998   3.447  -2.459
  281   2HE   LYS  29           HE1      LYS  29  68.418   5.016  -1.901
  282   1HZ   LYS  29           HZ2      LYS  29  70.647   5.835  -2.921
  283   2HZ   LYS  29           HZ1      LYS  29  70.548   4.401  -3.827
  284   3HZ   LYS  29           HZ3      LYS  29  69.306   5.550  -3.925
  285    H    CYS  30           HN       CYS  30  70.898   0.718   0.342
  286    HA   CYS  30           HA       CYS  30  73.367  -0.241   1.649
  287   1HB   CYS  30           HB2      CYS  30  71.637   2.044   2.647
  288   2HB   CYS  30           HB1      CYS  30  72.902   1.264   3.596
  289    HG   CYS  30           HG       CYS  30  74.629   2.520   2.332
  290    HA   PRO  31           HA       PRO  31  70.017  -2.846   3.202
  291   1HB   PRO  31           HB2      PRO  31  71.589  -4.692   4.462
  292   2HB   PRO  31           HB1      PRO  31  71.387  -4.654   2.701
  293   1HG   PRO  31           HG2      PRO  31  73.742  -3.860   4.331
  294   2HG   PRO  31           HG1      PRO  31  73.671  -4.362   2.635
  295   1HD   PRO  31           HD2      PRO  31  73.871  -1.683   3.635
  296   2HD   PRO  31           HD1      PRO  31  73.653  -2.180   1.943
  297    H    LYS  32           HN       LYS  32  71.164  -0.474   4.827
  298    HA   LYS  32           HA       LYS  32  70.697  -1.642   7.515
  299   1HB   LYS  32           HB2      LYS  32  72.214   0.174   8.362
  300   2HB   LYS  32           HB1      LYS  32  73.015  -1.002   7.319
  301   1HG   LYS  32           HG2      LYS  32  72.989   0.488   5.448
  302   2HG   LYS  32           HG1      LYS  32  71.861   1.584   6.247
  303   1HD   LYS  32           HD2      LYS  32  73.902   2.680   6.567
  304   2HD   LYS  32           HD1      LYS  32  73.743   1.764   8.067
  305   1HE   LYS  32           HE2      LYS  32  75.342   0.193   7.436
  306   2HE   LYS  32           HE1      LYS  32  75.108   0.495   5.715
  307   1HZ   LYS  32           HZ1      LYS  32  76.143   2.633   7.451
  308   2HZ   LYS  32           HZ3      LYS  32  77.193   1.421   6.897
  309   3HZ   LYS  32           HZ2      LYS  32  76.365   2.400   5.783
  310    HA   PRO  33           HA       PRO  33  67.898   2.108   6.732
  311   1HB   PRO  33           HB2      PRO  33  65.488   0.863   6.306
  312   2HB   PRO  33           HB1      PRO  33  66.578   1.352   4.996
  313   1HG   PRO  33           HG2      PRO  33  66.049  -1.371   6.086
  314   2HG   PRO  33           HG1      PRO  33  66.551  -0.889   4.457
  315   1HD   PRO  33           HD2      PRO  33  68.258  -1.961   6.438
  316   2HD   PRO  33           HD1      PRO  33  68.772  -1.109   4.966
  317    H    SER  34           HN       SER  34  67.097   2.912   8.640
  318    HA   SER  34           HA       SER  34  66.894   1.283  11.004
  319   1HB   SER  34           HB2      SER  34  66.356   4.130  10.297
  320   2HB   SER  34           HB1      SER  34  65.652   3.499  11.784
  321    HG   SER  34           HG       SER  34  67.699   2.949  12.484
  322    H    LEU  35           HN       LEU  35  65.046   0.554  12.102
  323    HA   LEU  35           HA       LEU  35  62.732  -0.098  10.522
  324   1HB   LEU  35           HB2      LEU  35  63.125   0.020  13.533
  325   2HB   LEU  35           HB1      LEU  35  61.677  -0.623  12.756
  326    HG   LEU  35           HG       LEU  35  63.807  -1.870  11.424
  327   1HD1  LEU  35          HD13      LEU  35  65.236  -1.049  13.343
  328   2HD1  LEU  35          HD12      LEU  35  64.252  -2.045  14.416
  329   3HD1  LEU  35          HD11      LEU  35  65.214  -2.802  13.146
  330   1HD2  LEU  35          HD23      LEU  35  61.528  -2.754  12.186
  331   2HD2  LEU  35          HD22      LEU  35  62.876  -3.882  12.323
  332   3HD2  LEU  35          HD21      LEU  35  62.275  -3.049  13.757
  333    H    GLN  36           HN       GLN  36  63.691   2.618  12.476
  334    HA   GLN  36           HA       GLN  36  61.080   3.900  12.625
  335   1HB   GLN  36           HB2      GLN  36  63.926   4.917  12.906
  336   2HB   GLN  36           HB1      GLN  36  62.525   5.982  13.038
  337   1HG   GLN  36           HG2      GLN  36  62.774   5.400  15.263
  338   2HG   GLN  36           HG1      GLN  36  61.702   4.102  14.736
  339   1HE2  GLN  36          HE22      GLN  36  65.618   3.251  15.602
  340   2HE2  GLN  36          HE21      GLN  36  65.131   4.864  15.400
  341    H    GLN  37           HN       GLN  37  63.836   3.909  10.434
  342    HA   GLN  37           HA       GLN  37  62.915   5.949   8.647
  343   1HB   GLN  37           HB2      GLN  37  65.244   5.008   8.664
  344   2HB   GLN  37           HB1      GLN  37  64.601   3.515   7.978
  345   1HG   GLN  37           HG2      GLN  37  63.883   4.637   5.981
  346   2HG   GLN  37           HG1      GLN  37  64.202   6.223   6.686
  347   1HE2  GLN  37          HE22      GLN  37  67.264   4.080   5.062
  348   2HE2  GLN  37          HE21      GLN  37  65.710   3.409   5.187
  349    H    ILE  38           HN       ILE  38  62.087   2.546   9.066
  350    HA   ILE  38           HA       ILE  38  60.751   2.303   6.511
  351    HB   ILE  38           HB       ILE  38  60.806   0.616   9.020
  352   1HG1  ILE  38          HG12      ILE  38  62.630   0.404   7.382
  353   2HG1  ILE  38          HG11      ILE  38  61.661  -1.067   7.412
  354   1HG2  ILE  38          HG22      ILE  38  58.886   0.316   6.679
  355   2HG2  ILE  38          HG21      ILE  38  59.317  -1.031   7.734
  356   3HG2  ILE  38          HG23      ILE  38  58.487   0.379   8.395
  357   1HD1  ILE  38          HD12      ILE  38  60.420   0.587   5.495
  358   2HD1  ILE  38          HD11      ILE  38  62.151   0.752   5.199
  359   3HD1  ILE  38          HD13      ILE  38  61.400  -0.844   5.176
  360    H    THR  39           HN       THR  39  59.896   3.398   9.717
  361    HA   THR  39           HA       THR  39  57.042   3.550   9.317
  362    HB   THR  39           HB       THR  39  58.665   5.485  10.990
  363    HG1  THR  39           HG1      THR  39  58.516   3.905  12.628
  364   1HG2  THR  39          HG22      THR  39  55.847   4.450  10.947
  365   2HG2  THR  39          HG21      THR  39  56.542   5.037  12.458
  366   3HG2  THR  39          HG23      THR  39  56.417   6.114  11.067
  367    H    HIS  40           HN       HIS  40  59.765   5.696   8.663
  368    HA   HIS  40           HA       HIS  40  58.196   7.892   7.599
  369   1HB   HIS  40           HB2      HIS  40  61.026   7.219   7.927
  370   2HB   HIS  40           HB1      HIS  40  60.715   7.996   6.376
  371    HD1  HIS  40           HD1      HIS  40  61.035   8.699   9.972
  372    HD2  HIS  40           HD2      HIS  40  59.374  10.605   6.657
  373    HE1  HIS  40           HE1      HIS  40  60.643  11.109  10.651
  374    H    ILE  41           HN       ILE  41  59.348   4.842   6.352
  375    HA   ILE  41           HA       ILE  41  59.141   5.473   3.558
  376    HB   ILE  41           HB       ILE  41  59.561   3.083   5.218
  377   1HG1  ILE  41          HG12      ILE  41  60.782   2.513   2.934
  378   2HG1  ILE  41          HG11      ILE  41  60.507   4.225   2.624
  379   1HG2  ILE  41          HG23      ILE  41  58.080   2.730   2.596
  380   2HG2  ILE  41          HG22      ILE  41  58.887   1.435   3.480
  381   3HG2  ILE  41          HG21      ILE  41  57.500   2.256   4.194
  382   1HD1  ILE  41          HD12      ILE  41  61.875   3.104   5.092
  383   2HD1  ILE  41          HD11      ILE  41  62.704   3.827   3.715
  384   3HD1  ILE  41          HD13      ILE  41  61.643   4.812   4.720
  385    H    ALA  42           HN       ALA  42  56.892   4.095   5.947
  386    HA   ALA  42           HA       ALA  42  54.681   3.657   4.249
  387   1HB   ALA  42           HB3      ALA  42  54.791   2.821   6.569
  388   2HB   ALA  42           HB2      ALA  42  54.670   4.476   7.165
  389   3HB   ALA  42           HB1      ALA  42  53.315   3.750   6.301
  390    H    ASN  43           HN       ASN  43  55.318   6.489   6.327
  391    HA   ASN  43           HA       ASN  43  53.179   8.062   5.250
  392   1HB   ASN  43           HB2      ASN  43  55.726   8.701   6.721
  393   2HB   ASN  43           HB1      ASN  43  54.748  10.005   6.046
  394   1HD2  ASN  43          HD22      ASN  43  53.257   7.810   9.180
  395   2HD2  ASN  43          HD21      ASN  43  54.543   7.187   8.265
  396    H    GLN  44           HN       GLN  44  56.266   7.133   4.016
  397    HA   GLN  44           HA       GLN  44  56.587   9.314   2.158
  398   1HB   GLN  44           HB2      GLN  44  58.015   6.867   2.882
  399   2HB   GLN  44           HB1      GLN  44  58.152   7.285   1.182
  400   1HG   GLN  44           HG2      GLN  44  58.766   9.127   3.513
  401   2HG   GLN  44           HG1      GLN  44  59.968   8.299   2.524
  402   1HE2  GLN  44          HE22      GLN  44  58.721  11.839   1.277
  403   2HE2  GLN  44          HE21      GLN  44  58.663  11.285   2.881
  404    H    LEU  45           HN       LEU  45  54.988   6.158   1.980
  405    HA   LEU  45           HA       LEU  45  54.156   6.938  -0.775
  406   1HB   LEU  45           HB2      LEU  45  54.392   4.743  -1.635
  407   2HB   LEU  45           HB1      LEU  45  55.870   5.058  -0.740
  408    HG   LEU  45           HG       LEU  45  53.544   3.619   0.531
  409   1HD1  LEU  45          HD11      LEU  45  55.038   2.680  -1.689
  410   2HD1  LEU  45          HD13      LEU  45  55.691   1.853  -0.275
  411   3HD1  LEU  45          HD12      LEU  45  53.971   1.745  -0.646
  412   1HD2  LEU  45          HD23      LEU  45  56.386   4.237   1.133
  413   2HD2  LEU  45          HD22      LEU  45  55.003   4.103   2.221
  414   3HD2  LEU  45          HD21      LEU  45  55.798   2.648   1.622
  415    H    GLY  46           HN       GLY  46  52.889   7.025   2.024
  416   1HA   GLY  46           HA2      GLY  46  50.769   6.704   2.963
  417   2HA   GLY  46           HA1      GLY  46  50.217   6.904   1.308
  418    H    LEU  47           HN       LEU  47  52.196   4.128   2.224
  419    HA   LEU  47           HA       LEU  47  49.814   2.427   1.672
  420   1HB   LEU  47           HB2      LEU  47  51.171   0.806   0.783
  421   2HB   LEU  47           HB1      LEU  47  52.236   2.169   0.523
  422    HG   LEU  47           HG       LEU  47  52.361   0.186   2.797
  423   1HD1  LEU  47          HD11      LEU  47  53.345  -0.050   0.243
  424   2HD1  LEU  47          HD13      LEU  47  54.722   0.645   1.099
  425   3HD1  LEU  47          HD12      LEU  47  54.015  -0.870   1.653
  426   1HD2  LEU  47          HD21      LEU  47  53.494   2.868   2.500
  427   2HD2  LEU  47          HD23      LEU  47  53.266   1.905   3.949
  428   3HD2  LEU  47          HD22      LEU  47  54.676   1.642   2.926
  429    H    GLU  48           HN       GLU  48  49.983   0.229   2.957
  430    HA   GLU  48           HA       GLU  48  49.975   0.965   5.818
  431   1HB   GLU  48           HB2      GLU  48  48.063  -0.325   4.788
  432   2HB   GLU  48           HB1      GLU  48  49.183  -1.658   4.507
  433   1HG   GLU  48           HG2      GLU  48  48.435  -2.330   6.565
  434   2HG   GLU  48           HG1      GLU  48  49.672  -1.208   7.129
  435    H    LYS  49           HN       LYS  49  51.337  -0.112   7.317
  436    HA   LYS  49           HA       LYS  49  53.944  -0.811   6.438
  437   1HB   LYS  49           HB2      LYS  49  52.442  -0.989   8.993
  438   2HB   LYS  49           HB1      LYS  49  53.848  -2.044   8.843
  439   1HG   LYS  49           HG2      LYS  49  54.973  -0.184   9.563
  440   2HG   LYS  49           HG1      LYS  49  54.890   0.258   7.858
  441   1HD   LYS  49           HD2      LYS  49  54.060   2.175   8.927
  442   2HD   LYS  49           HD1      LYS  49  52.588   1.308   8.485
  443   1HE   LYS  49           HE2      LYS  49  52.241   1.893  10.751
  444   2HE   LYS  49           HE1      LYS  49  52.770   0.213  10.825
  445   1HZ   LYS  49           HZ2      LYS  49  55.109   1.301  10.987
  446   2HZ   LYS  49           HZ1      LYS  49  54.239   2.657  11.527
  447   3HZ   LYS  49           HZ3      LYS  49  54.129   1.189  12.370
  448    H    ASP  50           HN       ASP  50  51.044  -2.708   6.460
  449    HA   ASP  50           HA       ASP  50  52.313  -5.301   6.637
  450   1HB   ASP  50           HB2      ASP  50  49.732  -4.443   6.821
  451   2HB   ASP  50           HB1      ASP  50  49.742  -5.086   5.179
  452    H    VAL  51           HN       VAL  51  51.423  -3.147   3.919
  453    HA   VAL  51           HA       VAL  51  52.213  -5.211   1.975
  454    HB   VAL  51           HB       VAL  51  50.394  -3.630   1.421
  455   1HG1  VAL  51          HG11      VAL  51  52.356  -1.696   2.335
  456   2HG1  VAL  51          HG13      VAL  51  51.775  -1.279   0.723
  457   3HG1  VAL  51          HG12      VAL  51  50.631  -1.478   2.049
  458   1HG2  VAL  51          HG23      VAL  51  52.131  -4.616  -0.278
  459   2HG2  VAL  51          HG22      VAL  51  51.022  -3.357  -0.820
  460   3HG2  VAL  51          HG21      VAL  51  52.687  -2.947  -0.406
  461    H    VAL  52           HN       VAL  52  53.682  -2.553   3.681
  462    HA   VAL  52           HA       VAL  52  55.952  -2.325   1.873
  463    HB   VAL  52           HB       VAL  52  54.889  -0.651   3.735
  464   1HG1  VAL  52          HG13      VAL  52  57.304  -1.856   5.104
  465   2HG1  VAL  52          HG12      VAL  52  56.458  -0.395   5.612
  466   3HG1  VAL  52          HG11      VAL  52  55.637  -1.954   5.671
  467   1HG2  VAL  52          HG22      VAL  52  56.841  -0.515   1.885
  468   2HG2  VAL  52          HG21      VAL  52  56.510   0.792   3.023
  469   3HG2  VAL  52          HG23      VAL  52  57.816  -0.348   3.345
  470    NH1  ARG  53           NH2      ARG  53  55.814 -10.038   9.670
  471    NH2  ARG  53           NH1      ARG  53  57.770 -10.828   8.857
  472    H    ARG  53           HN       ARG  53  55.104  -4.220   4.700
  473    HA   ARG  53           HA       ARG  53  57.838  -5.183   5.134
  474   1HB   ARG  53           HB2      ARG  53  55.974  -4.941   6.908
  475   2HB   ARG  53           HB1      ARG  53  55.322  -6.436   6.240
  476   1HG   ARG  53           HG2      ARG  53  58.187  -6.682   6.679
  477   2HG   ARG  53           HG1      ARG  53  57.373  -6.189   8.162
  478   1HD   ARG  53           HD2      ARG  53  55.655  -8.086   7.441
  479   2HD   ARG  53           HD1      ARG  53  57.062  -8.707   6.578
  480    HE   ARG  53           HE       ARG  53  57.881  -8.083   9.224
  481   1HH1  ARG  53          HH21      ARG  53  55.190  -9.274   9.832
  482   2HH1  ARG  53          HH22      ARG  53  55.565 -10.959   9.968
  483   1HH2  ARG  53          HH11      ARG  53  58.644 -10.669   8.397
  484   2HH2  ARG  53          HH12      ARG  53  57.522 -11.750   9.155
  485    H    VAL  54           HN       VAL  54  54.865  -6.368   3.592
  486    HA   VAL  54           HA       VAL  54  55.848  -9.025   3.049
  487    HB   VAL  54           HB       VAL  54  53.782  -7.406   1.518
  488   1HG1  VAL  54          HG11      VAL  54  54.714  -9.468   0.387
  489   2HG1  VAL  54          HG13      VAL  54  54.107 -10.411   1.748
  490   3HG1  VAL  54          HG12      VAL  54  52.981  -9.537   0.710
  491   1HG2  VAL  54          HG22      VAL  54  53.622  -7.982   4.140
  492   2HG2  VAL  54          HG21      VAL  54  52.209  -8.027   3.085
  493   3HG2  VAL  54          HG23      VAL  54  53.054  -9.520   3.492
  494    CH2  TRP  55           CH2      TRP  55  61.836  -2.218  -1.522
  495    H    TRP  55           HN       TRP  55  55.993  -5.956   1.255
  496    HA   TRP  55           HA       TRP  55  57.285  -7.142  -1.051
  497   1HB   TRP  55           HB2      TRP  55  56.265  -4.986  -1.409
  498   2HB   TRP  55           HB1      TRP  55  57.127  -4.279  -0.043
  499    HD1  TRP  55           HD1      TRP  55  57.853  -5.730  -3.574
  500    HE1  TRP  55           HE1      TRP  55  60.044  -4.674  -4.421
  501    HE3  TRP  55           HE3      TRP  55  59.235  -2.985   0.535
  502    HZ2  TRP  55           HZ2      TRP  55  62.065  -2.951  -3.527
  503    HZ3  TRP  55           HZ3      TRP  55  61.336  -1.680   0.496
  504    HH2  TRP  55           HH2      TRP  55  62.746  -1.637  -1.538
  505    H    PHE  56           HN       PHE  56  58.360  -5.748   2.030
  506    HA   PHE  56           HA       PHE  56  61.161  -6.008   1.259
  507   1HB   PHE  56           HB2      PHE  56  59.844  -4.554   3.251
  508   2HB   PHE  56           HB1      PHE  56  60.776  -5.768   4.133
  509    HD1  PHE  56           HD1      PHE  56  63.182  -6.236   2.776
  510    HD2  PHE  56           HD2      PHE  56  60.995  -2.549   2.984
  511    HE1  PHE  56           HE1      PHE  56  65.246  -4.989   2.243
  512    HE2  PHE  56           HE2      PHE  56  63.059  -1.315   2.463
  513    HZ   PHE  56           HZ       PHE  56  65.181  -2.525   2.074
  514    H    CYS  57           HN       CYS  57  58.857  -8.260   2.188
  515    HA   CYS  57           HA       CYS  57  60.622  -9.944   3.793
  516   1HB   CYS  57           HB2      CYS  57  57.917  -9.951   3.414
  517   2HB   CYS  57           HB1      CYS  57  58.395 -11.194   2.257
  518    HG   CYS  57           HG       CYS  57  59.792 -11.766   4.837
  519    H    ASN  58           HN       ASN  58  59.663  -9.555   0.439
  520    HA   ASN  58           HA       ASN  58  61.416 -11.746  -0.466
  521   1HB   ASN  58           HB2      ASN  58  59.148 -10.914  -1.527
  522   2HB   ASN  58           HB1      ASN  58  60.185  -9.721  -2.310
  523   1HD2  ASN  58          HD22      ASN  58  60.965 -13.678  -3.159
  524   2HD2  ASN  58          HD21      ASN  58  60.457 -13.258  -1.594
  525    NH1  ARG  59           NH2      ARG  59  64.241  -8.303  -4.017
  526    NH2  ARG  59           NH1      ARG  59  66.374  -7.761  -4.525
  527    H    ARG  59           HN       ARG  59  61.535  -8.259  -0.022
  528    HA   ARG  59           HA       ARG  59  63.892  -7.936  -1.731
  529   1HB   ARG  59           HB2      ARG  59  62.037  -6.132  -0.474
  530   2HB   ARG  59           HB1      ARG  59  63.654  -5.699   0.082
  531   1HG   ARG  59           HG2      ARG  59  62.740  -5.967  -2.800
  532   2HG   ARG  59           HG1      ARG  59  63.158  -4.487  -1.948
  533   1HD   ARG  59           HD2      ARG  59  65.360  -4.762  -2.331
  534   2HD   ARG  59           HD1      ARG  59  65.317  -6.441  -1.801
  535    HE   ARG  59           HE       ARG  59  64.794  -5.512  -4.583
  536   1HH1  ARG  59          HH21      ARG  59  63.325  -8.032  -3.721
  537   2HH1  ARG  59          HH22      ARG  59  64.435  -9.262  -4.224
  538   1HH2  ARG  59          HH11      ARG  59  67.095  -7.075  -4.618
  539   2HH2  ARG  59          HH12      ARG  59  66.568  -8.721  -4.732
  540    NH1  ARG  60           NH2      ARG  60  63.841 -10.465   7.980
  541    NH2  ARG  60           NH1      ARG  60  61.971 -11.725   8.124
  542    H    ARG  60           HN       ARG  60  63.286  -8.893   1.552
  543    HA   ARG  60           HA       ARG  60  66.065  -8.258   2.352
  544   1HB   ARG  60           HB2      ARG  60  65.435  -9.020   4.575
  545   2HB   ARG  60           HB1      ARG  60  64.200  -7.912   3.986
  546   1HG   ARG  60           HG2      ARG  60  62.865  -9.928   3.241
  547   2HG   ARG  60           HG1      ARG  60  64.050 -10.939   4.066
  548   1HD   ARG  60           HD2      ARG  60  63.431  -9.047   5.992
  549   2HD   ARG  60           HD1      ARG  60  61.881  -9.315   5.196
  550    HE   ARG  60           HE       ARG  60  62.525 -11.849   5.604
  551   1HH1  ARG  60          HH21      ARG  60  64.510  -9.968   7.427
  552   2HH1  ARG  60          HH22      ARG  60  63.937 -10.494   8.974
  553   1HH2  ARG  60          HH11      ARG  60  61.207 -12.194   7.681
  554   2HH2  ARG  60          HH12      ARG  60  62.067 -11.754   9.119
  555    H    GLN  61           HN       GLN  61  64.086 -10.947   1.313
  556    HA   GLN  61           HA       GLN  61  66.453 -12.751   1.621
  557   1HB   GLN  61           HB2      GLN  61  64.528 -13.416   3.044
  558   2HB   GLN  61           HB1      GLN  61  63.506 -13.490   1.610
  559   1HG   GLN  61           HG2      GLN  61  64.442 -15.452   0.876
  560   2HG   GLN  61           HG1      GLN  61  66.039 -15.051   1.512
  561   1HE2  GLN  61          HE22      GLN  61  63.845 -17.571   3.618
  562   2HE2  GLN  61          HE21      GLN  61  63.699 -17.291   1.950
  563    H    LYS  62           HN       LYS  62  66.625 -11.322  -0.560
  564    HA   LYS  62           HA       LYS  62  65.174 -12.504  -2.814
  565   1HB   LYS  62           HB2      LYS  62  66.600 -11.009  -4.176
  566   2HB   LYS  62           HB1      LYS  62  65.811 -10.136  -2.865
  567   1HG   LYS  62           HG2      LYS  62  68.335 -11.182  -1.927
  568   2HG   LYS  62           HG1      LYS  62  68.596 -10.284  -3.420
  569   1HD   LYS  62           HD2      LYS  62  66.862  -8.624  -2.094
  570   2HD   LYS  62           HD1      LYS  62  67.779  -9.311  -0.753
  571   1HE   LYS  62           HE2      LYS  62  69.866  -8.780  -2.236
  572   2HE   LYS  62           HE1      LYS  62  68.773  -7.682  -3.079
  573   1HZ   LYS  62           HZ2      LYS  62  68.199  -6.862  -0.737
  574   2HZ   LYS  62           HZ1      LYS  62  69.643  -7.621  -0.262
  575   3HZ   LYS  62           HZ3      LYS  62  69.681  -6.378  -1.415
  576    H    GLY  63           HN       GLY  63  68.202 -12.990  -1.145
  577   1HA   GLY  63           HA2      GLY  63  68.727 -15.540  -2.131
  578   2HA   GLY  63           HA1      GLY  63  69.553 -14.445  -3.243
  579    H    LYS  64           HN       LYS  64  69.199 -15.081   0.251
  580    HA   LYS  64           HA       LYS  64  71.930 -13.972   0.671
  581   1HB   LYS  64           HB2      LYS  64  69.477 -14.185   2.309
  582   2HB   LYS  64           HB1      LYS  64  70.974 -14.528   3.177
  583   1HG   LYS  64           HG2      LYS  64  71.920 -12.390   2.453
  584   2HG   LYS  64           HG1      LYS  64  70.473 -12.049   1.503
  585   1HD   LYS  64           HD2      LYS  64  70.169 -10.860   3.543
  586   2HD   LYS  64           HD1      LYS  64  69.164 -12.301   3.696
  587   1HE   LYS  64           HE2      LYS  64  71.265 -13.377   4.788
  588   2HE   LYS  64           HE1      LYS  64  71.822 -11.715   4.988
  589   1HZ   LYS  64           HZ1      LYS  64  69.524 -11.321   5.992
  590   2HZ   LYS  64           HZ3      LYS  64  69.428 -13.008   6.133
  591   3HZ   LYS  64           HZ2      LYS  64  70.663 -12.160   6.933
  592    NH1  ARG  65           NH1      ARG  65  71.577 -16.564   7.174
  593    NH2  ARG  65           NH2      ARG  65  69.405 -17.017   7.605
  594    H    ARG  65           HN       ARG  65  69.987 -16.890   1.077
  595    HA   ARG  65           HA       ARG  65  72.527 -18.382   1.546
  596   1HB   ARG  65           HB2      ARG  65  70.041 -18.354   3.195
  597   2HB   ARG  65           HB1      ARG  65  70.850 -19.907   2.976
  598   1HG   ARG  65           HG2      ARG  65  72.948 -18.974   3.809
  599   2HG   ARG  65           HG1      ARG  65  72.212 -17.376   3.943
  600   1HD   ARG  65           HD2      ARG  65  71.175 -19.810   5.415
  601   2HD   ARG  65           HD1      ARG  65  72.321 -18.668   6.117
  602    HE   ARG  65           HE       ARG  65  69.605 -17.825   5.185
  603   1HH1  ARG  65          HH11      ARG  65  72.385 -16.668   6.595
  604   2HH1  ARG  65          HH12      ARG  65  71.624 -16.007   8.004
  605   1HH2  ARG  65          HH21      ARG  65  68.549 -17.469   7.356
  606   2HH2  ARG  65          HH22      ARG  65  69.454 -16.460   8.434
  607    H    SER  66           HN       SER  66  72.657 -19.364  -0.447
  608    HA   SER  66           HA       SER  66  70.230 -20.702  -1.531
  609   1HB   SER  66           HB2      SER  66  71.738 -19.174  -2.957
  610   2HB   SER  66           HB1      SER  66  72.920 -20.479  -2.895
  611    HG   SER  66           HG       SER  66  71.752 -21.561  -4.264
  612    H    SER  67           HN       SER  67  70.491 -22.297   0.303
  613    HA   SER  67           HA       SER  67  72.337 -24.485  -0.550
  614   1HB   SER  67           HB2      SER  67  71.766 -23.699   2.322
  615   2HB   SER  67           HB1      SER  67  72.831 -24.995   1.784
  616    HG   SER  67           HG       SER  67  74.288 -23.556   1.156
   
  Start of MODEL          14
 Raw file had  616 H/Q atoms
  Start of MODEL   14
    1   1H    MET   1           HT1      MET   1  79.985  27.384   3.037
    2   2H    MET   1           HT3      MET   1  81.595  27.898   3.188
    3   3H    MET   1           HT2      MET   1  81.185  26.720   2.034
    4    HA   MET   1           HA       MET   1  82.117  25.465   3.721
    5   1HB   MET   1           HB2      MET   1  80.733  27.470   5.488
    6   2HB   MET   1           HB1      MET   1  81.222  25.904   6.135
    7   1HG   MET   1           HG2      MET   1  83.524  26.465   5.007
    8   2HG   MET   1           HG1      MET   1  82.936  28.126   5.065
    9   1HE   MET   1           HE3      MET   1  82.304  29.354   6.724
   10   2HE   MET   1           HE2      MET   1  81.454  28.559   8.047
   11   3HE   MET   1           HE1      MET   1  82.996  29.354   8.353
   12    H    GLU   2           HN       GLU   2  81.219  23.465   4.087
   13    HA   GLU   2           HA       GLU   2  79.590  21.779   4.110
   14   1HB   GLU   2           HB2      GLU   2  79.048  23.178   6.226
   15   2HB   GLU   2           HB1      GLU   2  77.695  23.806   5.285
   16   1HG   GLU   2           HG2      GLU   2  77.003  21.425   4.835
   17   2HG   GLU   2           HG1      GLU   2  78.249  20.908   5.973
   18    H    THR   3           HN       THR   3  79.798  23.274   1.696
   19    HA   THR   3           HA       THR   3  76.968  23.593   0.816
   20    HB   THR   3           HB       THR   3  79.497  24.331  -0.684
   21    HG1  THR   3           HG1      THR   3  79.603  25.907   0.675
   22   1HG2  THR   3          HG21      THR   3  76.566  24.636  -1.123
   23   2HG2  THR   3          HG23      THR   3  77.600  25.983  -1.602
   24   3HG2  THR   3          HG22      THR   3  77.859  24.383  -2.296
   25    H    LEU   4           HN       LEU   4  77.700  20.968   1.247
   26    HA   LEU   4           HA       LEU   4  77.924  19.918  -1.535
   27   1HB   LEU   4           HB2      LEU   4  79.936  19.631   0.219
   28   2HB   LEU   4           HB1      LEU   4  78.944  18.263   0.726
   29    HG   LEU   4           HG       LEU   4  78.802  17.714  -1.801
   30   1HD1  LEU   4          HD12      LEU   4  79.841  19.945  -2.425
   31   2HD1  LEU   4          HD11      LEU   4  81.369  19.322  -1.802
   32   3HD1  LEU   4          HD13      LEU   4  80.592  18.539  -3.179
   33   1HD2  LEU   4          HD23      LEU   4  81.378  17.422  -0.223
   34   2HD2  LEU   4          HD22      LEU   4  80.010  16.309  -0.211
   35   3HD2  LEU   4          HD21      LEU   4  80.986  16.490  -1.669
   36    H    VAL   5           HN       VAL   5  75.519  20.486  -0.026
   37    HA   VAL   5           HA       VAL   5  74.259  17.854  -0.212
   38    HB   VAL   5           HB       VAL   5  75.162  17.769   2.078
   39   1HG1  VAL   5          HG11      VAL   5  74.804  20.463   2.135
   40   2HG1  VAL   5          HG13      VAL   5  73.399  19.936   3.062
   41   3HG1  VAL   5          HG12      VAL   5  75.021  19.477   3.581
   42   1HG2  VAL   5          HG21      VAL   5  72.795  16.921   1.434
   43   2HG2  VAL   5          HG23      VAL   5  73.172  17.082   3.150
   44   3HG2  VAL   5          HG22      VAL   5  72.205  18.315   2.339
   45    H    GLN   6           HN       GLN   6  73.372  19.409  -1.909
   46    HA   GLN   6           HA       GLN   6  71.434  21.387  -0.869
   47   1HB   GLN   6           HB2      GLN   6  72.654  20.763  -3.520
   48   2HB   GLN   6           HB1      GLN   6  71.045  21.486  -3.520
   49   1HG   GLN   6           HG2      GLN   6  71.780  23.457  -2.534
   50   2HG   GLN   6           HG1      GLN   6  73.161  22.676  -1.763
   51   1HE2  GLN   6          HE22      GLN   6  75.339  23.399  -4.427
   52   2HE2  GLN   6          HE21      GLN   6  75.149  22.860  -2.828
   53    H    ALA   7           HN       ALA   7  69.276  21.307  -2.310
   54    HA   ALA   7           HA       ALA   7  67.841  18.982  -1.484
   55   1HB   ALA   7           HB2      ALA   7  67.243  21.297  -3.303
   56   2HB   ALA   7           HB1      ALA   7  66.131  19.928  -3.244
   57   3HB   ALA   7           HB3      ALA   7  66.471  20.851  -1.780
   58    NH1  ARG   8           NH2      ARG   8  70.453  13.089  -6.572
   59    NH2  ARG   8           NH1      ARG   8  71.348  13.256  -8.640
   60    H    ARG   8           HN       ARG   8  68.583  17.043  -2.313
   61    HA   ARG   8           HA       ARG   8  68.033  16.490  -5.114
   62   1HB   ARG   8           HB2      ARG   8  70.754  17.063  -4.204
   63   2HB   ARG   8           HB1      ARG   8  70.625  15.465  -4.936
   64   1HG   ARG   8           HG2      ARG   8  69.331  17.796  -6.311
   65   2HG   ARG   8           HG1      ARG   8  71.077  17.582  -6.450
   66   1HD   ARG   8           HD2      ARG   8  69.051  15.410  -7.059
   67   2HD   ARG   8           HD1      ARG   8  69.783  16.449  -8.282
   68    HE   ARG   8           HE       ARG   8  72.017  15.484  -7.257
   69   1HH1  ARG   8          HH21      ARG   8  70.167  13.517  -5.715
   70   2HH1  ARG   8          HH22      ARG   8  70.342  12.103  -6.700
   71   1HH2  ARG   8          HH11      ARG   8  71.747  13.813  -9.369
   72   2HH2  ARG   8          HH12      ARG   8  71.238  12.270  -8.767
   73    H    LYS   9           HN       LYS   9  70.159  15.035  -2.633
   74    HA   LYS   9           HA       LYS   9  68.881  12.443  -3.030
   75   1HB   LYS   9           HB2      LYS   9  71.406  13.141  -2.336
   76   2HB   LYS   9           HB1      LYS   9  70.725  12.839  -0.738
   77   1HG   LYS   9           HG2      LYS   9  70.085  10.601  -1.344
   78   2HG   LYS   9           HG1      LYS   9  70.465  10.892  -3.042
   79   1HD   LYS   9           HD2      LYS   9  72.862  11.453  -2.118
   80   2HD   LYS   9           HD1      LYS   9  72.337  10.510  -0.724
   81   1HE   LYS   9           HE2      LYS   9  71.737   9.260  -3.329
   82   2HE   LYS   9           HE1      LYS   9  73.457   9.434  -2.983
   83   1HZ   LYS   9           HZ2      LYS   9  72.794   8.507  -0.687
   84   2HZ   LYS   9           HZ1      LYS   9  71.409   7.939  -1.490
   85   3HZ   LYS   9           HZ3      LYS   9  72.947   7.435  -1.996
   86    NH1  ARG  10           NH2      ARG  10  64.652  16.013   4.876
   87    NH2  ARG  10           NH1      ARG  10  66.261  17.519   5.378
   88    H    ARG  10           HN       ARG  10  66.711  13.159  -2.329
   89    HA   ARG  10           HA       ARG  10  66.295  12.646   0.503
   90   1HB   ARG  10           HB2      ARG  10  66.268  15.385  -0.579
   91   2HB   ARG  10           HB1      ARG  10  64.807  14.961   0.312
   92   1HG   ARG  10           HG2      ARG  10  66.522  13.997   2.072
   93   2HG   ARG  10           HG1      ARG  10  67.641  15.113   1.285
   94   1HD   ARG  10           HD2      ARG  10  66.224  16.997   1.766
   95   2HD   ARG  10           HD1      ARG  10  64.917  15.947   2.312
   96    HE   ARG  10           HE       ARG  10  67.459  15.776   3.814
   97   1HH1  ARG  10          HH21      ARG  10  64.314  15.265   4.304
   98   2HH1  ARG  10          HH22      ARG  10  64.095  16.355   5.633
   99   1HH2  ARG  10          HH11      ARG  10  67.155  17.926   5.192
  100   2HH2  ARG  10          HH12      ARG  10  65.704  17.862   6.135
  101    H    LYS  11           HN       LYS  11  65.123  10.879  -0.535
  102    HA   LYS  11           HA       LYS  11  62.782  11.554  -2.158
  103   1HB   LYS  11           HB2      LYS  11  64.242   9.082  -1.408
  104   2HB   LYS  11           HB1      LYS  11  62.512   8.904  -1.698
  105   1HG   LYS  11           HG2      LYS  11  63.242   8.667  -3.866
  106   2HG   LYS  11           HG1      LYS  11  63.122  10.427  -3.823
  107   1HD   LYS  11           HD2      LYS  11  65.289  10.264  -4.571
  108   2HD   LYS  11           HD1      LYS  11  65.608  10.165  -2.840
  109   1HE   LYS  11           HE2      LYS  11  66.645   8.208  -3.300
  110   2HE   LYS  11           HE1      LYS  11  65.030   7.536  -3.517
  111   1HZ   LYS  11           HZ3      LYS  11  65.216   8.397  -5.880
  112   2HZ   LYS  11           HZ2      LYS  11  66.877   8.581  -5.575
  113   3HZ   LYS  11           HZ1      LYS  11  66.160   7.044  -5.481
  114    NH1  ARG  12           NH1      ARG  12  61.342  12.180   5.483
  115    NH2  ARG  12           NH2      ARG  12  61.793  14.234   6.313
  116    H    ARG  12           HN       ARG  12  61.294  12.593  -0.818
  117    HA   ARG  12           HA       ARG  12  59.869  10.889   1.098
  118   1HB   ARG  12           HB2      ARG  12  60.053  12.602   2.938
  119   2HB   ARG  12           HB1      ARG  12  61.561  11.754   2.596
  120   1HG   ARG  12           HG2      ARG  12  62.487  13.607   1.464
  121   2HG   ARG  12           HG1      ARG  12  60.913  14.372   1.248
  122   1HD   ARG  12           HD2      ARG  12  62.293  15.451   3.041
  123   2HD   ARG  12           HD1      ARG  12  60.750  14.833   3.628
  124    HE   ARG  12           HE       ARG  12  63.338  13.380   4.015
  125   1HH1  ARG  12          HH11      ARG  12  61.390  11.518   4.735
  126   2HH1  ARG  12          HH12      ARG  12  60.900  11.929   6.345
  127   1HH2  ARG  12          HH21      ARG  12  62.187  15.146   6.200
  128   2HH2  ARG  12          HH22      ARG  12  61.351  13.983   7.174
  129    H    THR  13           HN       THR  13  59.206  12.167  -1.403
  130    HA   THR  13           HA       THR  13  57.598  14.539  -0.803
  131    HB   THR  13           HB       THR  13  57.400  12.800  -3.272
  132    HG1  THR  13           HG1      THR  13  59.478  13.256  -3.346
  133   1HG2  THR  13          HG23      THR  13  55.938  14.965  -2.528
  134   2HG2  THR  13          HG22      THR  13  57.273  15.757  -3.365
  135   3HG2  THR  13          HG21      THR  13  56.290  14.560  -4.208
  136    H    SER  14           HN       SER  14  57.117  11.081  -1.181
  137    HA   SER  14           HA       SER  14  54.566  11.248   0.228
  138   1HB   SER  14           HB2      SER  14  54.726  10.708  -2.707
  139   2HB   SER  14           HB1      SER  14  53.584   9.758  -1.761
  140    HG   SER  14           HG       SER  14  53.579  12.442  -2.412
  141    H    ILE  15           HN       ILE  15  57.208  10.040   0.547
  142    HA   ILE  15           HA       ILE  15  56.323   7.318   1.208
  143    HB   ILE  15           HB       ILE  15  58.604   7.855  -0.715
  144   1HG1  ILE  15          HG12      ILE  15  56.339   7.610  -1.704
  145   2HG1  ILE  15          HG11      ILE  15  57.384   6.265  -2.146
  146   1HG2  ILE  15          HG22      ILE  15  58.198   5.661   1.225
  147   2HG2  ILE  15          HG21      ILE  15  58.510   5.122  -0.424
  148   3HG2  ILE  15          HG23      ILE  15  59.669   6.168   0.396
  149   1HD1  ILE  15          HD11      ILE  15  56.155   5.495   0.283
  150   2HD1  ILE  15          HD13      ILE  15  54.872   6.202  -0.701
  151   3HD1  ILE  15          HD12      ILE  15  55.827   4.860  -1.327
  152    H    GLU  16           HN       GLU  16  56.589   8.606   3.257
  153    HA   GLU  16           HA       GLU  16  59.174   9.411   4.172
  154   1HB   GLU  16           HB2      GLU  16  56.865   9.995   5.172
  155   2HB   GLU  16           HB1      GLU  16  56.949   8.418   5.956
  156   1HG   GLU  16           HG2      GLU  16  58.807   9.017   7.255
  157   2HG   GLU  16           HG1      GLU  16  59.255  10.337   6.175
  158    H    ASN  17           HN       ASN  17  60.546   8.234   5.657
  159    HA   ASN  17           HA       ASN  17  60.983   5.513   4.956
  160   1HB   ASN  17           HB2      ASN  17  62.564   7.255   6.137
  161   2HB   ASN  17           HB1      ASN  17  61.875   6.593   7.619
  162   1HD2  ASN  17          HD22      ASN  17  63.920   3.742   7.501
  163   2HD2  ASN  17          HD21      ASN  17  62.956   4.792   8.422
  164    NH1  ARG  18           NH1      ARG  18  58.473   8.417  13.886
  165    NH2  ARG  18           NH2      ARG  18  56.215   8.364  13.989
  166    H    ARG  18           HN       ARG  18  58.867   6.962   7.305
  167    HA   ARG  18           HA       ARG  18  58.458   4.468   8.787
  168   1HB   ARG  18           HB2      ARG  18  56.966   7.110   8.825
  169   2HB   ARG  18           HB1      ARG  18  56.651   5.763   9.920
  170   1HG   ARG  18           HG2      ARG  18  58.834   5.920  10.889
  171   2HG   ARG  18           HG1      ARG  18  59.384   7.028   9.632
  172   1HD   ARG  18           HD2      ARG  18  58.923   8.474  11.422
  173   2HD   ARG  18           HD1      ARG  18  57.441   8.555  10.469
  174    HE   ARG  18           HE       ARG  18  56.750   6.604  12.159
  175   1HH1  ARG  18          HH11      ARG  18  59.323   8.190  13.411
  176   2HH1  ARG  18          HH12      ARG  18  58.501   8.912  14.754
  177   1HH2  ARG  18          HH21      ARG  18  55.336   8.097  13.593
  178   2HH2  ARG  18          HH22      ARG  18  56.242   8.859  14.857
  179    H    VAL  19           HN       VAL  19  56.981   6.207   6.102
  180    HA   VAL  19           HA       VAL  19  54.519   4.747   6.085
  181    HB   VAL  19           HB       VAL  19  55.367   6.910   4.672
  182   1HG1  VAL  19          HG11      VAL  19  55.582   4.580   2.743
  183   2HG1  VAL  19          HG13      VAL  19  55.250   6.227   2.238
  184   3HG1  VAL  19          HG12      VAL  19  56.769   5.849   3.044
  185   1HG2  VAL  19          HG21      VAL  19  53.203   4.911   3.983
  186   2HG2  VAL  19          HG23      VAL  19  53.057   6.317   5.038
  187   3HG2  VAL  19          HG22      VAL  19  53.284   6.535   3.302
  188    NH1  ARG  20           NH2      ARG  20  62.893   4.815   1.613
  189    NH2  ARG  20           NH1      ARG  20  62.181   5.198  -0.498
  190    H    ARG  20           HN       ARG  20  57.614   4.207   4.428
  191    HA   ARG  20           HA       ARG  20  56.787   1.861   3.017
  192   1HB   ARG  20           HB2      ARG  20  59.525   2.636   4.062
  193   2HB   ARG  20           HB1      ARG  20  59.228   1.324   2.921
  194   1HG   ARG  20           HG2      ARG  20  58.847   2.748   1.177
  195   2HG   ARG  20           HG1      ARG  20  58.030   3.935   2.193
  196   1HD   ARG  20           HD2      ARG  20  59.908   5.169   2.268
  197   2HD   ARG  20           HD1      ARG  20  60.776   3.823   3.004
  198    HE   ARG  20           HE       ARG  20  60.643   3.266   0.246
  199   1HH1  ARG  20          HH21      ARG  20  62.758   4.393   2.509
  200   2HH1  ARG  20          HH22      ARG  20  63.710   5.364   1.437
  201   1HH2  ARG  20          HH11      ARG  20  61.500   5.070  -1.219
  202   2HH2  ARG  20          HH12      ARG  20  62.998   5.748  -0.674
  203    CH2  TRP  21           CH2      TRP  21  61.616  -1.596   3.807
  204    H    TRP  21           HN       TRP  21  58.179   2.255   6.253
  205    HA   TRP  21           HA       TRP  21  57.935  -0.624   6.675
  206   1HB   TRP  21           HB2      TRP  21  58.877   1.495   8.607
  207   2HB   TRP  21           HB1      TRP  21  59.036  -0.258   8.818
  208    HD1  TRP  21           HD1      TRP  21  61.380   2.161   8.121
  209    HE1  TRP  21           HE1      TRP  21  63.041   1.609   6.220
  210    HE3  TRP  21           HE3      TRP  21  58.927  -1.711   5.840
  211    HZ2  TRP  21           HZ2      TRP  21  63.254  -0.225   3.984
  212    HZ3  TRP  21           HZ3      TRP  21  59.832  -2.790   3.862
  213    HH2  TRP  21           HH2      TRP  21  62.020  -2.098   2.941
  214    H    SER  22           HN       SER  22  55.777   1.806   6.692
  215    HA   SER  22           HA       SER  22  54.073   0.785   8.844
  216   1HB   SER  22           HB2      SER  22  53.866   3.177   8.207
  217   2HB   SER  22           HB1      SER  22  53.514   2.706   6.546
  218    HG   SER  22           HG       SER  22  51.524   2.694   7.231
  219    H    LEU  23           HN       LEU  23  54.612   0.590   5.357
  220    HA   LEU  23           HA       LEU  23  52.435  -1.080   4.552
  221   1HB   LEU  23           HB2      LEU  23  55.329  -1.154   3.648
  222   2HB   LEU  23           HB1      LEU  23  54.006  -1.901   2.795
  223    HG   LEU  23           HG       LEU  23  53.957   1.048   3.316
  224   1HD1  LEU  23          HD13      LEU  23  56.198   0.029   2.283
  225   2HD1  LEU  23          HD12      LEU  23  55.209  -0.096   0.829
  226   3HD1  LEU  23          HD11      LEU  23  55.475   1.474   1.583
  227   1HD2  LEU  23          HD22      LEU  23  52.011  -0.260   2.309
  228   2HD2  LEU  23          HD21      LEU  23  52.626   1.040   1.291
  229   3HD2  LEU  23          HD23      LEU  23  53.065  -0.630   0.944
  230    H    GLU  24           HN       GLU  24  55.718  -1.762   5.677
  231    HA   GLU  24           HA       GLU  24  55.609  -4.591   5.735
  232   1HB   GLU  24           HB2      GLU  24  57.391  -2.549   6.592
  233   2HB   GLU  24           HB1      GLU  24  57.165  -3.623   7.964
  234   1HG   GLU  24           HG2      GLU  24  57.530  -5.534   6.227
  235   2HG   GLU  24           HG1      GLU  24  58.245  -4.267   5.229
  236    H    THR  25           HN       THR  25  54.342  -2.226   7.990
  237    HA   THR  25           HA       THR  25  53.942  -4.021  10.202
  238    HB   THR  25           HB       THR  25  52.343  -1.543   9.493
  239    HG1  THR  25           HG1      THR  25  54.694  -1.832  11.052
  240   1HG2  THR  25          HG21      THR  25  52.731  -3.180  11.993
  241   2HG2  THR  25          HG23      THR  25  52.244  -1.487  12.077
  242   3HG2  THR  25          HG22      THR  25  51.222  -2.658  11.243
  243    H    MET  26           HN       MET  26  52.005  -3.099   7.399
  244    HA   MET  26           HA       MET  26  49.714  -4.722   8.274
  245   1HB   MET  26           HB2      MET  26  50.320  -2.895   6.012
  246   2HB   MET  26           HB1      MET  26  49.137  -4.165   5.695
  247   1HG   MET  26           HG2      MET  26  47.946  -3.462   7.811
  248   2HG   MET  26           HG1      MET  26  49.035  -2.077   7.887
  249   1HE   MET  26           HE3      MET  26  47.715  -0.089   7.615
  250   2HE   MET  26           HE2      MET  26  46.231   0.039   6.675
  251   3HE   MET  26           HE1      MET  26  46.332  -1.123   7.996
  252    H    PHE  27           HN       PHE  27  52.550  -5.270   6.291
  253    HA   PHE  27           HA       PHE  27  51.354  -7.664   5.037
  254   1HB   PHE  27           HB2      PHE  27  54.094  -6.383   4.761
  255   2HB   PHE  27           HB1      PHE  27  53.634  -7.885   3.965
  256    HD1  PHE  27           HD2      PHE  27  51.092  -7.671   2.899
  257    HD2  PHE  27           HD1      PHE  27  53.953  -4.505   3.389
  258    HE1  PHE  27           HE2      PHE  27  49.992  -6.396   1.078
  259    HE2  PHE  27           HE1      PHE  27  52.853  -3.230   1.569
  260    HZ   PHE  27           HZ       PHE  27  50.875  -4.177   0.413
  261    H    LEU  28           HN       LEU  28  53.274  -6.895   7.805
  262    HA   LEU  28           HA       LEU  28  54.348  -9.631   8.018
  263   1HB   LEU  28           HB2      LEU  28  54.668  -7.174   9.758
  264   2HB   LEU  28           HB1      LEU  28  55.416  -8.735  10.109
  265    HG   LEU  28           HG       LEU  28  55.791  -7.230   7.504
  266   1HD1  LEU  28          HD12      LEU  28  57.194  -7.076  10.120
  267   2HD1  LEU  28          HD11      LEU  28  58.218  -7.154   8.686
  268   3HD1  LEU  28          HD13      LEU  28  57.034  -5.858   8.855
  269   1HD2  LEU  28          HD23      LEU  28  56.991  -9.723   8.726
  270   2HD2  LEU  28          HD22      LEU  28  56.190  -9.554   7.164
  271   3HD2  LEU  28          HD21      LEU  28  57.787  -8.850   7.416
  272    H    LYS  29           HN       LYS  29  51.367  -8.460   8.557
  273    HA   LYS  29           HA       LYS  29  50.993  -9.832  11.170
  274   1HB   LYS  29           HB2      LYS  29  48.785  -8.781  11.228
  275   2HB   LYS  29           HB1      LYS  29  49.999  -7.550  10.900
  276   1HG   LYS  29           HG2      LYS  29  49.446  -8.087   8.376
  277   2HG   LYS  29           HG1      LYS  29  47.945  -8.725   9.046
  278   1HD   LYS  29           HD2      LYS  29  48.988  -5.965   9.720
  279   2HD   LYS  29           HD1      LYS  29  47.896  -6.264   8.369
  280   1HE   LYS  29           HE2      LYS  29  46.974  -7.532  10.842
  281   2HE   LYS  29           HE1      LYS  29  47.128  -5.782  10.996
  282   1HZ   LYS  29           HZ2      LYS  29  45.939  -5.777   8.719
  283   2HZ   LYS  29           HZ1      LYS  29  45.439  -7.340   9.161
  284   3HZ   LYS  29           HZ3      LYS  29  45.027  -6.013  10.133
  285    H    CYS  30           HN       CYS  30  50.032  -9.881   7.793
  286    HA   CYS  30           HA       CYS  30  49.198 -12.693   8.104
  287   1HB   CYS  30           HB2      CYS  30  47.505 -10.408   7.185
  288   2HB   CYS  30           HB1      CYS  30  47.335 -11.944   6.334
  289    HG   CYS  30           HG       CYS  30  46.867 -11.638   9.416
  290    HA   PRO  31           HA       PRO  31  51.628 -12.608   4.306
  291   1HB   PRO  31           HB2      PRO  31  51.629 -15.303   3.843
  292   2HB   PRO  31           HB1      PRO  31  52.640 -14.550   5.090
  293   1HG   PRO  31           HG2      PRO  31  50.183 -16.193   5.411
  294   2HG   PRO  31           HG1      PRO  31  51.501 -15.911   6.560
  295   1HD   PRO  31           HD2      PRO  31  48.934 -14.644   6.547
  296   2HD   PRO  31           HD1      PRO  31  50.315 -14.243   7.588
  297    H    LYS  32           HN       LYS  32  48.472 -12.562   4.366
  298    HA   LYS  32           HA       LYS  32  48.114 -13.746   1.672
  299   1HB   LYS  32           HB2      LYS  32  45.740 -14.159   2.350
  300   2HB   LYS  32           HB1      LYS  32  46.910 -15.065   3.312
  301   1HG   LYS  32           HG2      LYS  32  46.711 -13.562   5.156
  302   2HG   LYS  32           HG1      LYS  32  45.854 -12.366   4.183
  303   1HD   LYS  32           HD2      LYS  32  44.754 -15.139   4.689
  304   2HD   LYS  32           HD1      LYS  32  44.401 -13.770   5.744
  305   1HE   LYS  32           HE2      LYS  32  43.594 -12.520   3.700
  306   2HE   LYS  32           HE1      LYS  32  43.746 -14.029   2.798
  307   1HZ   LYS  32           HZ1      LYS  32  42.323 -14.985   4.694
  308   2HZ   LYS  32           HZ3      LYS  32  41.913 -13.370   5.011
  309   3HZ   LYS  32           HZ2      LYS  32  41.561 -14.053   3.496
  310    HA   PRO  33           HA       PRO  33  46.789  -9.209   1.778
  311   1HB   PRO  33           HB2      PRO  33  48.728  -8.172   0.127
  312   2HB   PRO  33           HB1      PRO  33  48.863  -8.202   1.894
  313   1HG   PRO  33           HG2      PRO  33  50.218  -9.930  -0.126
  314   2HG   PRO  33           HG1      PRO  33  50.772  -9.436   1.482
  315   1HD   PRO  33           HD2      PRO  33  49.687 -11.957   0.853
  316   2HD   PRO  33           HD1      PRO  33  49.835 -11.277   2.488
  317    H    SER  34           HN       SER  34  45.298  -8.700   0.210
  318    HA   SER  34           HA       SER  34  45.254 -10.305  -2.253
  319   1HB   SER  34           HB2      SER  34  43.009  -9.157  -2.537
  320   2HB   SER  34           HB1      SER  34  43.160 -10.195  -1.123
  321    HG   SER  34           HG       SER  34  42.272  -8.180  -0.565
  322    H    LEU  35           HN       LEU  35  45.019  -9.344  -4.350
  323    HA   LEU  35           HA       LEU  35  46.728  -7.092  -4.843
  324   1HB   LEU  35           HB2      LEU  35  44.553  -8.367  -6.533
  325   2HB   LEU  35           HB1      LEU  35  45.635  -7.106  -7.124
  326    HG   LEU  35           HG       LEU  35  47.079  -9.282  -5.793
  327   1HD1  LEU  35          HD13      LEU  35  45.280  -9.881  -8.146
  328   2HD1  LEU  35          HD12      LEU  35  46.737 -10.820  -7.824
  329   3HD1  LEU  35          HD11      LEU  35  45.435 -10.777  -6.635
  330   1HD2  LEU  35          HD21      LEU  35  47.723  -7.326  -7.518
  331   2HD2  LEU  35          HD23      LEU  35  48.629  -8.838  -7.442
  332   3HD2  LEU  35          HD22      LEU  35  47.399  -8.609  -8.684
  333    H    GLN  36           HN       GLN  36  43.413  -7.417  -3.864
  334    HA   GLN  36           HA       GLN  36  42.521  -4.772  -4.701
  335   1HB   GLN  36           HB2      GLN  36  41.231  -6.989  -3.743
  336   2HB   GLN  36           HB1      GLN  36  41.294  -5.995  -2.289
  337   1HG   GLN  36           HG2      GLN  36  39.423  -5.018  -3.133
  338   2HG   GLN  36           HG1      GLN  36  40.550  -4.141  -4.169
  339   1HE2  GLN  36          HE22      GLN  36  38.319  -7.198  -5.760
  340   2HE2  GLN  36          HE21      GLN  36  38.477  -7.065  -4.075
  341    H    GLN  37           HN       GLN  37  43.910  -6.221  -1.785
  342    HA   GLN  37           HA       GLN  37  43.890  -3.776  -0.236
  343   1HB   GLN  37           HB2      GLN  37  44.047  -5.995   0.850
  344   2HB   GLN  37           HB1      GLN  37  45.609  -6.261   0.077
  345   1HG   GLN  37           HG2      GLN  37  46.701  -4.992   1.610
  346   2HG   GLN  37           HG1      GLN  37  45.507  -3.698   1.504
  347   1HE2  GLN  37          HE22      GLN  37  44.276  -4.561   4.682
  348   2HE2  GLN  37          HE21      GLN  37  44.744  -3.342   3.598
  349    H    ILE  38           HN       ILE  38  45.917  -5.019  -2.786
  350    HA   ILE  38           HA       ILE  38  48.255  -3.455  -2.061
  351    HB   ILE  38           HB       ILE  38  47.468  -4.929  -4.587
  352   1HG1  ILE  38          HG12      ILE  38  48.149  -6.295  -2.654
  353   2HG1  ILE  38          HG11      ILE  38  49.375  -6.369  -3.917
  354   1HG2  ILE  38          HG22      ILE  38  49.753  -3.040  -4.079
  355   2HG2  ILE  38          HG21      ILE  38  50.043  -4.470  -5.070
  356   3HG2  ILE  38          HG23      ILE  38  48.825  -3.290  -5.558
  357   1HD1  ILE  38          HD13      ILE  38  50.181  -4.178  -2.418
  358   2HD1  ILE  38          HD12      ILE  38  49.569  -5.285  -1.190
  359   3HD1  ILE  38          HD11      ILE  38  50.852  -5.803  -2.283
  360    H    THR  39           HN       THR  39  45.395  -3.044  -4.038
  361    HA   THR  39           HA       THR  39  46.194  -0.545  -5.267
  362    HB   THR  39           HB       THR  39  43.436  -0.377  -5.096
  363    HG1  THR  39           HG1      THR  39  42.608  -2.296  -4.892
  364   1HG2  THR  39          HG22      THR  39  45.418  -1.352  -7.058
  365   2HG2  THR  39          HG21      THR  39  43.761  -1.883  -7.343
  366   3HG2  THR  39          HG23      THR  39  44.131  -0.161  -7.248
  367    H    HIS  40           HN       HIS  40  44.261  -1.391  -2.417
  368    HA   HIS  40           HA       HIS  40  43.927   1.325  -1.496
  369   1HB   HIS  40           HB2      HIS  40  42.749  -1.001  -0.805
  370   2HB   HIS  40           HB1      HIS  40  43.955  -0.907   0.479
  371    HD1  HIS  40           HD1      HIS  40  40.606  -0.015  -0.009
  372    HD2  HIS  40           HD2      HIS  40  43.889   2.093   1.458
  373    HE1  HIS  40           HE1      HIS  40  39.673   1.917   1.336
  374    H    ILE  41           HN       ILE  41  46.540  -0.946  -1.392
  375    HA   ILE  41           HA       ILE  41  47.932   0.084   0.924
  376    HB   ILE  41           HB       ILE  41  48.266  -1.975  -1.007
  377   1HG1  ILE  41          HG12      ILE  41  50.429  -2.261   0.692
  378   2HG1  ILE  41          HG11      ILE  41  49.326  -1.259   1.636
  379   1HG2  ILE  41          HG21      ILE  41  50.677  -0.173  -0.932
  380   2HG2  ILE  41          HG23      ILE  41  50.721  -1.855  -1.464
  381   3HG2  ILE  41          HG22      ILE  41  49.758  -0.674  -2.352
  382   1HD1  ILE  41          HD12      ILE  41  48.326  -3.712   0.198
  383   2HD1  ILE  41          HD11      ILE  41  49.078  -3.843   1.788
  384   3HD1  ILE  41          HD13      ILE  41  47.614  -2.881   1.581
  385    H    ALA  42           HN       ALA  42  47.959   0.700  -2.526
  386    HA   ALA  42           HA       ALA  42  50.019   2.641  -2.614
  387   1HB   ALA  42           HB2      ALA  42  48.878   1.481  -4.570
  388   2HB   ALA  42           HB1      ALA  42  47.543   2.613  -4.348
  389   3HB   ALA  42           HB3      ALA  42  49.146   3.212  -4.775
  390    H    ASN  43           HN       ASN  43  46.505   3.009  -2.285
  391    HA   ASN  43           HA       ASN  43  46.555   5.851  -1.899
  392   1HB   ASN  43           HB2      ASN  43  44.525   4.349  -2.419
  393   2HB   ASN  43           HB1      ASN  43  44.511   3.977  -0.695
  394   1HD2  ASN  43          HD22      ASN  43  43.753   7.875  -1.800
  395   2HD2  ASN  43          HD21      ASN  43  44.806   6.942  -2.750
  396    H    GLN  44           HN       GLN  44  47.350   3.149   0.140
  397    HA   GLN  44           HA       GLN  44  47.000   4.601   2.622
  398   1HB   GLN  44           HB2      GLN  44  47.252   2.614   3.666
  399   2HB   GLN  44           HB1      GLN  44  47.058   1.949   2.059
  400   1HG   GLN  44           HG2      GLN  44  48.961   0.831   2.769
  401   2HG   GLN  44           HG1      GLN  44  49.693   2.220   1.972
  402   1HE2  GLN  44          HE22      GLN  44  51.245   1.949   5.350
  403   2HE2  GLN  44          HE21      GLN  44  51.178   0.961   3.971
  404    H    LEU  45           HN       LEU  45  49.628   4.290   0.337
  405    HA   LEU  45           HA       LEU  45  51.162   6.081   2.159
  406   1HB   LEU  45           HB2      LEU  45  53.229   4.987   1.831
  407   2HB   LEU  45           HB1      LEU  45  52.078   3.701   2.163
  408    HG   LEU  45           HG       LEU  45  52.821   4.517  -0.646
  409   1HD1  LEU  45          HD12      LEU  45  54.504   3.272   1.287
  410   2HD1  LEU  45          HD11      LEU  45  53.989   2.015   0.165
  411   3HD1  LEU  45          HD13      LEU  45  54.797   3.458  -0.437
  412   1HD2  LEU  45          HD23      LEU  45  51.224   2.396   0.693
  413   2HD2  LEU  45          HD22      LEU  45  50.933   3.222  -0.837
  414   3HD2  LEU  45          HD21      LEU  45  52.135   1.935  -0.742
  415    H    GLY  46           HN       GLY  46  49.470   6.423  -0.335
  416   1HA   GLY  46           HA2      GLY  46  49.496   7.696  -2.295
  417   2HA   GLY  46           HA1      GLY  46  50.646   8.682  -1.408
  418    H    LEU  47           HN       LEU  47  51.472   5.366  -2.322
  419    HA   LEU  47           HA       LEU  47  53.458   6.557  -4.204
  420   1HB   LEU  47           HB2      LEU  47  55.001   4.995  -3.586
  421   2HB   LEU  47           HB1      LEU  47  54.010   4.875  -2.149
  422    HG   LEU  47           HG       LEU  47  53.990   3.048  -4.548
  423   1HD1  LEU  47          HD12      LEU  47  55.556   3.013  -2.265
  424   2HD1  LEU  47          HD11      LEU  47  54.256   1.892  -1.868
  425   3HD1  LEU  47          HD13      LEU  47  55.239   1.627  -3.304
  426   1HD2  LEU  47          HD23      LEU  47  51.932   3.542  -2.525
  427   2HD2  LEU  47          HD22      LEU  47  51.798   2.740  -4.081
  428   3HD2  LEU  47          HD21      LEU  47  52.377   1.853  -2.679
  429    H    GLU  48           HN       GLU  48  54.056   4.791  -5.994
  430    HA   GLU  48           HA       GLU  48  51.524   4.310  -7.455
  431   1HB   GLU  48           HB2      GLU  48  53.107   3.713  -9.349
  432   2HB   GLU  48           HB1      GLU  48  53.232   5.371  -8.774
  433   1HG   GLU  48           HG2      GLU  48  54.980   3.485  -7.340
  434   2HG   GLU  48           HG1      GLU  48  55.352   3.635  -9.057
  435    H    LYS  49           HN       LYS  49  52.020   2.124  -8.980
  436    HA   LYS  49           HA       LYS  49  52.048  -0.045  -6.973
  437   1HB   LYS  49           HB2      LYS  49  51.446  -0.090  -9.943
  438   2HB   LYS  49           HB1      LYS  49  51.280  -1.464  -8.851
  439   1HG   LYS  49           HG2      LYS  49  49.246  -0.758  -8.190
  440   2HG   LYS  49           HG1      LYS  49  49.899   0.812  -7.730
  441   1HD   LYS  49           HD2      LYS  49  49.688   1.603 -10.044
  442   2HD   LYS  49           HD1      LYS  49  49.085   0.023 -10.543
  443   1HE   LYS  49           HE2      LYS  49  47.740   1.690  -8.406
  444   2HE   LYS  49           HE1      LYS  49  47.296   1.779 -10.110
  445   1HZ   LYS  49           HZ3      LYS  49  46.957  -0.668 -10.025
  446   2HZ   LYS  49           HZ2      LYS  49  47.173  -0.599  -8.341
  447   3HZ   LYS  49           HZ1      LYS  49  45.870   0.214  -9.067
  448    H    ASP  50           HN       ASP  50  54.288   1.482  -9.033
  449    HA   ASP  50           HA       ASP  50  55.853  -0.905  -9.666
  450   1HB   ASP  50           HB2      ASP  50  56.018   2.008 -10.229
  451   2HB   ASP  50           HB1      ASP  50  57.556   1.148 -10.152
  452    H    VAL  51           HN       VAL  51  56.123   1.846  -7.362
  453    HA   VAL  51           HA       VAL  51  58.564   0.690  -6.219
  454    HB   VAL  51           HB       VAL  51  58.211   3.150  -6.239
  455   1HG1  VAL  51          HG12      VAL  51  55.670   2.362  -5.079
  456   2HG1  VAL  51          HG11      VAL  51  56.477   3.553  -4.061
  457   3HG1  VAL  51          HG13      VAL  51  56.143   3.916  -5.755
  458   1HG2  VAL  51          HG22      VAL  51  59.638   2.037  -4.511
  459   2HG2  VAL  51          HG21      VAL  51  58.922   3.543  -3.938
  460   3HG2  VAL  51          HG23      VAL  51  58.243   1.996  -3.433
  461    H    VAL  52           HN       VAL  52  55.126   0.396  -5.768
  462    HA   VAL  52           HA       VAL  52  55.346  -0.642  -3.046
  463    HB   VAL  52           HB       VAL  52  53.291   0.508  -4.341
  464   1HG1  VAL  52          HG11      VAL  52  53.098  -1.468  -5.923
  465   2HG1  VAL  52          HG13      VAL  52  52.543  -2.409  -4.537
  466   3HG1  VAL  52          HG12      VAL  52  51.616  -1.011  -5.082
  467   1HG2  VAL  52          HG22      VAL  52  53.659  -0.371  -1.892
  468   2HG2  VAL  52          HG21      VAL  52  52.037  -0.011  -2.470
  469   3HG2  VAL  52          HG23      VAL  52  52.599  -1.678  -2.417
  470    NH1  ARG  53           NH2      ARG  53  57.434  -9.278  -8.652
  471    NH2  ARG  53           NH1      ARG  53  58.342  -7.908 -10.204
  472    H    ARG  53           HN       ARG  53  55.246  -1.964  -6.310
  473    HA   ARG  53           HA       ARG  53  54.946  -4.727  -5.415
  474   1HB   ARG  53           HB2      ARG  53  54.301  -3.759  -7.715
  475   2HB   ARG  53           HB1      ARG  53  56.021  -3.854  -8.099
  476   1HG   ARG  53           HG2      ARG  53  54.579  -6.244  -6.966
  477   2HG   ARG  53           HG1      ARG  53  54.501  -5.890  -8.692
  478   1HD   ARG  53           HD2      ARG  53  57.197  -5.613  -8.163
  479   2HD   ARG  53           HD1      ARG  53  56.737  -6.941  -7.097
  480    HE   ARG  53           HE       ARG  53  55.680  -7.281  -9.781
  481   1HH1  ARG  53          HH21      ARG  53  56.715  -9.476  -7.986
  482   2HH1  ARG  53          HH22      ARG  53  58.178  -9.931  -8.794
  483   1HH2  ARG  53          HH11      ARG  53  58.318  -7.056 -10.728
  484   2HH2  ARG  53          HH12      ARG  53  59.085  -8.561 -10.345
  485    H    VAL  54           HN       VAL  54  57.647  -2.685  -6.521
  486    HA   VAL  54           HA       VAL  54  59.627  -4.785  -6.308
  487    HB   VAL  54           HB       VAL  54  59.989  -1.770  -6.242
  488   1HG1  VAL  54          HG13      VAL  54  61.922  -4.031  -6.851
  489   2HG1  VAL  54          HG12      VAL  54  62.282  -2.314  -7.037
  490   3HG1  VAL  54          HG11      VAL  54  61.966  -2.980  -5.435
  491   1HG2  VAL  54          HG23      VAL  54  58.788  -2.728  -8.260
  492   2HG2  VAL  54          HG22      VAL  54  60.307  -1.911  -8.628
  493   3HG2  VAL  54          HG21      VAL  54  60.241  -3.673  -8.588
  494    CH2  TRP  55           CH2      TRP  55  56.372  -3.159   2.996
  495    H    TRP  55           HN       TRP  55  58.378  -2.305  -4.135
  496    HA   TRP  55           HA       TRP  55  60.332  -2.718  -2.050
  497   1HB   TRP  55           HB2      TRP  55  59.065  -0.644  -2.097
  498   2HB   TRP  55           HB1      TRP  55  57.539  -1.518  -2.026
  499    HD1  TRP  55           HD1      TRP  55  60.341  -0.185   0.172
  500    HE1  TRP  55           HE1      TRP  55  59.727  -0.586   2.608
  501    HE3  TRP  55           HE3      TRP  55  56.256  -3.222  -0.394
  502    HZ2  TRP  55           HZ2      TRP  55  57.823  -2.076   4.164
  503    HZ3  TRP  55           HZ3      TRP  55  55.062  -4.113   1.577
  504    HH2  TRP  55           HH2      TRP  55  55.852  -3.552   3.854
  505    H    PHE  56           HN       PHE  56  57.212  -4.227  -2.839
  506    HA   PHE  56           HA       PHE  56  57.416  -5.853  -0.391
  507   1HB   PHE  56           HB2      PHE  56  55.185  -4.952  -1.396
  508   2HB   PHE  56           HB1      PHE  56  55.325  -6.332  -2.489
  509    HD1  PHE  56           HD1      PHE  56  56.154  -5.852   1.149
  510    HD2  PHE  56           HD2      PHE  56  53.932  -8.081  -1.772
  511    HE1  PHE  56           HE1      PHE  56  55.337  -7.355   2.929
  512    HE2  PHE  56           HE2      PHE  56  53.116  -9.593   0.018
  513    HZ   PHE  56           HZ       PHE  56  53.827  -9.225   2.370
  514    H    CYS  57           HN       CYS  57  58.640  -6.026  -3.530
  515    HA   CYS  57           HA       CYS  57  58.406  -8.884  -3.942
  516   1HB   CYS  57           HB2      CYS  57  58.942  -7.213  -5.765
  517   2HB   CYS  57           HB1      CYS  57  60.534  -7.013  -5.033
  518    HG   CYS  57           HG       CYS  57  59.968  -9.134  -6.950
  519    H    ASN  58           HN       ASN  58  60.764  -6.718  -2.454
  520    HA   ASN  58           HA       ASN  58  62.601  -8.888  -1.768
  521   1HB   ASN  58           HB2      ASN  58  63.081  -6.301  -2.053
  522   2HB   ASN  58           HB1      ASN  58  62.579  -6.230  -0.364
  523   1HD2  ASN  58          HD22      ASN  58  65.372  -8.261   0.758
  524   2HD2  ASN  58          HD21      ASN  58  63.721  -8.017   1.064
  525    NH1  ARG  59           NH1      ARG  59  62.840  -4.898   4.006
  526    NH2  ARG  59           NH2      ARG  59  63.075  -7.047   4.666
  527    H    ARG  59           HN       ARG  59  60.063  -6.973  -0.193
  528    HA   ARG  59           HA       ARG  59  60.375  -8.058   2.443
  529   1HB   ARG  59           HB2      ARG  59  58.552  -6.312   1.094
  530   2HB   ARG  59           HB1      ARG  59  57.592  -7.525   1.942
  531   1HG   ARG  59           HG2      ARG  59  58.061  -5.543   3.357
  532   2HG   ARG  59           HG1      ARG  59  58.756  -7.015   4.033
  533   1HD   ARG  59           HD2      ARG  59  60.704  -5.879   2.279
  534   2HD   ARG  59           HD1      ARG  59  60.099  -4.590   3.309
  535    HE   ARG  59           HE       ARG  59  60.570  -6.635   5.093
  536   1HH1  ARG  59          HH11      ARG  59  62.252  -4.129   3.755
  537   2HH1  ARG  59          HH12      ARG  59  63.834  -4.789   4.001
  538   1HH2  ARG  59          HH21      ARG  59  62.668  -7.925   4.921
  539   2HH2  ARG  59          HH22      ARG  59  64.069  -6.940   4.662
  540    NH1  ARG  60           NH1      ARG  60  57.349 -12.805  -3.985
  541    NH2  ARG  60           NH2      ARG  60  56.682 -10.985  -5.148
  542    H    ARG  60           HN       ARG  60  59.056  -9.424  -0.478
  543    HA   ARG  60           HA       ARG  60  57.575 -11.531   0.957
  544   1HB   ARG  60           HB2      ARG  60  58.062 -10.856  -1.941
  545   2HB   ARG  60           HB1      ARG  60  57.403 -12.427  -1.486
  546   1HG   ARG  60           HG2      ARG  60  55.456 -11.478  -0.556
  547   2HG   ARG  60           HG1      ARG  60  56.190  -9.879  -0.423
  548   1HD   ARG  60           HD2      ARG  60  54.560 -10.025  -2.307
  549   2HD   ARG  60           HD1      ARG  60  56.191  -9.636  -2.854
  550    HE   ARG  60           HE       ARG  60  54.834 -12.257  -3.215
  551   1HH1  ARG  60          HH11      ARG  60  57.234 -13.430  -3.212
  552   2HH1  ARG  60          HH12      ARG  60  58.090 -12.952  -4.640
  553   1HH2  ARG  60          HH21      ARG  60  56.055 -10.215  -5.266
  554   2HH2  ARG  60          HH22      ARG  60  57.424 -11.131  -5.802
  555    H    GLN  61           HN       GLN  61  60.544 -11.161  -0.949
  556    HA   GLN  61           HA       GLN  61  61.499 -13.755   0.190
  557   1HB   GLN  61           HB2      GLN  61  62.713 -14.111  -2.006
  558   2HB   GLN  61           HB1      GLN  61  60.958 -14.253  -2.109
  559   1HG   GLN  61           HG2      GLN  61  60.760 -12.032  -3.032
  560   2HG   GLN  61           HG1      GLN  61  62.466 -11.700  -2.732
  561   1HE2  GLN  61          HE22      GLN  61  63.597 -13.466  -5.604
  562   2HE2  GLN  61          HE21      GLN  61  64.057 -12.743  -4.139
  563    H    LYS  62           HN       LYS  62  62.276 -11.923   1.686
  564    HA   LYS  62           HA       LYS  62  64.545 -10.347   0.729
  565   1HB   LYS  62           HB2      LYS  62  64.803  -9.789   3.165
  566   2HB   LYS  62           HB1      LYS  62  63.188  -9.450   2.542
  567   1HG   LYS  62           HG2      LYS  62  62.217 -11.178   3.721
  568   2HG   LYS  62           HG1      LYS  62  63.680 -12.162   3.690
  569   1HD   LYS  62           HD2      LYS  62  64.699 -10.373   5.245
  570   2HD   LYS  62           HD1      LYS  62  63.044  -9.815   5.480
  571   1HE   LYS  62           HE2      LYS  62  62.551 -11.550   6.844
  572   2HE   LYS  62           HE1      LYS  62  63.285 -12.722   5.749
  573   1HZ   LYS  62           HZ1      LYS  62  64.756 -10.967   7.641
  574   2HZ   LYS  62           HZ3      LYS  62  64.457 -12.622   7.859
  575   3HZ   LYS  62           HZ2      LYS  62  65.458 -12.101   6.588
  576    H    GLY  63           HN       GLY  63  64.031 -13.513   2.087
  577   1HA   GLY  63           HA2      GLY  63  66.856 -14.152   1.719
  578   2HA   GLY  63           HA1      GLY  63  66.315 -14.218   3.397
  579    H    LYS  64           HN       LYS  64  64.592 -15.122   0.413
  580    HA   LYS  64           HA       LYS  64  64.093 -17.796   1.634
  581   1HB   LYS  64           HB2      LYS  64  62.591 -16.014  -0.208
  582   2HB   LYS  64           HB1      LYS  64  62.484 -17.740  -0.556
  583   1HG   LYS  64           HG2      LYS  64  61.503 -18.231   1.513
  584   2HG   LYS  64           HG1      LYS  64  62.106 -16.751   2.260
  585   1HD   LYS  64           HD2      LYS  64  60.443 -15.433   1.315
  586   2HD   LYS  64           HD1      LYS  64  60.211 -16.525  -0.051
  587   1HE   LYS  64           HE2      LYS  64  59.600 -17.615   2.650
  588   2HE   LYS  64           HE1      LYS  64  58.480 -16.414   2.007
  589   1HZ   LYS  64           HZ1      LYS  64  58.603 -17.841  -0.112
  590   2HZ   LYS  64           HZ3      LYS  64  59.193 -19.056   0.914
  591   3HZ   LYS  64           HZ2      LYS  64  57.654 -18.389   1.187
  592    NH1  ARG  65           NH1      ARG  65  66.376 -13.868  -5.829
  593    NH2  ARG  65           NH2      ARG  65  68.602 -14.225  -6.003
  594    H    ARG  65           HN       ARG  65  66.645 -17.142   0.406
  595    HA   ARG  65           HA       ARG  65  66.563 -19.012  -1.931
  596   1HB   ARG  65           HB2      ARG  65  67.928 -16.393  -1.547
  597   2HB   ARG  65           HB1      ARG  65  68.836 -17.644  -2.397
  598   1HG   ARG  65           HG2      ARG  65  66.485 -17.929  -3.659
  599   2HG   ARG  65           HG1      ARG  65  66.343 -16.228  -3.212
  600   1HD   ARG  65           HD2      ARG  65  68.751 -16.003  -4.158
  601   2HD   ARG  65           HD1      ARG  65  68.427 -17.549  -4.941
  602    HE   ARG  65           HE       ARG  65  66.558 -16.452  -6.138
  603   1HH1  ARG  65          HH11      ARG  65  65.452 -14.220  -5.681
  604   2HH1  ARG  65          HH12      ARG  65  66.519 -12.892  -5.991
  605   1HH2  ARG  65          HH21      ARG  65  69.383 -14.850  -5.989
  606   2HH2  ARG  65          HH22      ARG  65  68.746 -13.249  -6.165
  607    H    SER  66           HN       SER  66  66.976 -19.586   0.955
  608    HA   SER  66           HA       SER  66  69.732 -20.734   0.755
  609   1HB   SER  66           HB2      SER  66  69.866 -19.026   2.428
  610   2HB   SER  66           HB1      SER  66  68.328 -19.507   3.139
  611    HG   SER  66           HG       SER  66  70.503 -20.257   4.063
  612    H    SER  67           HN       SER  67  68.600 -22.633  -0.136
  613    HA   SER  67           HA       SER  67  67.658 -24.412   2.036
  614   1HB   SER  67           HB2      SER  67  65.840 -23.158   0.303
  615   2HB   SER  67           HB1      SER  67  66.013 -24.789  -0.339
  616    HG   SER  67           HG       SER  67  64.619 -24.018   1.750
   
  Start of MODEL          15
 Raw file had  616 H/Q atoms
  Start of MODEL   15
    1   1H    MET   1           HT3      MET   1  55.570  12.905  12.745
    2   2H    MET   1           HT2      MET   1  53.947  12.845  13.243
    3   3H    MET   1           HT1      MET   1  54.465  11.923  11.914
    4    HA   MET   1           HA       MET   1  54.787  13.825  10.574
    5   1HB   MET   1           HB2      MET   1  52.364  12.981  11.275
    6   2HB   MET   1           HB1      MET   1  52.271  14.583  12.008
    7   1HG   MET   1           HG2      MET   1  53.160  15.436   9.717
    8   2HG   MET   1           HG1      MET   1  52.654  13.860   9.109
    9   1HE   MET   1           HE1      MET   1  51.913  16.499   8.142
   10   2HE   MET   1           HE3      MET   1  50.734  15.403   7.406
   11   3HE   MET   1           HE2      MET   1  50.194  16.879   8.202
   12    H    GLU   2           HN       GLU   2  56.366  15.328  11.077
   13    HA   GLU   2           HA       GLU   2  57.285  17.322  11.899
   14   1HB   GLU   2           HB2      GLU   2  54.778  17.966  11.174
   15   2HB   GLU   2           HB1      GLU   2  54.644  18.268  12.906
   16   1HG   GLU   2           HG2      GLU   2  57.069  19.436  12.315
   17   2HG   GLU   2           HG1      GLU   2  56.142  19.760  10.851
   18    H    THR   3           HN       THR   3  56.874  14.961  13.686
   19    HA   THR   3           HA       THR   3  56.462  16.239  16.331
   20    HB   THR   3           HB       THR   3  57.116  13.337  15.783
   21    HG1  THR   3           HG1      THR   3  54.938  12.992  15.612
   22   1HG2  THR   3          HG22      THR   3  57.254  14.328  18.121
   23   2HG2  THR   3          HG21      THR   3  55.515  14.602  18.013
   24   3HG2  THR   3          HG23      THR   3  56.154  12.960  17.941
   25    H    LEU   4           HN       LEU   4  58.983  14.895  14.292
   26    HA   LEU   4           HA       LEU   4  60.990  14.985  16.443
   27   1HB   LEU   4           HB2      LEU   4  60.780  13.449  14.210
   28   2HB   LEU   4           HB1      LEU   4  61.856  14.713  13.616
   29    HG   LEU   4           HG       LEU   4  62.341  13.300  16.243
   30   1HD1  LEU   4          HD12      LEU   4  62.273  11.888  13.970
   31   2HD1  LEU   4          HD11      LEU   4  63.886  12.579  13.792
   32   3HD1  LEU   4          HD13      LEU   4  63.499  11.597  15.205
   33   1HD2  LEU   4          HD21      LEU   4  63.777  15.235  14.479
   34   2HD2  LEU   4          HD23      LEU   4  63.737  15.138  16.240
   35   3HD2  LEU   4          HD22      LEU   4  64.753  14.029  15.318
   36    H    VAL   5           HN       VAL   5  61.897  16.899  16.993
   37    HA   VAL   5           HA       VAL   5  61.925  19.117  15.017
   38    HB   VAL   5           HB       VAL   5  62.636  19.150  17.967
   39   1HG1  VAL   5          HG11      VAL   5  63.445  20.979  16.258
   40   2HG1  VAL   5          HG13      VAL   5  61.766  21.513  16.326
   41   3HG1  VAL   5          HG12      VAL   5  62.741  21.477  17.795
   42   1HG2  VAL   5          HG22      VAL   5  60.149  18.642  16.979
   43   2HG2  VAL   5          HG21      VAL   5  60.436  19.522  18.479
   44   3HG2  VAL   5          HG23      VAL   5  60.130  20.405  16.984
   45    H    GLN   6           HN       GLN   6  64.083  17.174  17.036
   46    HA   GLN   6           HA       GLN   6  66.444  18.488  15.794
   47   1HB   GLN   6           HB2      GLN   6  67.727  17.154  17.502
   48   2HB   GLN   6           HB1      GLN   6  66.566  18.278  18.209
   49   1HG   GLN   6           HG2      GLN   6  65.043  16.558  18.744
   50   2HG   GLN   6           HG1      GLN   6  65.801  15.420  17.630
   51   1HE2  GLN   6          HE22      GLN   6  68.299  14.402  19.940
   52   2HE2  GLN   6          HE21      GLN   6  67.782  14.354  18.324
   53    H    ALA   7           HN       ALA   7  65.330  17.188  13.829
   54    HA   ALA   7           HA       ALA   7  65.819  14.370  13.645
   55   1HB   ALA   7           HB3      ALA   7  65.129  16.562  11.749
   56   2HB   ALA   7           HB2      ALA   7  65.818  15.092  11.060
   57   3HB   ALA   7           HB1      ALA   7  64.333  15.010  12.008
   58    NH1  ARG   8           NH2      ARG   8  72.927  12.032  16.584
   59    NH2  ARG   8           NH1      ARG   8  74.140  13.844  17.183
   60    H    ARG   8           HN       ARG   8  67.836  13.515  13.763
   61    HA   ARG   8           HA       ARG   8  70.191  15.046  12.992
   62   1HB   ARG   8           HB2      ARG   8  69.802  12.215  13.990
   63   2HB   ARG   8           HB1      ARG   8  71.384  12.897  13.608
   64   1HG   ARG   8           HG2      ARG   8  69.528  14.377  15.453
   65   2HG   ARG   8           HG1      ARG   8  70.498  13.039  16.072
   66   1HD   ARG   8           HD2      ARG   8  71.624  15.413  14.559
   67   2HD   ARG   8           HD1      ARG   8  71.632  15.256  16.316
   68    HE   ARG   8           HE       ARG   8  73.383  13.834  14.458
   69   1HH1  ARG   8          HH21      ARG   8  72.296  11.582  15.952
   70   2HH1  ARG   8          HH22      ARG   8  73.258  11.543  17.392
   71   1HH2  ARG   8          HH11      ARG   8  74.439  14.782  17.008
   72   2HH2  ARG   8          HH12      ARG   8  74.471  13.356  17.991
   73    H    LYS   9           HN       LYS   9  68.534  12.116  11.828
   74    HA   LYS   9           HA       LYS   9  69.321  12.689   9.092
   75   1HB   LYS   9           HB2      LYS   9  71.300  11.461  10.296
   76   2HB   LYS   9           HB1      LYS   9  70.273  10.036  10.143
   77   1HG   LYS   9           HG2      LYS   9  70.352  10.061   7.812
   78   2HG   LYS   9           HG1      LYS   9  70.732  11.781   7.745
   79   1HD   LYS   9           HD2      LYS   9  72.872  11.104   7.402
   80   2HD   LYS   9           HD1      LYS   9  72.891  10.780   9.135
   81   1HE   LYS   9           HE2      LYS   9  73.619   8.749   8.168
   82   2HE   LYS   9           HE1      LYS   9  71.913   8.466   8.515
   83   1HZ   LYS   9           HZ1      LYS   9  72.961   9.387   5.895
   84   2HZ   LYS   9           HZ3      LYS   9  72.590   7.773   6.261
   85   3HZ   LYS   9           HZ2      LYS   9  71.360   8.946   6.253
   86    NH1  ARG  10           NH2      ARG  10  62.761   6.789  13.246
   87    NH2  ARG  10           NH1      ARG  10  61.419   8.540  13.742
   88    H    ARG  10           HN       ARG  10  66.854  12.691   9.459
   89    HA   ARG  10           HA       ARG  10  65.823  10.075   8.611
   90   1HB   ARG  10           HB2      ARG  10  65.419  11.189  11.271
   91   2HB   ARG  10           HB1      ARG  10  63.881  10.955  10.443
   92   1HG   ARG  10           HG2      ARG  10  64.390   8.622  10.029
   93   2HG   ARG  10           HG1      ARG  10  66.025   8.824  10.661
   94   1HD   ARG  10           HD2      ARG  10  64.919   7.932  12.513
   95   2HD   ARG  10           HD1      ARG  10  64.786   9.663  12.821
   96    HE   ARG  10           HE       ARG  10  62.488   9.218  11.459
   97   1HH1  ARG  10          HH21      ARG  10  63.509   6.395  12.711
   98   2HH1  ARG  10          HH22      ARG  10  62.293   6.236  13.935
   99   1HH2  ARG  10          HH11      ARG  10  61.139   9.487  13.588
  100   2HH2  ARG  10          HH12      ARG  10  60.951   7.985  14.430
  101    H    LYS  11           HN       LYS  11  65.746  11.518   6.647
  102    HA   LYS  11           HA       LYS  11  63.326  13.239   6.684
  103   1HB   LYS  11           HB2      LYS  11  65.855  13.446   5.039
  104   2HB   LYS  11           HB1      LYS  11  64.390  14.358   4.665
  105   1HG   LYS  11           HG2      LYS  11  64.506  15.604   6.657
  106   2HG   LYS  11           HG1      LYS  11  65.571  14.433   7.435
  107   1HD   LYS  11           HD2      LYS  11  67.124  16.053   6.888
  108   2HD   LYS  11           HD1      LYS  11  67.178  15.089   5.412
  109   1HE   LYS  11           HE2      LYS  11  65.087  17.190   5.490
  110   2HE   LYS  11           HE1      LYS  11  66.751  17.771   5.426
  111   1HZ   LYS  11           HZ3      LYS  11  66.982  16.005   3.576
  112   2HZ   LYS  11           HZ2      LYS  11  65.288  16.110   3.488
  113   3HZ   LYS  11           HZ1      LYS  11  66.243  17.489   3.217
  114    NH1  ARG  12           NH1      ARG  12  56.551  10.107   2.527
  115    NH2  ARG  12           NH2      ARG  12  55.048  11.346   3.672
  116    H    ARG  12           HN       ARG  12  61.844  12.978   4.938
  117    HA   ARG  12           HA       ARG  12  62.121  10.367   3.539
  118   1HB   ARG  12           HB2      ARG  12  59.679  10.647   3.079
  119   2HB   ARG  12           HB1      ARG  12  60.060  10.637   4.800
  120   1HG   ARG  12           HG2      ARG  12  59.426  12.804   5.082
  121   2HG   ARG  12           HG1      ARG  12  60.147  13.314   3.555
  122   1HD   ARG  12           HD2      ARG  12  57.712  13.560   3.446
  123   2HD   ARG  12           HD1      ARG  12  58.236  12.293   2.336
  124    HE   ARG  12           HE       ARG  12  57.406  11.390   5.020
  125   1HH1  ARG  12          HH11      ARG  12  57.500   9.855   2.337
  126   2HH1  ARG  12          HH12      ARG  12  55.807   9.664   2.028
  127   1HH2  ARG  12          HH21      ARG  12  54.845  12.043   4.359
  128   2HH2  ARG  12          HH22      ARG  12  54.303  10.903   3.173
  129    H    THR  13           HN       THR  13  63.613  12.690   2.599
  130    HA   THR  13           HA       THR  13  62.193  13.693   0.236
  131    HB   THR  13           HB       THR  13  63.787  15.171   1.333
  132    HG1  THR  13           HG1      THR  13  64.480  15.866  -0.520
  133   1HG2  THR  13          HG22      THR  13  65.367  12.766   1.475
  134   2HG2  THR  13          HG21      THR  13  66.291  14.026   0.658
  135   3HG2  THR  13          HG23      THR  13  65.641  14.316   2.271
  136    H    SER  14           HN       SER  14  64.343  11.058   1.017
  137    HA   SER  14           HA       SER  14  64.274  10.232  -1.851
  138   1HB   SER  14           HB2      SER  14  66.575   9.505  -1.745
  139   2HB   SER  14           HB1      SER  14  66.527  11.175  -1.188
  140    HG   SER  14           HG       SER  14  67.113  10.531   0.729
  141    H    ILE  15           HN       ILE  15  65.574   7.768  -1.508
  142    HA   ILE  15           HA       ILE  15  63.471   6.225  -0.172
  143    HB   ILE  15           HB       ILE  15  66.004   5.403  -1.621
  144   1HG1  ILE  15          HG12      ILE  15  64.213   6.417  -3.011
  145   2HG1  ILE  15          HG11      ILE  15  64.445   4.711  -3.388
  146   1HG2  ILE  15          HG22      ILE  15  63.829   3.738  -0.330
  147   2HG2  ILE  15          HG21      ILE  15  64.849   3.108  -1.624
  148   3HG2  ILE  15          HG23      ILE  15  65.573   3.615  -0.097
  149   1HD1  ILE  15          HD11      ILE  15  62.530   4.734  -1.323
  150   2HD1  ILE  15          HD13      ILE  15  62.063   6.055  -2.395
  151   3HD1  ILE  15          HD12      ILE  15  62.237   4.422  -3.032
  152    H    GLU  16           HN       GLU  16  63.685   6.722   2.022
  153    HA   GLU  16           HA       GLU  16  66.249   6.293   3.363
  154   1HB   GLU  16           HB2      GLU  16  64.057   7.877   3.923
  155   2HB   GLU  16           HB1      GLU  16  63.846   6.533   5.042
  156   1HG   GLU  16           HG2      GLU  16  66.484   6.973   5.392
  157   2HG   GLU  16           HG1      GLU  16  65.977   8.605   4.952
  158    H    ASN  17           HN       ASN  17  66.365   4.662   5.149
  159    HA   ASN  17           HA       ASN  17  65.546   2.085   4.251
  160   1HB   ASN  17           HB2      ASN  17  67.319   2.985   6.137
  161   2HB   ASN  17           HB1      ASN  17  66.032   2.346   7.158
  162   1HD2  ASN  17          HD21      ASN  17  68.762   1.462   5.283
  163   2HD2  ASN  17          HD22      ASN  17  68.498  -0.215   5.265
  164    NH1  ARG  18           NH1      ARG  18  58.570   7.790   9.181
  165    NH2  ARG  18           NH2      ARG  18  59.631   9.611   8.365
  166    H    ARG  18           HN       ARG  18  64.007   4.427   6.353
  167    HA   ARG  18           HA       ARG  18  62.005   2.549   7.335
  168   1HB   ARG  18           HB2      ARG  18  60.906   4.556   8.266
  169   2HB   ARG  18           HB1      ARG  18  62.623   4.537   8.662
  170   1HG   ARG  18           HG2      ARG  18  62.837   6.568   7.710
  171   2HG   ARG  18           HG1      ARG  18  62.395   5.858   6.159
  172   1HD   ARG  18           HD2      ARG  18  60.697   7.400   6.327
  173   2HD   ARG  18           HD1      ARG  18  59.937   6.072   7.202
  174    HE   ARG  18           HE       ARG  18  61.443   7.631   9.055
  175   1HH1  ARG  18          HH11      ARG  18  58.570   6.815   9.404
  176   2HH1  ARG  18          HH12      ARG  18  57.757   8.343   9.359
  177   1HH2  ARG  18          HH21      ARG  18  60.444  10.032   7.962
  178   2HH2  ARG  18          HH22      ARG  18  58.818  10.165   8.544
  179    H    VAL  19           HN       VAL  19  62.358   4.666   4.556
  180    HA   VAL  19           HA       VAL  19  59.546   4.671   3.901
  181    HB   VAL  19           HB       VAL  19  61.614   6.184   3.001
  182   1HG1  VAL  19          HG13      VAL  19  61.141   4.119   0.823
  183   2HG1  VAL  19          HG12      VAL  19  61.817   5.710   0.534
  184   3HG1  VAL  19          HG11      VAL  19  62.681   4.567   1.558
  185   1HG2  VAL  19          HG21      VAL  19  59.156   6.582   2.845
  186   2HG2  VAL  19          HG23      VAL  19  60.014   7.053   1.378
  187   3HG2  VAL  19          HG22      VAL  19  59.107   5.540   1.422
  188    NH1  ARG  20           NH1      ARG  20  66.159  -0.731  -2.016
  189    NH2  ARG  20           NH2      ARG  20  65.998   1.208  -3.167
  190    H    ARG  20           HN       ARG  20  62.313   2.752   2.764
  191    HA   ARG  20           HA       ARG  20  60.807   1.120   0.965
  192   1HB   ARG  20           HB2      ARG  20  63.319   0.448   2.518
  193   2HB   ARG  20           HB1      ARG  20  62.698  -0.475   1.150
  194   1HG   ARG  20           HG2      ARG  20  62.787   1.742  -0.159
  195   2HG   ARG  20           HG1      ARG  20  63.797   2.334   1.160
  196   1HD   ARG  20           HD2      ARG  20  65.588   1.278   0.299
  197   2HD   ARG  20           HD1      ARG  20  64.738  -0.267   0.351
  198    HE   ARG  20           HE       ARG  20  63.722   1.055  -1.894
  199   1HH1  ARG  20          HH11      ARG  20  65.833  -1.336  -1.289
  200   2HH1  ARG  20          HH12      ARG  20  66.934  -1.005  -2.586
  201   1HH2  ARG  20          HH21      ARG  20  65.548   2.088  -3.322
  202   2HH2  ARG  20          HH22      ARG  20  66.773   0.935  -3.737
  203    CH2  TRP  21           CH2      TRP  21  63.332  -4.296   2.037
  204    H    TRP  21           HN       TRP  21  61.644   0.626   4.383
  205    HA   TRP  21           HA       TRP  21  60.009  -1.784   4.394
  206   1HB   TRP  21           HB2      TRP  21  61.429  -0.455   6.701
  207   2HB   TRP  21           HB1      TRP  21  60.720  -2.079   6.707
  208    HD1  TRP  21           HD1      TRP  21  63.991  -1.019   6.684
  209    HE1  TRP  21           HE1      TRP  21  65.552  -2.222   5.014
  210    HE3  TRP  21           HE3      TRP  21  60.538  -3.205   3.593
  211    HZ2  TRP  21           HZ2      TRP  21  65.342  -3.860   2.644
  212    HZ3  TRP  21           HZ3      TRP  21  61.225  -4.521   1.655
  213    HH2  TRP  21           HH2      TRP  21  63.632  -4.897   1.192
  214    H    SER  22           HN       SER  22  59.198   1.349   4.344
  215    HA   SER  22           HA       SER  22  56.880   1.162   6.129
  216   1HB   SER  22           HB2      SER  22  58.093   3.248   4.369
  217   2HB   SER  22           HB1      SER  22  56.338   3.284   4.520
  218    HG   SER  22           HG       SER  22  57.095   4.481   6.194
  219    H    LEU  23           HN       LEU  23  57.851   0.984   2.729
  220    HA   LEU  23           HA       LEU  23  55.350   0.483   1.451
  221   1HB   LEU  23           HB2      LEU  23  57.997  -0.905   0.946
  222   2HB   LEU  23           HB1      LEU  23  56.672  -0.839  -0.183
  223    HG   LEU  23           HG       LEU  23  57.936   1.708   0.761
  224   1HD1  LEU  23          HD11      LEU  23  59.602  -0.190  -0.015
  225   2HD1  LEU  23          HD13      LEU  23  58.976   0.173  -1.623
  226   3HD1  LEU  23          HD12      LEU  23  59.780   1.430  -0.683
  227   1HD2  LEU  23          HD22      LEU  23  55.868   1.125  -0.980
  228   2HD2  LEU  23          HD21      LEU  23  56.841   2.594  -1.057
  229   3HD2  LEU  23          HD23      LEU  23  57.241   1.216  -2.083
  230    H    GLU  24           HN       GLU  24  57.689  -1.614   3.053
  231    HA   GLU  24           HA       GLU  24  56.518  -4.131   2.672
  232   1HB   GLU  24           HB2      GLU  24  58.667  -3.223   4.055
  233   2HB   GLU  24           HB1      GLU  24  57.601  -3.655   5.388
  234   1HG   GLU  24           HG2      GLU  24  57.232  -5.880   4.161
  235   2HG   GLU  24           HG1      GLU  24  58.618  -5.433   3.168
  236    H    THR  25           HN       THR  25  55.927  -2.004   5.531
  237    HA   THR  25           HA       THR  25  53.988  -3.713   6.702
  238    HB   THR  25           HB       THR  25  54.956  -1.831   7.945
  239    HG1  THR  25           HG1      THR  25  53.180  -1.618   9.056
  240   1HG2  THR  25          HG21      THR  25  53.599  -0.249   5.794
  241   2HG2  THR  25          HG23      THR  25  53.756   0.454   7.402
  242   3HG2  THR  25          HG22      THR  25  55.195  -0.029   6.506
  243    H    MET  26           HN       MET  26  53.720  -1.455   4.030
  244    HA   MET  26           HA       MET  26  50.792  -1.447   4.051
  245   1HB   MET  26           HB2      MET  26  52.951  -0.355   2.330
  246   2HB   MET  26           HB1      MET  26  51.416  -0.688   1.525
  247   1HG   MET  26           HG2      MET  26  50.260   0.611   3.341
  248   2HG   MET  26           HG1      MET  26  51.848   1.060   3.963
  249   1HE   MET  26           HE2      MET  26  52.980   2.723   3.557
  250   2HE   MET  26           HE1      MET  26  53.756   2.459   1.998
  251   3HE   MET  26           HE3      MET  26  52.871   3.960   2.306
  252    H    PHE  27           HN       PHE  27  53.290  -3.420   2.536
  253    HA   PHE  27           HA       PHE  27  51.323  -4.804   0.824
  254   1HB   PHE  27           HB2      PHE  27  54.323  -5.056   1.159
  255   2HB   PHE  27           HB1      PHE  27  53.379  -6.155   0.161
  256    HD1  PHE  27           HD2      PHE  27  51.703  -4.972  -1.528
  257    HD2  PHE  27           HD1      PHE  27  55.190  -3.127   0.172
  258    HE1  PHE  27           HE2      PHE  27  51.743  -3.332  -3.388
  259    HE2  PHE  27           HE1      PHE  27  55.230  -1.488  -1.689
  260    HZ   PHE  27           HZ       PHE  27  53.507  -1.591  -3.468
  261    H    LEU  28           HN       LEU  28  52.474  -5.188   4.017
  262    HA   LEU  28           HA       LEU  28  52.303  -8.127   3.944
  263   1HB   LEU  28           HB2      LEU  28  52.907  -6.215   6.209
  264   2HB   LEU  28           HB1      LEU  28  52.964  -7.977   6.330
  265    HG   LEU  28           HG       LEU  28  54.486  -6.580   4.148
  266   1HD1  LEU  28          HD13      LEU  28  55.245  -6.812   7.057
  267   2HD1  LEU  28          HD12      LEU  28  56.472  -6.746   5.793
  268   3HD1  LEU  28          HD11      LEU  28  55.351  -5.401   6.004
  269   1HD2  LEU  28          HD22      LEU  28  54.136  -9.101   4.295
  270   2HD2  LEU  28          HD21      LEU  28  55.814  -8.570   4.189
  271   3HD2  LEU  28          HD23      LEU  28  55.143  -9.066   5.743
  272    H    LYS  29           HN       LYS  29  49.892  -6.108   3.743
  273    HA   LYS  29           HA       LYS  29  48.290  -7.263   5.977
  274   1HB   LYS  29           HB2      LYS  29  46.627  -5.539   5.477
  275   2HB   LYS  29           HB1      LYS  29  48.204  -4.781   5.677
  276   1HG   LYS  29           HG2      LYS  29  48.466  -4.841   3.165
  277   2HG   LYS  29           HG1      LYS  29  46.797  -5.403   3.061
  278   1HD   LYS  29           HD2      LYS  29  47.666  -2.821   4.397
  279   2HD   LYS  29           HD1      LYS  29  46.986  -2.932   2.774
  280   1HE   LYS  29           HE2      LYS  29  44.949  -4.013   3.761
  281   2HE   LYS  29           HE1      LYS  29  45.621  -3.718   5.365
  282   1HZ   LYS  29           HZ2      LYS  29  45.312  -1.525   3.413
  283   2HZ   LYS  29           HZ1      LYS  29  44.016  -2.004   4.402
  284   3HZ   LYS  29           HZ3      LYS  29  45.450  -1.433   5.104
  285    H    CYS  30           HN       CYS  30  48.378  -6.853   2.480
  286    HA   CYS  30           HA       CYS  30  46.770  -9.304   2.181
  287   1HB   CYS  30           HB2      CYS  30  46.082  -6.566   1.195
  288   2HB   CYS  30           HB1      CYS  30  45.751  -7.927   0.123
  289    HG   CYS  30           HG       CYS  30  44.538  -7.687   3.001
  290    HA   PRO  31           HA       PRO  31  50.050  -9.802  -0.839
  291   1HB   PRO  31           HB2      PRO  31  49.211 -12.177  -1.910
  292   2HB   PRO  31           HB1      PRO  31  49.975 -12.062  -0.314
  293   1HG   PRO  31           HG2      PRO  31  47.121 -12.553  -0.991
  294   2HG   PRO  31           HG1      PRO  31  48.014 -12.979   0.478
  295   1HD   PRO  31           HD2      PRO  31  46.234 -10.765   0.139
  296   2HD   PRO  31           HD1      PRO  31  47.273 -11.093   1.541
  297    H    LYS  32           HN       LYS  32  47.072  -8.687  -1.562
  298    HA   LYS  32           HA       LYS  32  47.372  -9.144  -4.478
  299   1HB   LYS  32           HB2      LYS  32  44.879  -8.686  -4.553
  300   2HB   LYS  32           HB1      LYS  32  45.340 -10.169  -3.718
  301   1HG   LYS  32           HG2      LYS  32  44.997  -9.194  -1.570
  302   2HG   LYS  32           HG1      LYS  32  44.941  -7.562  -2.231
  303   1HD   LYS  32           HD2      LYS  32  42.670  -8.188  -1.781
  304   2HD   LYS  32           HD1      LYS  32  42.878  -8.284  -3.531
  305   1HE   LYS  32           HE2      LYS  32  43.522 -10.775  -3.061
  306   2HE   LYS  32           HE1      LYS  32  42.689 -10.519  -1.528
  307   1HZ   LYS  32           HZ2      LYS  32  41.395  -9.706  -4.040
  308   2HZ   LYS  32           HZ1      LYS  32  41.376 -11.343  -3.583
  309   3HZ   LYS  32           HZ3      LYS  32  40.688 -10.173  -2.567
  310    HA   PRO  33           HA       PRO  33  47.686  -4.556  -3.679
  311   1HB   PRO  33           HB2      PRO  33  50.061  -4.140  -4.999
  312   2HB   PRO  33           HB1      PRO  33  49.956  -4.507  -3.269
  313   1HG   PRO  33           HG2      PRO  33  50.801  -6.270  -5.515
  314   2HG   PRO  33           HG1      PRO  33  51.253  -6.334  -3.803
  315   1HD   PRO  33           HD2      PRO  33  49.360  -8.016  -5.071
  316   2HD   PRO  33           HD1      PRO  33  49.571  -7.819  -3.318
  317    H    SER  34           HN       SER  34  46.709  -3.234  -5.178
  318    HA   SER  34           HA       SER  34  46.236  -4.245  -7.879
  319   1HB   SER  34           HB2      SER  34  44.953  -2.045  -8.070
  320   2HB   SER  34           HB1      SER  34  44.362  -3.190  -6.868
  321    HG   SER  34           HG       SER  34  44.965  -0.749  -6.413
  322    H    LEU  35           HN       LEU  35  46.808  -3.094  -9.812
  323    HA   LEU  35           HA       LEU  35  49.462  -1.987  -9.819
  324   1HB   LEU  35           HB2      LEU  35  47.198  -1.934 -11.831
  325   2HB   LEU  35           HB1      LEU  35  48.760  -1.180 -12.155
  326    HG   LEU  35           HG       LEU  35  49.018  -3.895 -11.080
  327   1HD1  LEU  35          HD12      LEU  35  47.274  -3.372 -13.449
  328   2HD1  LEU  35          HD11      LEU  35  48.394  -4.731 -13.540
  329   3HD1  LEU  35          HD13      LEU  35  47.186  -4.668 -12.256
  330   1HD2  LEU  35          HD22      LEU  35  50.603  -2.191 -12.448
  331   2HD2  LEU  35          HD21      LEU  35  50.833  -3.939 -12.491
  332   3HD2  LEU  35          HD23      LEU  35  49.967  -3.131 -13.798
  333    H    GLN  36           HN       GLN  36  46.306  -0.703  -9.198
  334    HA   GLN  36           HA       GLN  36  46.983   2.107  -9.637
  335   1HB   GLN  36           HB2      GLN  36  44.618   0.987  -9.516
  336   2HB   GLN  36           HB1      GLN  36  44.821   1.139  -7.770
  337   1HG   GLN  36           HG2      GLN  36  44.788   3.457  -7.826
  338   2HG   GLN  36           HG1      GLN  36  45.381   3.529  -9.486
  339   1HE2  GLN  36          HE22      GLN  36  41.377   2.759  -8.896
  340   2HE2  GLN  36          HE21      GLN  36  42.490   2.286  -7.706
  341    H    GLN  37           HN       GLN  37  46.966  -0.190  -6.969
  342    HA   GLN  37           HA       GLN  37  47.686   1.720  -4.924
  343   1HB   GLN  37           HB2      GLN  37  46.644  -0.528  -4.475
  344   2HB   GLN  37           HB1      GLN  37  48.177  -1.272  -4.932
  345   1HG   GLN  37           HG2      GLN  37  49.331  -0.264  -3.113
  346   2HG   GLN  37           HG1      GLN  37  48.010   0.863  -2.801
  347   1HE2  GLN  37          HE22      GLN  37  47.556  -3.051  -1.595
  348   2HE2  GLN  37          HE21      GLN  37  48.595  -2.703  -2.892
  349    H    ILE  38           HN       ILE  38  49.476  -0.046  -7.372
  350    HA   ILE  38           HA       ILE  38  52.040   0.335  -6.037
  351    HB   ILE  38           HB       ILE  38  51.309  -0.657  -8.809
  352   1HG1  ILE  38          HG12      ILE  38  50.915  -2.209  -6.940
  353   2HG1  ILE  38          HG11      ILE  38  52.277  -2.769  -7.908
  354   1HG2  ILE  38          HG22      ILE  38  54.068  -0.236  -7.587
  355   2HG2  ILE  38          HG21      ILE  38  53.768  -1.230  -9.012
  356   3HG2  ILE  38          HG23      ILE  38  53.446   0.504  -9.061
  357   1HD1  ILE  38          HD11      ILE  38  53.537  -1.148  -6.075
  358   2HD1  ILE  38          HD13      ILE  38  52.223  -1.818  -5.108
  359   3HD1  ILE  38          HD12      ILE  38  53.371  -2.895  -5.905
  360    H    THR  39           HN       THR  39  50.026   2.065  -8.281
  361    HA   THR  39           HA       THR  39  52.093   3.941  -9.127
  362    HB   THR  39           HB       THR  39  49.814   5.360  -9.499
  363    HG1  THR  39           HG1      THR  39  48.100   4.084  -9.673
  364   1HG2  THR  39          HG21      THR  39  51.556   4.332 -11.139
  365   2HG2  THR  39          HG23      THR  39  50.376   3.034 -11.319
  366   3HG2  THR  39          HG22      THR  39  49.937   4.689 -11.741
  367    H    HIS  40           HN       HIS  40  49.663   3.762  -6.584
  368    HA   HIS  40           HA       HIS  40  50.254   6.393  -5.465
  369   1HB   HIS  40           HB2      HIS  40  48.123   4.810  -5.190
  370   2HB   HIS  40           HB1      HIS  40  49.049   4.202  -3.818
  371    HD1  HIS  40           HD1      HIS  40  49.659   5.941  -1.928
  372    HD2  HIS  40           HD2      HIS  40  47.061   7.396  -4.843
  373    HE1  HIS  40           HE1      HIS  40  48.677   8.084  -1.005
  374    H    ILE  41           HN       ILE  41  51.565   3.184  -5.207
  375    HA   ILE  41           HA       ILE  41  52.940   3.504  -2.694
  376    HB   ILE  41           HB       ILE  41  52.654   1.536  -4.788
  377   1HG1  ILE  41          HG12      ILE  41  53.918   0.318  -2.595
  378   2HG1  ILE  41          HG11      ILE  41  53.017   1.667  -1.906
  379   1HG2  ILE  41          HG21      ILE  41  55.498   1.899  -3.837
  380   2HG2  ILE  41          HG23      ILE  41  54.890   0.461  -4.659
  381   3HG2  ILE  41          HG22      ILE  41  54.921   2.010  -5.500
  382   1HD1  ILE  41          HD13      ILE  41  51.747  -0.212  -3.899
  383   2HD1  ILE  41          HD12      ILE  41  51.769  -0.579  -2.174
  384   3HD1  ILE  41          HD11      ILE  41  50.953   0.871  -2.756
  385    H    ALA  42           HN       ALA  42  53.801   3.979  -6.094
  386    HA   ALA  42           HA       ALA  42  56.485   4.805  -5.707
  387   1HB   ALA  42           HB3      ALA  42  54.458   5.154  -7.880
  388   2HB   ALA  42           HB2      ALA  42  55.946   6.098  -7.953
  389   3HB   ALA  42           HB1      ALA  42  56.019   4.335  -7.936
  390    H    ASN  43           HN       ASN  43  53.570   6.797  -6.171
  391    HA   ASN  43           HA       ASN  43  54.888   9.273  -5.575
  392   1HB   ASN  43           HB2      ASN  43  52.051   8.339  -5.726
  393   2HB   ASN  43           HB1      ASN  43  52.373   9.862  -4.895
  394   1HD2  ASN  43          HD22      ASN  43  51.928  10.395  -8.641
  395   2HD2  ASN  43          HD21      ASN  43  50.994   9.549  -7.504
  396    H    GLN  44           HN       GLN  44  53.895   6.609  -3.620
  397    HA   GLN  44           HA       GLN  44  53.529   8.051  -1.150
  398   1HB   GLN  44           HB2      GLN  44  53.468   5.282  -2.063
  399   2HB   GLN  44           HB1      GLN  44  54.182   5.443  -0.466
  400   1HG   GLN  44           HG2      GLN  44  51.487   6.546  -1.321
  401   2HG   GLN  44           HG1      GLN  44  51.734   5.098  -0.346
  402   1HE2  GLN  44          HE22      GLN  44  51.734   8.695   1.458
  403   2HE2  GLN  44          HE21      GLN  44  51.280   8.482  -0.164
  404    H    LEU  45           HN       LEU  45  56.293   6.592  -2.794
  405    HA   LEU  45           HA       LEU  45  57.985   7.734  -0.624
  406   1HB   LEU  45           HB2      LEU  45  59.434   5.875  -0.561
  407   2HB   LEU  45           HB1      LEU  45  57.815   5.196  -0.565
  408    HG   LEU  45           HG       LEU  45  59.432   5.517  -3.096
  409   1HD1  LEU  45          HD12      LEU  45  60.229   3.931  -1.010
  410   2HD1  LEU  45          HD11      LEU  45  59.146   2.839  -1.871
  411   3HD1  LEU  45          HD13      LEU  45  60.523   3.550  -2.701
  412   1HD2  LEU  45          HD23      LEU  45  56.878   4.221  -2.238
  413   2HD2  LEU  45          HD22      LEU  45  57.233   5.122  -3.713
  414   3HD2  LEU  45          HD21      LEU  45  57.811   3.467  -3.530
  415    H    GLY  46           HN       GLY  46  57.169   8.639  -3.405
  416   1HA   GLY  46           HA2      GLY  46  58.148   9.694  -5.254
  417   2HA   GLY  46           HA1      GLY  46  59.304  10.240  -4.052
  418    H    LEU  47           HN       LEU  47  59.026   6.844  -5.029
  419    HA   LEU  47           HA       LEU  47  61.799   7.077  -6.107
  420   1HB   LEU  47           HB2      LEU  47  62.219   4.896  -5.483
  421   2HB   LEU  47           HB1      LEU  47  60.980   5.276  -4.300
  422    HG   LEU  47           HG       LEU  47  60.621   3.771  -6.893
  423   1HD1  LEU  47          HD11      LEU  47  61.494   2.817  -4.507
  424   2HD1  LEU  47          HD13      LEU  47  59.751   2.642  -4.301
  425   3HD1  LEU  47          HD12      LEU  47  60.562   1.857  -5.654
  426   1HD2  LEU  47          HD22      LEU  47  58.665   5.052  -5.088
  427   2HD2  LEU  47          HD21      LEU  47  58.572   4.772  -6.818
  428   3HD2  LEU  47          HD23      LEU  47  58.260   3.456  -5.692
  429    H    GLU  48           HN       GLU  48  62.110   5.208  -7.912
  430    HA   GLU  48           HA       GLU  48  60.254   5.957 -10.085
  431   1HB   GLU  48           HB2      GLU  48  62.925   5.787 -10.140
  432   2HB   GLU  48           HB1      GLU  48  62.557   4.106 -10.529
  433   1HG   GLU  48           HG2      GLU  48  62.424   4.914 -12.663
  434   2HG   GLU  48           HG1      GLU  48  60.793   5.351 -12.166
  435    H    LYS  49           HN       LYS  49  59.016   4.394 -11.178
  436    HA   LYS  49           HA       LYS  49  57.950   2.244  -9.691
  437   1HB   LYS  49           HB2      LYS  49  56.971   3.366 -11.770
  438   2HB   LYS  49           HB1      LYS  49  58.021   2.307 -12.711
  439   1HG   LYS  49           HG2      LYS  49  56.783   0.614 -10.829
  440   2HG   LYS  49           HG1      LYS  49  55.503   1.689 -11.388
  441   1HD   LYS  49           HD2      LYS  49  55.384   0.079 -13.039
  442   2HD   LYS  49           HD1      LYS  49  56.589   1.145 -13.765
  443   1HE   LYS  49           HE2      LYS  49  58.396  -0.240 -13.009
  444   2HE   LYS  49           HE1      LYS  49  57.320  -1.194 -11.988
  445   1HZ   LYS  49           HZ2      LYS  49  57.081  -1.023 -14.940
  446   2HZ   LYS  49           HZ1      LYS  49  57.908  -2.267 -14.129
  447   3HZ   LYS  49           HZ3      LYS  49  56.239  -2.071 -13.901
  448    H    ASP  50           HN       ASP  50  60.888   2.355 -11.565
  449    HA   ASP  50           HA       ASP  50  61.055  -0.505 -11.999
  450   1HB   ASP  50           HB2      ASP  50  63.358  -0.087 -12.703
  451   2HB   ASP  50           HB1      ASP  50  62.289   1.119 -13.414
  452    H    VAL  51           HN       VAL  51  62.253   1.686  -9.437
  453    HA   VAL  51           HA       VAL  51  63.672  -0.540  -8.142
  454    HB   VAL  51           HB       VAL  51  64.522   1.784  -7.957
  455   1HG1  VAL  51          HG11      VAL  51  61.763   2.273  -7.187
  456   2HG1  VAL  51          HG13      VAL  51  62.876   2.910  -5.979
  457   3HG1  VAL  51          HG12      VAL  51  63.006   3.427  -7.660
  458   1HG2  VAL  51          HG23      VAL  51  63.611   0.437  -5.399
  459   2HG2  VAL  51          HG22      VAL  51  65.169   0.259  -6.207
  460   3HG2  VAL  51          HG21      VAL  51  64.747   1.786  -5.431
  461    H    VAL  52           HN       VAL  52  60.486   0.848  -8.108
  462    HA   VAL  52           HA       VAL  52  59.761  -0.203  -5.500
  463    HB   VAL  52           HB       VAL  52  58.713   1.775  -6.980
  464   1HG1  VAL  52          HG13      VAL  52  57.883  -0.071  -8.648
  465   2HG1  VAL  52          HG12      VAL  52  56.611  -0.311  -7.453
  466   3HG1  VAL  52          HG11      VAL  52  56.814   1.264  -8.219
  467   1HG2  VAL  52          HG21      VAL  52  58.228   0.799  -4.583
  468   2HG2  VAL  52          HG23      VAL  52  57.089   1.910  -5.343
  469   3HG2  VAL  52          HG22      VAL  52  56.774   0.176  -5.362
  470    NH1  ARG  53           NH1      ARG  53  55.454  -6.248 -11.754
  471    NH2  ARG  53           NH2      ARG  53  53.445  -5.422 -11.117
  472    H    ARG  53           HN       ARG  53  59.712  -1.374  -8.808
  473    HA   ARG  53           HA       ARG  53  57.993  -3.659  -8.150
  474   1HB   ARG  53           HB2      ARG  53  58.438  -2.416 -10.482
  475   2HB   ARG  53           HB1      ARG  53  59.688  -3.654 -10.606
  476   1HG   ARG  53           HG2      ARG  53  57.613  -4.486 -11.603
  477   2HG   ARG  53           HG1      ARG  53  57.976  -5.398 -10.139
  478   1HD   ARG  53           HD2      ARG  53  56.067  -4.723  -9.145
  479   2HD   ARG  53           HD1      ARG  53  56.369  -3.035  -9.556
  480    HE   ARG  53           HE       ARG  53  55.029  -3.311 -11.503
  481   1HH1  ARG  53          HH11      ARG  53  56.437  -6.124 -11.888
  482   2HH1  ARG  53          HH12      ARG  53  55.026  -7.126 -11.972
  483   1HH2  ARG  53          HH21      ARG  53  52.893  -4.667 -10.763
  484   2HH2  ARG  53          HH22      ARG  53  53.014  -6.297 -11.334
  485    H    VAL  54           HN       VAL  54  61.464  -3.136  -8.831
  486    HA   VAL  54           HA       VAL  54  62.211  -5.891  -8.461
  487    HB   VAL  54           HB       VAL  54  63.864  -3.367  -8.097
  488   1HG1  VAL  54          HG12      VAL  54  64.777  -5.511  -7.067
  489   2HG1  VAL  54          HG11      VAL  54  64.820  -6.179  -8.699
  490   3HG1  VAL  54          HG13      VAL  54  65.803  -4.771  -8.296
  491   1HG2  VAL  54          HG22      VAL  54  63.327  -5.175 -10.469
  492   2HG2  VAL  54          HG21      VAL  54  62.995  -3.451 -10.340
  493   3HG2  VAL  54          HG23      VAL  54  64.660  -4.021 -10.423
  494    CH2  TRP  55           CH2      TRP  55  58.229  -3.129   0.306
  495    H    TRP  55           HN       TRP  55  61.677  -3.201  -6.264
  496    HA   TRP  55           HA       TRP  55  62.854  -4.516  -3.942
  497   1HB   TRP  55           HB2      TRP  55  62.735  -2.084  -3.963
  498   2HB   TRP  55           HB1      TRP  55  61.000  -2.124  -4.249
  499    HD1  TRP  55           HD1      TRP  55  63.585  -2.287  -1.480
  500    HE1  TRP  55           HE1      TRP  55  62.386  -2.393   0.767
  501    HE3  TRP  55           HE3      TRP  55  58.778  -3.096  -3.043
  502    HZ2  TRP  55           HZ2      TRP  55  59.743  -2.847   1.808
  503    HZ3  TRP  55           HZ3      TRP  55  56.947  -3.362  -1.406
  504    HH2  TRP  55           HH2      TRP  55  57.427  -3.246   1.019
  505    H    PHE  56           HN       PHE  56  59.557  -4.172  -5.275
  506    HA   PHE  56           HA       PHE  56  58.563  -5.884  -3.095
  507   1HB   PHE  56           HB2      PHE  56  57.233  -3.896  -4.039
  508   2HB   PHE  56           HB1      PHE  56  56.880  -4.955  -5.409
  509    HD1  PHE  56           HD2      PHE  56  57.144  -5.418  -1.688
  510    HD2  PHE  56           HD1      PHE  56  54.791  -6.004  -5.230
  511    HE1  PHE  56           HE2      PHE  56  55.438  -6.595  -0.350
  512    HE2  PHE  56           HE1      PHE  56  53.079  -7.195  -3.886
  513    HZ   PHE  56           HZ       PHE  56  53.417  -7.489  -1.440
  514    H    CYS  57           HN       CYS  57  60.214  -6.553  -5.832
  515    HA   CYS  57           HA       CYS  57  58.548  -8.764  -6.813
  516   1HB   CYS  57           HB2      CYS  57  61.160  -7.527  -7.551
  517   2HB   CYS  57           HB1      CYS  57  60.982  -9.245  -7.907
  518    HG   CYS  57           HG       CYS  57  58.912  -7.147  -8.969
  519    H    ASN  58           HN       ASN  58  61.330  -8.235  -4.729
  520    HA   ASN  58           HA       ASN  58  61.691 -11.108  -4.221
  521   1HB   ASN  58           HB2      ASN  58  62.893  -8.633  -2.930
  522   2HB   ASN  58           HB1      ASN  58  63.336 -10.286  -2.503
  523   1HD2  ASN  58          HD22      ASN  58  65.380 -10.755  -5.355
  524   2HD2  ASN  58          HD21      ASN  58  64.705 -11.460  -3.966
  525    NH1  ARG  59           NH1      ARG  59  61.157  -8.520   3.572
  526    NH2  ARG  59           NH2      ARG  59  62.891  -7.589   2.462
  527    H    ARG  59           HN       ARG  59  60.263  -8.246  -2.720
  528    HA   ARG  59           HA       ARG  59  59.576  -9.398  -0.193
  529   1HB   ARG  59           HB2      ARG  59  59.051  -6.974  -1.615
  530   2HB   ARG  59           HB1      ARG  59  57.507  -7.581  -1.019
  531   1HG   ARG  59           HG2      ARG  59  58.509  -6.131   0.650
  532   2HG   ARG  59           HG1      ARG  59  58.510  -7.793   1.242
  533   1HD   ARG  59           HD2      ARG  59  60.884  -7.992   0.341
  534   2HD   ARG  59           HD1      ARG  59  60.844  -6.249   0.081
  535    HE   ARG  59           HE       ARG  59  60.398  -6.085   2.592
  536   1HH1  ARG  59          HH11      ARG  59  60.177  -8.567   3.764
  537   2HH1  ARG  59          HH12      ARG  59  61.788  -9.140   4.038
  538   1HH2  ARG  59          HH21      ARG  59  63.240  -6.921   1.804
  539   2HH2  ARG  59          HH22      ARG  59  63.523  -8.209   2.927
  540    NH1  ARG  60           NH2      ARG  60  54.120 -11.083  -8.761
  541    NH2  ARG  60           NH1      ARG  60  55.048 -13.129  -9.002
  542    H    ARG  60           HN       ARG  60  58.119  -9.735  -3.385
  543    HA   ARG  60           HA       ARG  60  55.677 -10.953  -2.268
  544   1HB   ARG  60           HB2      ARG  60  54.982 -11.201  -4.617
  545   2HB   ARG  60           HB1      ARG  60  55.518  -9.554  -4.292
  546   1HG   ARG  60           HG2      ARG  60  57.605  -9.910  -5.389
  547   2HG   ARG  60           HG1      ARG  60  57.375 -11.656  -5.424
  548   1HD   ARG  60           HD2      ARG  60  55.449  -9.797  -6.819
  549   2HD   ARG  60           HD1      ARG  60  56.923 -10.354  -7.614
  550    HE   ARG  60           HE       ARG  60  55.555 -12.620  -6.538
  551   1HH1  ARG  60          HH21      ARG  60  54.003 -10.242  -8.232
  552   2HH1  ARG  60          HH22      ARG  60  53.640 -11.198  -9.631
  553   1HH2  ARG  60          HH11      ARG  60  55.641 -13.858  -8.659
  554   2HH2  ARG  60          HH12      ARG  60  54.569 -13.244  -9.873
  555    H    GLN  61           HN       GLN  61  58.720 -12.012  -3.688
  556    HA   GLN  61           HA       GLN  61  57.848 -14.824  -3.167
  557   1HB   GLN  61           HB2      GLN  61  59.211 -15.518  -5.149
  558   2HB   GLN  61           HB1      GLN  61  57.825 -14.518  -5.578
  559   1HG   GLN  61           HG2      GLN  61  59.160 -12.945  -6.484
  560   2HG   GLN  61           HG1      GLN  61  60.112 -12.833  -5.005
  561   1HE2  GLN  61          HE22      GLN  61  61.376 -15.832  -7.509
  562   2HE2  GLN  61          HE21      GLN  61  59.734 -15.723  -7.098
  563    H    LYS  62           HN       LYS  62  59.064 -13.709  -1.156
  564    HA   LYS  62           HA       LYS  62  61.980 -13.871  -1.327
  565   1HB   LYS  62           HB2      LYS  62  61.918 -13.417   1.088
  566   2HB   LYS  62           HB1      LYS  62  60.864 -12.297   0.230
  567   1HG   LYS  62           HG2      LYS  62  59.037 -14.167   0.735
  568   2HG   LYS  62           HG1      LYS  62  60.143 -14.565   2.047
  569   1HD   LYS  62           HD2      LYS  62  59.617 -11.675   1.732
  570   2HD   LYS  62           HD1      LYS  62  58.208 -12.629   2.194
  571   1HE   LYS  62           HE2      LYS  62  60.738 -13.231   3.636
  572   2HE   LYS  62           HE1      LYS  62  59.976 -11.683   3.999
  573   1HZ   LYS  62           HZ3      LYS  62  57.848 -13.102   4.176
  574   2HZ   LYS  62           HZ2      LYS  62  58.920 -14.405   4.374
  575   3HZ   LYS  62           HZ1      LYS  62  58.947 -13.105   5.468
  576    H    GLY  63           HN       GLY  63  59.313 -15.916  -0.316
  577   1HA   GLY  63           HA2      GLY  63  60.693 -18.353  -0.649
  578   2HA   GLY  63           HA1      GLY  63  60.824 -17.921   1.057
  579    H    LYS  64           HN       LYS  64  58.620 -18.858  -1.497
  580    HA   LYS  64           HA       LYS  64  56.235 -18.684   0.183
  581   1HB   LYS  64           HB2      LYS  64  56.782 -19.849  -2.551
  582   2HB   LYS  64           HB1      LYS  64  55.209 -19.986  -1.765
  583   1HG   LYS  64           HG2      LYS  64  55.368 -17.421  -1.447
  584   2HG   LYS  64           HG1      LYS  64  56.645 -17.490  -2.662
  585   1HD   LYS  64           HD2      LYS  64  53.923 -18.727  -3.107
  586   2HD   LYS  64           HD1      LYS  64  54.286 -17.058  -3.546
  587   1HE   LYS  64           HE2      LYS  64  56.370 -18.147  -4.747
  588   2HE   LYS  64           HE1      LYS  64  55.370 -19.600  -4.710
  589   1HZ   LYS  64           HZ3      LYS  64  53.561 -18.139  -5.673
  590   2HZ   LYS  64           HZ2      LYS  64  54.782 -17.004  -5.997
  591   3HZ   LYS  64           HZ1      LYS  64  54.841 -18.546  -6.709
  592    NH1  ARG  65           NH2      ARG  65  57.411 -28.546  -1.030
  593    NH2  ARG  65           NH1      ARG  65  55.572 -27.783  -2.103
  594    H    ARG  65           HN       ARG  65  58.702 -21.060  -0.405
  595    HA   ARG  65           HA       ARG  65  56.995 -23.184   0.764
  596   1HB   ARG  65           HB2      ARG  65  59.439 -23.121  -0.910
  597   2HB   ARG  65           HB1      ARG  65  59.404 -24.388   0.316
  598   1HG   ARG  65           HG2      ARG  65  56.904 -24.663  -0.624
  599   2HG   ARG  65           HG1      ARG  65  57.668 -24.018  -2.077
  600   1HD   ARG  65           HD2      ARG  65  59.406 -25.779  -1.929
  601   2HD   ARG  65           HD1      ARG  65  58.602 -26.438  -0.504
  602    HE   ARG  65           HE       ARG  65  57.460 -26.462  -3.261
  603   1HH1  ARG  65          HH21      ARG  65  58.383 -28.461  -0.811
  604   2HH1  ARG  65          HH22      ARG  65  56.876 -29.300  -0.648
  605   1HH2  ARG  65          HH11      ARG  65  55.136 -27.114  -2.705
  606   2HH2  ARG  65          HH12      ARG  65  55.036 -28.536  -1.721
  607    H    SER  66           HN       SER  66  60.099 -21.524   1.319
  608    HA   SER  66           HA       SER  66  60.269 -22.732   4.022
  609   1HB   SER  66           HB2      SER  66  62.229 -20.717   2.969
  610   2HB   SER  66           HB1      SER  66  62.508 -22.086   4.042
  611    HG   SER  66           HG       SER  66  63.165 -22.218   1.702
  612    H    SER  67           HN       SER  67  58.800 -21.678   5.337
  613    HA   SER  67           HA       SER  67  58.521 -18.746   5.192
  614   1HB   SER  67           HB2      SER  67  57.249 -20.607   7.207
  615   2HB   SER  67           HB1      SER  67  56.703 -19.005   6.720
  616    HG   SER  67           HG       SER  67  56.394 -21.460   5.489
   
  Start of MODEL          16
 Raw file had  616 H/Q atoms
  Start of MODEL   16
    1   1H    MET   1           HT2      MET   1  78.851 -19.444  -6.503
    2   2H    MET   1           HT1      MET   1  78.993 -18.378  -7.818
    3   3H    MET   1           HT3      MET   1  77.857 -18.070  -6.597
    4    HA   MET   1           HA       MET   1  76.521 -18.949  -8.229
    5   1HB   MET   1           HB2      MET   1  77.260 -20.929  -9.584
    6   2HB   MET   1           HB1      MET   1  78.285 -19.511  -9.807
    7   1HG   MET   1           HG2      MET   1  79.884 -20.418  -8.149
    8   2HG   MET   1           HG1      MET   1  78.869 -21.849  -7.966
    9   1HE   MET   1           HE3      MET   1  77.917 -22.990  -9.770
   10   2HE   MET   1           HE2      MET   1  78.090 -22.414 -11.426
   11   3HE   MET   1           HE1      MET   1  78.980 -23.841 -10.900
   12    H    GLU   2           HN       GLU   2  75.025 -20.719  -8.002
   13    HA   GLU   2           HA       GLU   2  73.867 -22.338  -6.767
   14   1HB   GLU   2           HB2      GLU   2  76.653 -23.230  -6.908
   15   2HB   GLU   2           HB1      GLU   2  75.836 -23.832  -5.465
   16   1HG   GLU   2           HG2      GLU   2  74.118 -24.873  -6.750
   17   2HG   GLU   2           HG1      GLU   2  74.596 -24.019  -8.216
   18    H    THR   3           HN       THR   3  74.697 -19.760  -5.510
   19    HA   THR   3           HA       THR   3  74.713 -20.633  -2.650
   20    HB   THR   3           HB       THR   3  75.324 -17.958  -2.569
   21    HG1  THR   3           HG1      THR   3  76.845 -17.630  -4.213
   22   1HG2  THR   3          HG22      THR   3  77.191 -20.326  -2.848
   23   2HG2  THR   3          HG21      THR   3  77.689 -18.731  -2.283
   24   3HG2  THR   3          HG23      THR   3  76.527 -19.674  -1.349
   25    H    LEU   4           HN       LEU   4  73.540 -18.969  -1.220
   26    HA   LEU   4           HA       LEU   4  71.366 -17.505  -2.519
   27   1HB   LEU   4           HB2      LEU   4  69.671 -18.750  -0.947
   28   2HB   LEU   4           HB1      LEU   4  70.087 -19.445  -2.503
   29    HG   LEU   4           HG       LEU   4  70.039 -21.063  -0.552
   30   1HD1  LEU   4          HD12      LEU   4  71.599 -21.046  -2.778
   31   2HD1  LEU   4          HD11      LEU   4  72.823 -21.208  -1.519
   32   3HD1  LEU   4          HD13      LEU   4  71.519 -22.389  -1.636
   33   1HD2  LEU   4          HD21      LEU   4  71.287 -19.324   0.953
   34   2HD2  LEU   4          HD23      LEU   4  71.658 -21.037   1.130
   35   3HD2  LEU   4          HD22      LEU   4  72.741 -19.993   0.217
   36    H    VAL   5           HN       VAL   5  73.551 -16.719  -0.903
   37    HA   VAL   5           HA       VAL   5  72.058 -15.594   1.420
   38    HB   VAL   5           HB       VAL   5  74.922 -16.584   1.558
   39   1HG1  VAL   5          HG13      VAL   5  73.715 -14.677   3.081
   40   2HG1  VAL   5          HG12      VAL   5  73.278 -16.128   3.984
   41   3HG1  VAL   5          HG11      VAL   5  74.975 -15.752   3.685
   42   1HG2  VAL   5          HG22      VAL   5  72.298 -17.898   2.119
   43   2HG2  VAL   5          HG21      VAL   5  73.810 -18.607   1.551
   44   3HG2  VAL   5          HG23      VAL   5  73.615 -18.196   3.254
   45    H    GLN   6           HN       GLN   6  72.023 -13.900  -0.431
   46    HA   GLN   6           HA       GLN   6  74.207 -11.981   0.101
   47   1HB   GLN   6           HB2      GLN   6  74.396 -11.519  -2.401
   48   2HB   GLN   6           HB1      GLN   6  75.121 -13.026  -1.845
   49   1HG   GLN   6           HG2      GLN   6  72.991 -14.206  -2.482
   50   2HG   GLN   6           HG1      GLN   6  72.428 -12.693  -3.195
   51   1HE2  GLN   6          HE22      GLN   6  75.296 -14.883  -5.114
   52   2HE2  GLN   6          HE21      GLN   6  74.824 -15.294  -3.536
   53    H    ALA   7           HN       ALA   7  71.165 -12.609  -1.667
   54    HA   ALA   7           HA       ALA   7  70.453  -9.843  -1.953
   55   1HB   ALA   7           HB2      ALA   7  68.832 -12.397  -1.998
   56   2HB   ALA   7           HB1      ALA   7  68.108 -10.810  -2.261
   57   3HB   ALA   7           HB3      ALA   7  69.338 -11.413  -3.373
   58    NH1  ARG   8           NH1      ARG   8  70.183 -12.579   6.564
   59    NH2  ARG   8           NH2      ARG   8  72.255 -11.680   6.636
   60    H    ARG   8           HN       ARG   8  70.185  -8.550  -0.186
   61    HA   ARG   8           HA       ARG   8  68.336  -9.435   1.923
   62   1HB   ARG   8           HB2      ARG   8  71.154  -8.473   2.479
   63   2HB   ARG   8           HB1      ARG   8  69.915  -8.719   3.710
   64   1HG   ARG   8           HG2      ARG   8  69.731 -11.106   2.971
   65   2HG   ARG   8           HG1      ARG   8  71.087 -10.830   1.878
   66   1HD   ARG   8           HD2      ARG   8  72.613 -10.852   3.566
   67   2HD   ARG   8           HD1      ARG   8  71.559  -9.960   4.663
   68    HE   ARG   8           HE       ARG   8  71.030 -12.845   4.119
   69   1HH1  ARG   8          HH11      ARG   8  69.398 -12.903   6.037
   70   2HH1  ARG   8          HH12      ARG   8  70.166 -12.619   7.563
   71   1HH2  ARG   8          HH21      ARG   8  73.058 -11.316   6.164
   72   2HH2  ARG   8          HH22      ARG   8  72.239 -11.721   7.635
   73    H    LYS   9           HN       LYS   9  67.561  -7.621   3.229
   74    HA   LYS   9           HA       LYS   9  67.580  -5.102   1.697
   75   1HB   LYS   9           HB2      LYS   9  65.656  -4.502   3.189
   76   2HB   LYS   9           HB1      LYS   9  65.377  -5.976   2.262
   77   1HG   LYS   9           HG2      LYS   9  65.386  -7.299   4.119
   78   2HG   LYS   9           HG1      LYS   9  66.698  -6.395   4.875
   79   1HD   LYS   9           HD2      LYS   9  64.944  -4.519   5.212
   80   2HD   LYS   9           HD1      LYS   9  63.746  -5.771   4.877
   81   1HE   LYS   9           HE2      LYS   9  63.965  -5.869   7.217
   82   2HE   LYS   9           HE1      LYS   9  65.034  -7.159   6.665
   83   1HZ   LYS   9           HZ3      LYS   9  66.783  -5.263   6.644
   84   2HZ   LYS   9           HZ2      LYS   9  65.717  -4.506   7.728
   85   3HZ   LYS   9           HZ1      LYS   9  66.382  -6.022   8.107
   86    NH1  ARG  10           NH1      ARG  10  69.554  -4.573   9.914
   87    NH2  ARG  10           NH2      ARG  10  71.179  -5.924  10.717
   88    H    ARG  10           HN       ARG  10  69.982  -5.438   2.913
   89    HA   ARG  10           HA       ARG  10  69.874  -3.999   5.489
   90   1HB   ARG  10           HB2      ARG  10  71.292  -6.159   4.967
   91   2HB   ARG  10           HB1      ARG  10  72.424  -4.994   4.279
   92   1HG   ARG  10           HG2      ARG  10  73.100  -5.178   6.536
   93   2HG   ARG  10           HG1      ARG  10  72.138  -3.699   6.495
   94   1HD   ARG  10           HD2      ARG  10  70.137  -5.094   7.173
   95   2HD   ARG  10           HD1      ARG  10  71.251  -6.437   7.437
   96    HE   ARG  10           HE       ARG  10  72.277  -4.244   8.884
   97   1HH1  ARG  10          HH11      ARG  10  69.218  -3.944   9.213
   98   2HH1  ARG  10          HH12      ARG  10  68.981  -4.794  10.704
   99   1HH2  ARG  10          HH21      ARG  10  72.089  -6.330  10.630
  100   2HH2  ARG  10          HH22      ARG  10  70.606  -6.145  11.506
  101    H    LYS  11           HN       LYS  11  69.344  -2.602   2.958
  102    HA   LYS  11           HA       LYS  11  71.766  -0.951   2.625
  103   1HB   LYS  11           HB2      LYS  11  70.439   0.116   0.753
  104   2HB   LYS  11           HB1      LYS  11  70.783  -1.598   0.529
  105   1HG   LYS  11           HG2      LYS  11  68.572  -2.232   1.089
  106   2HG   LYS  11           HG1      LYS  11  68.217  -0.665   1.813
  107   1HD   LYS  11           HD2      LYS  11  68.905   0.063  -0.745
  108   2HD   LYS  11           HD1      LYS  11  68.119  -1.492  -1.018
  109   1HE   LYS  11           HE2      LYS  11  66.104  -0.767   0.050
  110   2HE   LYS  11           HE1      LYS  11  66.887   0.675   0.696
  111   1HZ   LYS  11           HZ3      LYS  11  66.477   0.103  -2.189
  112   2HZ   LYS  11           HZ2      LYS  11  65.521   1.153  -1.256
  113   3HZ   LYS  11           HZ1      LYS  11  67.158   1.512  -1.535
  114    NH1  ARG  12           NH2      ARG  12  71.983  -1.312   8.908
  115    NH2  ARG  12           NH1      ARG  12  70.226  -1.799  10.242
  116    H    ARG  12           HN       ARG  12  71.908   1.070   3.485
  117    HA   ARG  12           HA       ARG  12  69.421   2.426   4.427
  118   1HB   ARG  12           HB2      ARG  12  71.805   1.628   6.091
  119   2HB   ARG  12           HB1      ARG  12  70.839   3.039   6.525
  120   1HG   ARG  12           HG2      ARG  12  68.817   1.674   6.623
  121   2HG   ARG  12           HG1      ARG  12  69.717   0.257   6.081
  122   1HD   ARG  12           HD2      ARG  12  71.210   1.087   8.243
  123   2HD   ARG  12           HD1      ARG  12  69.567   1.471   8.759
  124    HE   ARG  12           HE       ARG  12  69.155  -1.031   7.952
  125   1HH1  ARG  12          HH21      ARG  12  72.353  -0.873   8.089
  126   2HH1  ARG  12          HH22      ARG  12  72.590  -1.814   9.524
  127   1HH2  ARG  12          HH11      ARG  12  69.249  -1.734  10.447
  128   2HH2  ARG  12          HH12      ARG  12  70.834  -2.302  10.858
  129    H    THR  13           HN       THR  13  70.850   3.100   2.135
  130    HA   THR  13           HA       THR  13  72.786   5.209   2.710
  131    HB   THR  13           HB       THR  13  72.671   5.622   0.296
  132    HG1  THR  13           HG1      THR  13  71.129   4.687  -0.940
  133   1HG2  THR  13          HG23      THR  13  73.941   3.641   1.192
  134   2HG2  THR  13          HG22      THR  13  72.541   2.644   0.796
  135   3HG2  THR  13          HG21      THR  13  73.426   3.472  -0.486
  136    H    SER  14           HN       SER  14  69.359   4.902   2.041
  137    HA   SER  14           HA       SER  14  68.820   7.520   3.184
  138   1HB   SER  14           HB2      SER  14  69.385   7.726   0.583
  139   2HB   SER  14           HB1      SER  14  67.723   7.167   0.418
  140    HG   SER  14           HG       SER  14  67.952   9.479   0.555
  141    H    ILE  15           HN       ILE  15  68.201   4.718   3.668
  142    HA   ILE  15           HA       ILE  15  65.272   4.953   3.848
  143    HB   ILE  15           HB       ILE  15  66.654   2.713   2.353
  144   1HG1  ILE  15          HG12      ILE  15  66.058   4.737   1.048
  145   2HG1  ILE  15          HG11      ILE  15  65.099   3.346   0.556
  146   1HG2  ILE  15          HG23      ILE  15  64.091   2.734   3.849
  147   2HG2  ILE  15          HG22      ILE  15  63.994   2.100   2.207
  148   3HG2  ILE  15          HG21      ILE  15  65.101   1.371   3.370
  149   1HD1  ILE  15          HD12      ILE  15  63.262   4.136   2.073
  150   2HD1  ILE  15          HD11      ILE  15  64.201   5.591   2.394
  151   3HD1  ILE  15          HD13      ILE  15  63.622   5.261   0.772
  152    H    GLU  16           HN       GLU  16  66.062   5.189   6.090
  153    HA   GLU  16           HA       GLU  16  67.275   3.016   7.497
  154   1HB   GLU  16           HB2      GLU  16  65.828   5.514   8.230
  155   2HB   GLU  16           HB1      GLU  16  65.858   4.234   9.443
  156   1HG   GLU  16           HG2      GLU  16  67.822   5.401   9.939
  157   2HG   GLU  16           HG1      GLU  16  68.418   4.128   8.875
  158    H    ASN  17           HN       ASN  17  66.145   1.459   8.854
  159    HA   ASN  17           HA       ASN  17  63.896   0.252   7.600
  160   1HB   ASN  17           HB2      ASN  17  63.729  -1.105   9.715
  161   2HB   ASN  17           HB1      ASN  17  65.350  -1.078   9.017
  162   1HD2  ASN  17          HD22      ASN  17  64.657   0.934  12.533
  163   2HD2  ASN  17          HD21      ASN  17  63.347   0.534  11.530
  164    NH1  ARG  18           NH1      ARG  18  59.944   6.912  13.360
  165    NH2  ARG  18           NH2      ARG  18  61.203   7.641  15.091
  166    H    ARG  18           HN       ARG  18  64.108   2.703  10.076
  167    HA   ARG  18           HA       ARG  18  61.304   2.472  10.847
  168   1HB   ARG  18           HB2      ARG  18  63.560   3.665  11.958
  169   2HB   ARG  18           HB1      ARG  18  62.603   5.043  11.415
  170   1HG   ARG  18           HG2      ARG  18  60.628   4.102  12.609
  171   2HG   ARG  18           HG1      ARG  18  61.643   2.791  13.207
  172   1HD   ARG  18           HD2      ARG  18  61.460   4.562  14.901
  173   2HD   ARG  18           HD1      ARG  18  63.118   4.451  14.311
  174    HE   ARG  18           HE       ARG  18  62.753   6.511  13.056
  175   1HH1  ARG  18          HH11      ARG  18  59.842   6.343  12.545
  176   2HH1  ARG  18          HH12      ARG  18  59.188   7.491  13.665
  177   1HH2  ARG  18          HH21      ARG  18  62.063   7.631  15.601
  178   2HH2  ARG  18          HH22      ARG  18  60.447   8.221  15.397
  179    H    VAL  19           HN       VAL  19  63.155   4.221   8.430
  180    HA   VAL  19           HA       VAL  19  61.128   6.190   7.892
  181    HB   VAL  19           HB       VAL  19  63.722   5.978   7.084
  182   1HG1  VAL  19          HG13      VAL  19  62.069   5.205   4.652
  183   2HG1  VAL  19          HG12      VAL  19  63.733   5.767   4.610
  184   3HG1  VAL  19          HG11      VAL  19  63.345   4.238   5.397
  185   1HG2  VAL  19          HG23      VAL  19  62.063   7.925   7.107
  186   2HG2  VAL  19          HG22      VAL  19  63.269   7.962   5.820
  187   3HG2  VAL  19          HG21      VAL  19  61.621   7.441   5.470
  188    NH1  ARG  20           NH2      ARG  20  63.618  -0.794   2.647
  189    NH2  ARG  20           NH1      ARG  20  62.486  -1.547   0.842
  190    H    ARG  20           HN       ARG  20  61.900   3.051   6.401
  191    HA   ARG  20           HA       ARG  20  59.808   3.165   4.449
  192   1HB   ARG  20           HB2      ARG  20  61.565   1.081   5.581
  193   2HB   ARG  20           HB1      ARG  20  60.017   0.485   4.982
  194   1HG   ARG  20           HG2      ARG  20  61.035   2.365   3.070
  195   2HG   ARG  20           HG1      ARG  20  62.331   1.239   3.468
  196   1HD   ARG  20           HD2      ARG  20  59.584   0.156   2.933
  197   2HD   ARG  20           HD1      ARG  20  60.594   0.641   1.571
  198    HE   ARG  20           HE       ARG  20  61.028  -1.684   3.278
  199   1HH1  ARG  20          HH21      ARG  20  63.621  -0.450   3.586
  200   2HH1  ARG  20          HH22      ARG  20  64.480  -0.904   2.152
  201   1HH2  ARG  20          HH11      ARG  20  61.622  -1.781   0.398
  202   2HH2  ARG  20          HH12      ARG  20  63.348  -1.655   0.346
  203    CH2  TRP  21           CH2      TRP  21  56.893  -2.967   5.324
  204    H    TRP  21           HN       TRP  21  59.804   1.681   7.702
  205    HA   TRP  21           HA       TRP  21  56.979   1.129   7.415
  206   1HB   TRP  21           HB2      TRP  21  59.022   0.549   9.419
  207   2HB   TRP  21           HB1      TRP  21  57.487   1.020  10.159
  208    HD1  TRP  21           HD1      TRP  21  56.605  -1.388  10.812
  209    HE1  TRP  21           HE1      TRP  21  55.810  -3.410   9.412
  210    HE3  TRP  21           HE3      TRP  21  58.317  -0.026   6.206
  211    HZ2  TRP  21           HZ2      TRP  21  55.890  -4.305   6.665
  212    HZ3  TRP  21           HZ3      TRP  21  57.947  -1.430   4.232
  213    HH2  TRP  21           HH2      TRP  21  56.717  -3.580   4.452
  214    H    SER  22           HN       SER  22  58.668   3.994   7.958
  215    HA   SER  22           HA       SER  22  56.634   5.324   9.559
  216   1HB   SER  22           HB2      SER  22  58.967   6.231   9.411
  217   2HB   SER  22           HB1      SER  22  58.721   6.517   7.692
  218    HG   SER  22           HG       SER  22  57.739   7.870   9.898
  219    H    LEU  23           HN       LEU  23  57.470   4.823   6.151
  220    HA   LEU  23           HA       LEU  23  55.465   6.392   4.870
  221   1HB   LEU  23           HB2      LEU  23  56.446   3.613   4.093
  222   2HB   LEU  23           HB1      LEU  23  55.584   4.704   3.037
  223    HG   LEU  23           HG       LEU  23  58.120   5.687   4.266
  224   1HD1  LEU  23          HD13      LEU  23  58.213   3.223   3.191
  225   2HD1  LEU  23          HD12      LEU  23  58.264   4.156   1.696
  226   3HD1  LEU  23          HD11      LEU  23  59.504   4.395   2.926
  227   1HD2  LEU  23          HD22      LEU  23  56.438   6.898   2.622
  228   2HD2  LEU  23          HD21      LEU  23  58.175   7.060   2.362
  229   3HD2  LEU  23          HD23      LEU  23  57.242   5.919   1.394
  230    H    GLU  24           HN       GLU  24  55.459   3.131   6.202
  231    HA   GLU  24           HA       GLU  24  52.823   2.340   5.533
  232   1HB   GLU  24           HB2      GLU  24  54.720   0.988   6.658
  233   2HB   GLU  24           HB1      GLU  24  54.102   1.647   8.173
  234   1HG   GLU  24           HG2      GLU  24  51.786   0.797   6.961
  235   2HG   GLU  24           HG1      GLU  24  52.941  -0.416   6.408
  236    H    THR  25           HN       THR  25  53.899   3.830   8.600
  237    HA   THR  25           HA       THR  25  51.360   4.044   9.800
  238    HB   THR  25           HB       THR  25  53.539   6.107  10.134
  239    HG1  THR  25           HG1      THR  25  53.351   3.488  11.206
  240   1HG2  THR  25          HG21      THR  25  51.289   6.321  11.297
  241   2HG2  THR  25          HG23      THR  25  51.689   4.837  12.161
  242   3HG2  THR  25          HG22      THR  25  52.689   6.275  12.370
  243    H    MET  26           HN       MET  26  52.780   5.996   7.252
  244    HA   MET  26           HA       MET  26  50.756   8.121   7.612
  245   1HB   MET  26           HB2      MET  26  53.296   7.840   6.235
  246   2HB   MET  26           HB1      MET  26  52.077   8.504   5.149
  247   1HG   MET  26           HG2      MET  26  51.542  10.255   6.778
  248   2HG   MET  26           HG1      MET  26  52.698   9.570   7.921
  249   1HE   MET  26           HE2      MET  26  52.254  12.411   6.640
  250   2HE   MET  26           HE1      MET  26  53.526  12.985   5.564
  251   3HE   MET  26           HE3      MET  26  52.198  12.004   4.927
  252    H    PHE  27           HN       PHE  27  51.193   5.263   5.639
  253    HA   PHE  27           HA       PHE  27  49.060   6.091   3.772
  254   1HB   PHE  27           HB2      PHE  27  50.978   3.776   3.880
  255   2HB   PHE  27           HB1      PHE  27  49.533   3.685   2.878
  256    HD1  PHE  27           HD2      PHE  27  49.060   5.797   1.365
  257    HD2  PHE  27           HD1      PHE  27  52.902   4.773   2.989
  258    HE1  PHE  27           HE2      PHE  27  50.167   7.170  -0.377
  259    HE2  PHE  27           HE1      PHE  27  54.005   6.147   1.247
  260    HZ   PHE  27           HZ       PHE  27  52.637   7.344  -0.434
  261    H    LEU  28           HN       LEU  28  49.238   4.448   6.765
  262    HA   LEU  28           HA       LEU  28  46.926   2.722   6.169
  263   1HB   LEU  28           HB2      LEU  28  48.609   3.090   8.655
  264   2HB   LEU  28           HB1      LEU  28  47.228   1.994   8.561
  265    HG   LEU  28           HG       LEU  28  49.617   1.905   6.695
  266   1HD1  LEU  28          HD12      LEU  28  48.931   0.328   9.180
  267   2HD1  LEU  28          HD11      LEU  28  50.058  -0.271   7.961
  268   3HD1  LEU  28          HD13      LEU  28  50.412   1.222   8.832
  269   1HD2  LEU  28          HD21      LEU  28  46.989   0.771   6.535
  270   2HD2  LEU  28          HD23      LEU  28  48.355   0.511   5.451
  271   3HD2  LEU  28          HD22      LEU  28  48.122  -0.543   6.844
  272    H    LYS  29           HN       LYS  29  46.666   5.729   6.227
  273    HA   LYS  29           HA       LYS  29  44.625   5.916   8.400
  274   1HB   LYS  29           HB2      LYS  29  44.890   8.350   8.289
  275   2HB   LYS  29           HB1      LYS  29  46.463   7.605   8.555
  276   1HG   LYS  29           HG2      LYS  29  46.768   7.698   6.007
  277   2HG   LYS  29           HG1      LYS  29  45.364   8.764   5.986
  278   1HD   LYS  29           HD2      LYS  29  46.660  10.089   7.832
  279   2HD   LYS  29           HD1      LYS  29  48.072   9.235   7.208
  280   1HE   LYS  29           HE2      LYS  29  46.307  10.442   5.155
  281   2HE   LYS  29           HE1      LYS  29  47.169  11.586   6.184
  282   1HZ   LYS  29           HZ1      LYS  29  49.210  10.219   5.688
  283   2HZ   LYS  29           HZ3      LYS  29  48.306   9.461   4.469
  284   3HZ   LYS  29           HZ2      LYS  29  48.592  11.134   4.396
  285    H    CYS  30           HN       CYS  30  45.358   6.672   5.033
  286    HA   CYS  30           HA       CYS  30  42.502   6.361   4.362
  287   1HB   CYS  30           HB2      CYS  30  44.231   8.664   3.402
  288   2HB   CYS  30           HB1      CYS  30  42.563   8.355   2.921
  289    HG   CYS  30           HG       CYS  30  43.265   9.934   5.292
  290    HA   PRO  31           HA       PRO  31  44.769   4.096   1.180
  291   1HB   PRO  31           HB2      PRO  31  42.602   2.938  -0.017
  292   2HB   PRO  31           HB1      PRO  31  43.252   2.372   1.533
  293   1HG   PRO  31           HG2      PRO  31  40.760   3.901   0.993
  294   2HG   PRO  31           HG1      PRO  31  41.157   2.855   2.365
  295   1HD   PRO  31           HD2      PRO  31  41.230   5.716   2.310
  296   2HD   PRO  31           HD1      PRO  31  41.789   4.659   3.625
  297    H    LYS  32           HN       LYS  32  43.595   6.968   0.749
  298    HA   LYS  32           HA       LYS  32  43.244   6.723  -2.185
  299   1HB   LYS  32           HB2      LYS  32  41.821   8.788  -1.996
  300   2HB   LYS  32           HB1      LYS  32  41.147   7.379  -1.175
  301   1HG   LYS  32           HG2      LYS  32  41.628   8.213   0.948
  302   2HG   LYS  32           HG1      LYS  32  42.938   9.236   0.359
  303   1HD   LYS  32           HD2      LYS  32  41.428  10.836  -0.542
  304   2HD   LYS  32           HD1      LYS  32  40.058   9.731  -0.413
  305   1HE   LYS  32           HE2      LYS  32  40.515   9.751   2.125
  306   2HE   LYS  32           HE1      LYS  32  41.519  11.165   1.806
  307   1HZ   LYS  32           HZ2      LYS  32  39.563  12.154   0.667
  308   2HZ   LYS  32           HZ1      LYS  32  38.628  10.849   1.223
  309   3HZ   LYS  32           HZ3      LYS  32  39.342  11.913   2.334
  310    HA   PRO  33           HA       PRO  33  46.689   9.781  -1.035
  311   1HB   PRO  33           HB2      PRO  33  48.871   8.339  -1.881
  312   2HB   PRO  33           HB1      PRO  33  48.282   8.334  -0.209
  313   1HG   PRO  33           HG2      PRO  33  47.985   6.237  -2.315
  314   2HG   PRO  33           HG1      PRO  33  48.073   6.057  -0.554
  315   1HD   PRO  33           HD2      PRO  33  45.704   5.934  -2.062
  316   2HD   PRO  33           HD1      PRO  33  45.799   6.226  -0.312
  317    H    SER  34           HN       SER  34  47.903  10.984  -2.679
  318    HA   SER  34           HA       SER  34  46.831  10.562  -5.390
  319   1HB   SER  34           HB2      SER  34  48.058  12.817  -3.898
  320   2HB   SER  34           HB1      SER  34  48.326  12.779  -5.638
  321    HG   SER  34           HG       SER  34  45.975  13.104  -4.175
  322    H    LEU  35           HN       LEU  35  48.133  10.114  -7.203
  323    HA   LEU  35           HA       LEU  35  50.597   8.720  -6.718
  324   1HB   LEU  35           HB2      LEU  35  50.058   7.986  -8.794
  325   2HB   LEU  35           HB1      LEU  35  48.843   9.243  -8.955
  326    HG   LEU  35           HG       LEU  35  50.751  10.799  -9.632
  327   1HD1  LEU  35          HD11      LEU  35  52.386   8.856  -8.745
  328   2HD1  LEU  35          HD13      LEU  35  52.287   8.381 -10.440
  329   3HD1  LEU  35          HD12      LEU  35  52.870   9.988 -10.008
  330   1HD2  LEU  35          HD23      LEU  35  49.856   8.423 -11.257
  331   2HD2  LEU  35          HD22      LEU  35  49.309  10.095 -11.368
  332   3HD2  LEU  35          HD21      LEU  35  50.912   9.652 -11.953
  333    H    GLN  36           HN       GLN  36  49.723  12.062  -7.148
  334    HA   GLN  36           HA       GLN  36  52.345  13.081  -7.852
  335   1HB   GLN  36           HB2      GLN  36  49.814  14.176  -7.643
  336   2HB   GLN  36           HB1      GLN  36  50.607  14.821  -6.206
  337   1HG   GLN  36           HG2      GLN  36  52.301  15.881  -7.476
  338   2HG   GLN  36           HG1      GLN  36  51.941  14.921  -8.912
  339   1HE2  GLN  36          HE22      GLN  36  49.586  18.165  -8.029
  340   2HE2  GLN  36          HE21      GLN  36  50.593  17.512  -6.830
  341    H    GLN  37           HN       GLN  37  50.552  12.455  -4.878
  342    HA   GLN  37           HA       GLN  37  52.565  13.428  -3.063
  343   1HB   GLN  37           HB2      GLN  37  50.157  12.992  -2.452
  344   2HB   GLN  37           HB1      GLN  37  50.498  11.265  -2.555
  345   1HG   GLN  37           HG2      GLN  37  51.553  11.242  -0.550
  346   2HG   GLN  37           HG1      GLN  37  52.456  12.712  -0.913
  347   1HE2  GLN  37          HE22      GLN  37  48.645  13.469   0.415
  348   2HE2  GLN  37          HE21      GLN  37  48.886  12.373  -0.859
  349    H    ILE  38           HN       ILE  38  52.149  10.470  -4.908
  350    HA   ILE  38           HA       ILE  38  53.981   8.877  -3.341
  351    HB   ILE  38           HB       ILE  38  52.839   8.589  -6.137
  352   1HG1  ILE  38          HG12      ILE  38  51.345   8.107  -4.241
  353   2HG1  ILE  38          HG11      ILE  38  51.748   6.613  -5.085
  354   1HG2  ILE  38          HG21      ILE  38  54.985   6.940  -4.772
  355   2HG2  ILE  38          HG23      ILE  38  53.876   6.194  -5.924
  356   3HG2  ILE  38          HG22      ILE  38  54.932   7.509  -6.440
  357   1HD1  ILE  38          HD13      ILE  38  53.704   6.470  -3.318
  358   2HD1  ILE  38          HD12      ILE  38  52.697   7.585  -2.397
  359   3HD1  ILE  38          HD11      ILE  38  52.073   5.997  -2.841
  360    H    THR  39           HN       THR  39  54.238  11.136  -5.997
  361    HA   THR  39           HA       THR  39  56.985  10.608  -6.693
  362    HB   THR  39           HB       THR  39  55.587  13.292  -6.861
  363    HG1  THR  39           HG1      THR  39  54.232  12.317  -8.109
  364   1HG2  THR  39          HG21      THR  39  58.140  12.663  -7.463
  365   2HG2  THR  39          HG23      THR  39  57.367  12.231  -8.988
  366   3HG2  THR  39          HG22      THR  39  57.218  13.871  -8.357
  367    H    HIS  40           HN       HIS  40  55.427  12.994  -4.575
  368    HA   HIS  40           HA       HIS  40  57.874  14.043  -3.470
  369   1HB   HIS  40           HB2      HIS  40  55.051  14.497  -3.167
  370   2HB   HIS  40           HB1      HIS  40  55.750  14.275  -1.564
  371    HD1  HIS  40           HD1      HIS  40  56.109  16.593  -0.686
  372    HD2  HIS  40           HD2      HIS  40  57.361  16.233  -4.646
  373    HE1  HIS  40           HE1      HIS  40  57.195  18.798  -1.298
  374    H    ILE  41           HN       ILE  41  56.097  11.120  -2.944
  375    HA   ILE  41           HA       ILE  41  57.002  10.579  -0.259
  376    HB   ILE  41           HB       ILE  41  55.448   9.262  -2.314
  377   1HG1  ILE  41          HG12      ILE  41  55.029   7.861   0.029
  378   2HG1  ILE  41          HG11      ILE  41  55.639   9.407   0.616
  379   1HG2  ILE  41          HG22      ILE  41  57.528   7.525  -0.980
  380   2HG2  ILE  41          HG21      ILE  41  56.024   6.878  -1.635
  381   3HG2  ILE  41          HG23      ILE  41  57.185   7.667  -2.704
  382   1HD1  ILE  41          HD11      ILE  41  53.458   9.260  -1.464
  383   2HD1  ILE  41          HD13      ILE  41  53.095   9.204   0.260
  384   3HD1  ILE  41          HD12      ILE  41  53.891  10.619  -0.428
  385    H    ALA  42           HN       ALA  42  58.145   9.873  -3.517
  386    HA   ALA  42           HA       ALA  42  60.406   8.305  -2.866
  387   1HB   ALA  42           HB1      ALA  42  59.752  10.098  -5.194
  388   2HB   ALA  42           HB3      ALA  42  61.289   9.238  -5.105
  389   3HB   ALA  42           HB2      ALA  42  59.774   8.335  -5.147
  390    H    ASN  43           HN       ASN  43  60.242  11.807  -3.538
  391    HA   ASN  43           HA       ASN  43  62.947  12.342  -2.755
  392   1HB   ASN  43           HB2      ASN  43  60.484  14.115  -2.679
  393   2HB   ASN  43           HB1      ASN  43  62.130  14.694  -2.414
  394   1HD2  ASN  43          HD22      ASN  43  62.281  15.259  -5.902
  395   2HD2  ASN  43          HD21      ASN  43  62.313  15.952  -4.353
  396    H    GLN  44           HN       GLN  44  60.066  11.619  -0.987
  397    HA   GLN  44           HA       GLN  44  60.769  12.763   1.542
  398   1HB   GLN  44           HB2      GLN  44  58.613  11.342   0.393
  399   2HB   GLN  44           HB1      GLN  44  59.103  10.434   1.814
  400   1HG   GLN  44           HG2      GLN  44  58.626  13.421   1.866
  401   2HG   GLN  44           HG1      GLN  44  57.343  12.251   2.177
  402   1HE2  GLN  44          HE22      GLN  44  58.304  11.964   5.539
  403   2HE2  GLN  44          HE21      GLN  44  57.057  11.996   4.387
  404    H    LEU  45           HN       LEU  45  61.385   9.582   0.060
  405    HA   LEU  45           HA       LEU  45  63.212   9.049   2.351
  406   1HB   LEU  45           HB2      LEU  45  62.592   6.758   2.466
  407   2HB   LEU  45           HB1      LEU  45  61.089   7.665   2.407
  408    HG   LEU  45           HG       LEU  45  62.345   6.501  -0.081
  409   1HD1  LEU  45          HD11      LEU  45  61.215   5.060   2.131
  410   2HD1  LEU  45          HD13      LEU  45  60.086   4.968   0.779
  411   3HD1  LEU  45          HD12      LEU  45  61.752   4.430   0.576
  412   1HD2  LEU  45          HD22      LEU  45  59.813   7.849   0.690
  413   2HD2  LEU  45          HD21      LEU  45  60.709   7.906  -0.828
  414   3HD2  LEU  45          HD23      LEU  45  59.684   6.520  -0.464
  415    H    GLY  46           HN       GLY  46  63.655  10.130  -0.415
  416   1HA   GLY  46           HA2      GLY  46  65.143   9.861  -2.212
  417   2HA   GLY  46           HA1      GLY  46  66.209   9.294  -0.939
  418    H    LEU  47           HN       LEU  47  63.324   7.511  -1.964
  419    HA   LEU  47           HA       LEU  47  65.165   5.362  -2.909
  420   1HB   LEU  47           HB2      LEU  47  63.705   3.754  -2.161
  421   2HB   LEU  47           HB1      LEU  47  63.238   5.039  -1.070
  422    HG   LEU  47           HG       LEU  47  61.833   4.244  -3.620
  423   1HD1  LEU  47          HD11      LEU  47  61.631   3.180  -1.062
  424   2HD1  LEU  47          HD13      LEU  47  60.295   4.330  -1.130
  425   3HD1  LEU  47          HD12      LEU  47  60.411   3.045  -2.327
  426   1HD2  LEU  47          HD22      LEU  47  61.704   6.683  -1.994
  427   2HD2  LEU  47          HD21      LEU  47  61.253   6.432  -3.672
  428   3HD2  LEU  47          HD23      LEU  47  60.146   5.975  -2.380
  429    H    GLU  48           HN       GLU  48  64.051   3.948  -4.688
  430    HA   GLU  48           HA       GLU  48  63.384   5.783  -6.903
  431   1HB   GLU  48           HB2      GLU  48  65.078   3.826  -7.044
  432   2HB   GLU  48           HB1      GLU  48  63.660   2.778  -7.090
  433   1HG   GLU  48           HG2      GLU  48  62.870   3.762  -9.109
  434   2HG   GLU  48           HG1      GLU  48  63.982   5.124  -8.969
  435    H    LYS  49           HN       LYS  49  61.408   5.593  -8.041
  436    HA   LYS  49           HA       LYS  49  59.085   5.041  -6.534
  437   1HB   LYS  49           HB2      LYS  49  59.393   6.376  -8.751
  438   2HB   LYS  49           HB1      LYS  49  59.077   4.825  -9.529
  439   1HG   LYS  49           HG2      LYS  49  57.102   4.972  -7.572
  440   2HG   LYS  49           HG1      LYS  49  57.219   6.630  -8.158
  441   1HD   LYS  49           HD2      LYS  49  56.523   6.075 -10.290
  442   2HD   LYS  49           HD1      LYS  49  57.172   4.437 -10.188
  443   1HE   LYS  49           HE2      LYS  49  54.862   4.064 -10.045
  444   2HE   LYS  49           HE1      LYS  49  55.342   4.101  -8.348
  445   1HZ   LYS  49           HZ1      LYS  49  54.871   6.630  -8.619
  446   2HZ   LYS  49           HZ3      LYS  49  53.908   6.123  -9.920
  447   3HZ   LYS  49           HZ2      LYS  49  53.589   5.546  -8.354
  448    H    ASP  50           HN       ASP  50  61.159   2.822  -8.212
  449    HA   ASP  50           HA       ASP  50  59.177   0.767  -8.661
  450   1HB   ASP  50           HB2      ASP  50  61.419   0.954  -9.837
  451   2HB   ASP  50           HB1      ASP  50  62.164   0.386  -8.342
  452    H    VAL  51           HN       VAL  51  61.451   1.485  -6.000
  453    HA   VAL  51           HA       VAL  51  60.648  -0.964  -4.587
  454    HB   VAL  51           HB       VAL  51  62.945  -0.078  -4.345
  455   1HG1  VAL  51          HG11      VAL  51  61.502   2.380  -3.832
  456   2HG1  VAL  51          HG13      VAL  51  62.612   2.034  -2.508
  457   3HG1  VAL  51          HG12      VAL  51  63.214   2.151  -4.159
  458   1HG2  VAL  51          HG22      VAL  51  61.181  -0.155  -1.889
  459   2HG2  VAL  51          HG21      VAL  51  62.199  -1.441  -2.534
  460   3HG2  VAL  51          HG23      VAL  51  62.936  -0.026  -1.782
  461    H    VAL  52           HN       VAL  52  59.667   2.384  -4.720
  462    HA   VAL  52           HA       VAL  52  58.217   2.322  -2.201
  463    HB   VAL  52           HB       VAL  52  59.137   4.366  -3.701
  464   1HG1  VAL  52          HG13      VAL  52  57.230   3.725  -5.418
  465   2HG1  VAL  52          HG12      VAL  52  56.226   4.661  -4.310
  466   3HG1  VAL  52          HG11      VAL  52  57.620   5.413  -5.085
  467   1HG2  VAL  52          HG21      VAL  52  57.830   4.118  -1.359
  468   2HG2  VAL  52          HG23      VAL  52  58.203   5.682  -2.082
  469   3HG2  VAL  52          HG22      VAL  52  56.599   4.978  -2.284
  470    NH1  ARG  53           NH1      ARG  53  52.538   1.002 -11.428
  471    NH2  ARG  53           NH2      ARG  53  51.843  -0.791 -10.239
  472    H    ARG  53           HN       ARG  53  57.529   1.541  -5.548
  473    HA   ARG  53           HA       ARG  53  54.641   1.372  -5.125
  474   1HB   ARG  53           HB2      ARG  53  56.371   1.473  -7.360
  475   2HB   ARG  53           HB1      ARG  53  55.572  -0.093  -7.448
  476   1HG   ARG  53           HG2      ARG  53  53.775   2.141  -6.740
  477   2HG   ARG  53           HG1      ARG  53  54.486   2.266  -8.349
  478   1HD   ARG  53           HD2      ARG  53  53.802  -0.322  -8.432
  479   2HD   ARG  53           HD1      ARG  53  52.600   0.223  -7.262
  480    HE   ARG  53           HE       ARG  53  52.024   1.993  -9.067
  481   1HH1  ARG  53          HH11      ARG  53  52.867   1.946 -11.459
  482   2HH1  ARG  53          HH12      ARG  53  52.413   0.488 -12.277
  483   1HH2  ARG  53          HH21      ARG  53  51.639  -1.220  -9.360
  484   2HH2  ARG  53          HH22      ARG  53  51.718  -1.305 -11.088
  485    H    VAL  54           HN       VAL  54  57.386  -0.879  -5.247
  486    HA   VAL  54           HA       VAL  54  55.851  -3.302  -5.136
  487    HB   VAL  54           HB       VAL  54  58.616  -2.767  -3.993
  488   1HG1  VAL  54          HG11      VAL  54  56.975  -5.224  -4.489
  489   2HG1  VAL  54          HG13      VAL  54  58.718  -5.317  -4.741
  490   3HG1  VAL  54          HG12      VAL  54  58.077  -4.866  -3.161
  491   1HG2  VAL  54          HG21      VAL  54  57.896  -2.400  -6.587
  492   2HG2  VAL  54          HG23      VAL  54  59.487  -2.987  -6.103
  493   3HG2  VAL  54          HG22      VAL  54  58.242  -4.129  -6.609
  494    CH2  TRP  55           CH2      TRP  55  53.673   2.225   3.134
  495    H    TRP  55           HN       TRP  55  57.177  -1.207  -2.549
  496    HA   TRP  55           HA       TRP  55  56.174  -2.883  -0.423
  497   1HB   TRP  55           HB2      TRP  55  57.883  -1.297   0.191
  498   2HB   TRP  55           HB1      TRP  55  56.968   0.050  -0.483
  499    HD1  TRP  55           HD1      TRP  55  56.785  -2.490   2.456
  500    HE1  TRP  55           HE1      TRP  55  55.321  -1.449   4.299
  501    HE3  TRP  55           HE3      TRP  55  55.268   1.833   0.149
  502    HZ2  TRP  55           HZ2      TRP  55  53.768   0.830   4.763
  503    HZ3  TRP  55           HZ3      TRP  55  53.757   3.390   1.337
  504    HH2  TRP  55           HH2      TRP  55  53.024   2.915   3.650
  505    H    PHE  56           HN       PHE  56  54.807  -0.168  -2.303
  506    HA   PHE  56           HA       PHE  56  52.387  -0.270  -0.666
  507   1HB   PHE  56           HB2      PHE  56  53.480   1.800  -2.077
  508   2HB   PHE  56           HB1      PHE  56  52.209   1.268  -3.183
  509    HD1  PHE  56           HD2      PHE  56  52.456   1.335   0.543
  510    HD2  PHE  56           HD1      PHE  56  50.295   2.656  -2.913
  511    HE1  PHE  56           HE2      PHE  56  50.771   2.363   2.011
  512    HE2  PHE  56           HE1      PHE  56  48.584   3.685  -1.435
  513    HZ   PHE  56           HZ       PHE  56  48.833   3.523   1.038
  514    H    CYS  57           HN       CYS  57  53.483  -2.262  -3.028
  515    HA   CYS  57           HA       CYS  57  50.947  -2.633  -4.449
  516   1HB   CYS  57           HB2      CYS  57  53.270  -3.270  -5.372
  517   2HB   CYS  57           HB1      CYS  57  53.232  -4.622  -4.240
  518    HG   CYS  57           HG       CYS  57  52.101  -4.979  -6.803
  519    H    ASN  58           HN       ASN  58  52.755  -4.025  -1.768
  520    HA   ASN  58           HA       ASN  58  50.626  -5.963  -1.144
  521   1HB   ASN  58           HB2      ASN  58  53.313  -5.274  -0.002
  522   2HB   ASN  58           HB1      ASN  58  52.146  -6.102   1.030
  523   1HD2  ASN  58          HD22      ASN  58  52.426  -9.194  -0.675
  524   2HD2  ASN  58          HD21      ASN  58  51.611  -8.314   0.526
  525    NH1  ARG  59           NH1      ARG  59  50.934  -3.151   5.807
  526    NH2  ARG  59           NH2      ARG  59  48.754  -2.980   5.231
  527    H    ARG  59           HN       ARG  59  51.749  -2.779  -0.071
  528    HA   ARG  59           HA       ARG  59  50.019  -2.670   2.256
  529   1HB   ARG  59           HB2      ARG  59  52.023  -0.953   1.120
  530   2HB   ARG  59           HB1      ARG  59  50.544  -0.010   1.260
  531   1HG   ARG  59           HG2      ARG  59  51.819  -1.603   3.497
  532   2HG   ARG  59           HG1      ARG  59  51.891   0.143   3.300
  533   1HD   ARG  59           HD2      ARG  59  49.693   0.461   3.911
  534   2HD   ARG  59           HD1      ARG  59  49.186  -1.117   3.312
  535    HE   ARG  59           HE       ARG  59  50.261  -0.552   5.984
  536   1HH1  ARG  59          HH11      ARG  59  51.828  -2.724   5.950
  537   2HH1  ARG  59          HH12      ARG  59  50.820  -4.132   5.958
  538   1HH2  ARG  59          HH21      ARG  59  47.977  -2.423   4.934
  539   2HH2  ARG  59          HH22      ARG  59  48.636  -3.962   5.380
  540    NH1  ARG  60           NH1      ARG  60  47.699   1.118  -7.319
  541    NH2  ARG  60           NH2      ARG  60  46.047   2.327  -6.361
  542    H    ARG  60           HN       ARG  60  49.531  -2.263  -1.162
  543    HA   ARG  60           HA       ARG  60  47.096  -0.659  -0.888
  544   1HB   ARG  60           HB2      ARG  60  48.628  -1.913  -3.121
  545   2HB   ARG  60           HB1      ARG  60  46.904  -1.644  -3.385
  546   1HG   ARG  60           HG2      ARG  60  47.180   0.728  -2.739
  547   2HG   ARG  60           HG1      ARG  60  48.906   0.457  -2.508
  548   1HD   ARG  60           HD2      ARG  60  48.888   1.269  -4.684
  549   2HD   ARG  60           HD1      ARG  60  48.780  -0.466  -4.981
  550    HE   ARG  60           HE       ARG  60  46.162   0.155  -4.903
  551   1HH1  ARG  60          HH11      ARG  60  48.358   0.367  -7.278
  552   2HH1  ARG  60          HH12      ARG  60  47.649   1.696  -8.134
  553   1HH2  ARG  60          HH21      ARG  60  45.440   2.503  -5.586
  554   2HH2  ARG  60          HH22      ARG  60  45.997   2.906  -7.176
  555    H    GLN  61           HN       GLN  61  47.953  -4.061  -1.353
  556    HA   GLN  61           HA       GLN  61  45.078  -4.764  -0.881
  557   1HB   GLN  61           HB2      GLN  61  47.179  -6.277  -2.466
  558   2HB   GLN  61           HB1      GLN  61  45.546  -6.858  -2.142
  559   1HG   GLN  61           HG2      GLN  61  45.919  -4.152  -3.388
  560   2HG   GLN  61           HG1      GLN  61  46.060  -5.592  -4.395
  561   1HE2  GLN  61          HE22      GLN  61  42.494  -4.749  -4.582
  562   2HE2  GLN  61          HE21      GLN  61  43.971  -4.178  -5.195
  563    H    LYS  62           HN       LYS  62  45.958  -4.476   1.431
  564    HA   LYS  62           HA       LYS  62  47.700  -6.598   2.434
  565   1HB   LYS  62           HB2      LYS  62  47.107  -5.644   4.667
  566   2HB   LYS  62           HB1      LYS  62  47.722  -4.431   3.545
  567   1HG   LYS  62           HG2      LYS  62  45.774  -3.284   3.560
  568   2HG   LYS  62           HG1      LYS  62  44.821  -4.749   3.328
  569   1HD   LYS  62           HD2      LYS  62  46.073  -4.277   6.008
  570   2HD   LYS  62           HD1      LYS  62  44.633  -3.353   5.578
  571   1HE   LYS  62           HE2      LYS  62  43.844  -5.820   4.792
  572   2HE   LYS  62           HE1      LYS  62  44.928  -6.259   6.111
  573   1HZ   LYS  62           HZ2      LYS  62  43.725  -4.702   7.540
  574   2HZ   LYS  62           HZ1      LYS  62  42.647  -4.365   6.271
  575   3HZ   LYS  62           HZ3      LYS  62  42.706  -5.922   6.940
  576    H    GLY  63           HN       GLY  63  44.324  -6.296   1.767
  577   1HA   GLY  63           HA2      GLY  63  43.578  -8.403   3.699
  578   2HA   GLY  63           HA1      GLY  63  42.466  -7.505   2.665
  579    H    LYS  64           HN       LYS  64  44.118  -7.945   0.250
  580    HA   LYS  64           HA       LYS  64  43.020 -10.557  -0.466
  581   1HB   LYS  64           HB2      LYS  64  43.565  -8.250  -1.882
  582   2HB   LYS  64           HB1      LYS  64  44.881  -9.313  -2.380
  583   1HG   LYS  64           HG2      LYS  64  43.423 -10.908  -3.289
  584   2HG   LYS  64           HG1      LYS  64  42.057 -10.351  -2.322
  585   1HD   LYS  64           HD2      LYS  64  41.526  -9.456  -4.409
  586   2HD   LYS  64           HD1      LYS  64  42.394  -8.112  -3.668
  587   1HE   LYS  64           HE2      LYS  64  44.512  -9.116  -4.731
  588   2HE   LYS  64           HE1      LYS  64  43.414 -10.093  -5.705
  589   1HZ   LYS  64           HZ2      LYS  64  42.984  -7.191  -5.527
  590   2HZ   LYS  64           HZ1      LYS  64  44.199  -7.785  -6.555
  591   3HZ   LYS  64           HZ3      LYS  64  42.589  -8.265  -6.783
  592    NH1  ARG  65           NH1      ARG  65  51.133 -14.045  -5.071
  593    NH2  ARG  65           NH2      ARG  65  51.052 -12.052  -6.135
  594    H    ARG  65           HN       ARG  65  46.314  -9.267  -0.937
  595    HA   ARG  65           HA       ARG  65  47.329 -11.970  -0.157
  596   1HB   ARG  65           HB2      ARG  65  47.578 -10.969  -2.632
  597   2HB   ARG  65           HB1      ARG  65  48.984 -10.198  -1.896
  598   1HG   ARG  65           HG2      ARG  65  49.426 -12.622  -0.941
  599   2HG   ARG  65           HG1      ARG  65  48.422 -13.115  -2.304
  600   1HD   ARG  65           HD2      ARG  65  50.655 -11.166  -2.768
  601   2HD   ARG  65           HD1      ARG  65  51.029 -12.882  -2.612
  602    HE   ARG  65           HE       ARG  65  48.891 -12.210  -4.528
  603   1HH1  ARG  65          HH11      ARG  65  50.838 -14.640  -4.323
  604   2HH1  ARG  65          HH12      ARG  65  51.785 -14.381  -5.750
  605   1HH2  ARG  65          HH21      ARG  65  50.694 -11.120  -6.202
  606   2HH2  ARG  65          HH22      ARG  65  51.702 -12.388  -6.816
  607    H    SER  66           HN       SER  66  48.351 -11.852   1.769
  608    HA   SER  66           HA       SER  66  50.301  -9.694   2.254
  609   1HB   SER  66           HB2      SER  66  47.756  -9.330   3.219
  610   2HB   SER  66           HB1      SER  66  48.533 -10.135   4.578
  611    HG   SER  66           HG       SER  66  50.145  -8.550   4.518
  612    H    SER  67           HN       SER  67  52.010 -11.085   2.520
  613    HA   SER  67           HA       SER  67  51.985 -12.833   4.888
  614   1HB   SER  67           HB2      SER  67  51.118 -14.193   2.897
  615   2HB   SER  67           HB1      SER  67  52.729 -14.020   2.205
  616    HG   SER  67           HG       SER  67  52.181 -15.040   4.800
   
  Start of MODEL          17
 Raw file had  616 H/Q atoms
  Start of MODEL   17
    1   1H    MET   1           HT2      MET   1  48.004  10.094  19.784
    2   2H    MET   1           HT1      MET   1  47.814   8.672  18.873
    3   3H    MET   1           HT3      MET   1  49.332   9.067  19.520
    4    HA   MET   1           HA       MET   1  49.553  10.943  18.080
    5   1HB   MET   1           HB2      MET   1  50.010   8.541  17.259
    6   2HB   MET   1           HB1      MET   1  48.494   8.691  16.369
    7   1HG   MET   1           HG2      MET   1  49.354  10.724  15.253
    8   2HG   MET   1           HG1      MET   1  50.875  10.556  16.130
    9   1HE   MET   1           HE1      MET   1  49.516  10.604  13.220
   10   2HE   MET   1           HE3      MET   1  50.265   9.425  12.135
   11   3HE   MET   1           HE2      MET   1  48.760   9.034  12.963
   12    H    GLU   2           HN       GLU   2  47.966  12.559  18.348
   13    HA   GLU   2           HA       GLU   2  45.750  12.431  16.368
   14   1HB   GLU   2           HB2      GLU   2  45.151  11.925  18.927
   15   2HB   GLU   2           HB1      GLU   2  45.170  13.687  19.017
   16   1HG   GLU   2           HG2      GLU   2  42.917  13.021  18.478
   17   2HG   GLU   2           HG1      GLU   2  43.624  13.718  17.019
   18    H    THR   3           HN       THR   3  47.478  13.833  15.324
   19    HA   THR   3           HA       THR   3  47.889  16.490  16.480
   20    HB   THR   3           HB       THR   3  49.175  16.879  14.393
   21    HG1  THR   3           HG1      THR   3  49.394  15.043  13.001
   22   1HG2  THR   3          HG22      THR   3  49.946  15.452  16.495
   23   2HG2  THR   3          HG21      THR   3  49.994  14.155  15.301
   24   3HG2  THR   3          HG23      THR   3  50.977  15.601  15.072
   25    H    LEU   4           HN       LEU   4  47.620  18.294  14.578
   26    HA   LEU   4           HA       LEU   4  44.959  17.961  13.292
   27   1HB   LEU   4           HB2      LEU   4  44.336  20.264  14.109
   28   2HB   LEU   4           HB1      LEU   4  44.429  19.051  15.385
   29    HG   LEU   4           HG       LEU   4  47.042  20.229  15.007
   30   1HD1  LEU   4          HD11      LEU   4  45.691  22.153  14.121
   31   2HD1  LEU   4          HD13      LEU   4  44.854  22.218  15.672
   32   3HD1  LEU   4          HD12      LEU   4  46.587  22.536  15.591
   33   1HD2  LEU   4          HD23      LEU   4  45.971  19.088  17.043
   34   2HD2  LEU   4          HD22      LEU   4  46.913  20.543  17.365
   35   3HD2  LEU   4          HD21      LEU   4  45.151  20.622  17.335
   36    H    VAL   5           HN       VAL   5  46.885  17.756  11.633
   37    HA   VAL   5           HA       VAL   5  46.989  20.307  10.185
   38    HB   VAL   5           HB       VAL   5  48.930  20.515  11.673
   39   1HG1  VAL   5          HG12      VAL   5  49.084  17.846  11.678
   40   2HG1  VAL   5          HG11      VAL   5  50.286  18.169  10.427
   41   3HG1  VAL   5          HG13      VAL   5  50.483  18.859  12.039
   42   1HG2  VAL   5          HG23      VAL   5  49.124  20.358   8.758
   43   2HG2  VAL   5          HG22      VAL   5  49.788  21.562   9.861
   44   3HG2  VAL   5          HG21      VAL   5  50.681  20.077   9.538
   45    H    GLN   6           HN       GLN   6  45.722  18.972   8.734
   46    HA   GLN   6           HA       GLN   6  47.293  16.872   7.297
   47   1HB   GLN   6           HB2      GLN   6  45.037  16.161   6.411
   48   2HB   GLN   6           HB1      GLN   6  45.226  15.967   8.152
   49   1HG   GLN   6           HG2      GLN   6  43.544  17.411   8.581
   50   2HG   GLN   6           HG1      GLN   6  44.228  18.627   7.504
   51   1HE2  GLN   6          HE22      GLN   6  41.942  17.965   4.921
   52   2HE2  GLN   6          HE21      GLN   6  43.169  18.964   5.535
   53    H    ALA   7           HN       ALA   7  48.368  18.057   5.729
   54    HA   ALA   7           HA       ALA   7  47.313  20.319   4.355
   55   1HB   ALA   7           HB3      ALA   7  49.753  19.075   4.457
   56   2HB   ALA   7           HB2      ALA   7  49.211  18.645   2.835
   57   3HB   ALA   7           HB1      ALA   7  49.332  20.340   3.304
   58    NH1  ARG   8           NH1      ARG   8  46.200  24.354   0.473
   59    NH2  ARG   8           NH2      ARG   8  46.980  23.846  -1.588
   60    H    ARG   8           HN       ARG   8  47.685  19.632   1.606
   61    HA   ARG   8           HA       ARG   8  45.613  17.588   1.092
   62   1HB   ARG   8           HB2      ARG   8  44.594  19.175  -0.608
   63   2HB   ARG   8           HB1      ARG   8  44.344  19.628   1.078
   64   1HG   ARG   8           HG2      ARG   8  45.664  21.483   0.913
   65   2HG   ARG   8           HG1      ARG   8  46.822  20.687  -0.152
   66   1HD   ARG   8           HD2      ARG   8  45.768  21.404  -2.034
   67   2HD   ARG   8           HD1      ARG   8  44.164  21.122  -1.358
   68    HE   ARG   8           HE       ARG   8  44.110  23.417  -0.873
   69   1HH1  ARG   8          HH11      ARG   8  45.496  24.269   1.177
   70   2HH1  ARG   8          HH12      ARG   8  47.012  24.913   0.643
   71   1HH2  ARG   8          HH21      ARG   8  46.873  23.371  -2.462
   72   2HH2  ARG   8          HH22      ARG   8  47.793  24.403  -1.419
   73    H    LYS   9           HN       LYS   9  48.607  17.854   0.667
   74    HA   LYS   9           HA       LYS   9  48.584  16.982  -2.141
   75   1HB   LYS   9           HB2      LYS   9  50.101  19.357  -1.089
   76   2HB   LYS   9           HB1      LYS   9  50.732  18.428  -2.449
   77   1HG   LYS   9           HG2      LYS   9  47.937  19.594  -2.360
   78   2HG   LYS   9           HG1      LYS   9  49.308  20.392  -3.127
   79   1HD   LYS   9           HD2      LYS   9  49.596  18.126  -4.398
   80   2HD   LYS   9           HD1      LYS   9  47.918  17.849  -3.929
   81   1HE   LYS   9           HE2      LYS   9  48.620  20.498  -5.124
   82   2HE   LYS   9           HE1      LYS   9  48.520  19.105  -6.201
   83   1HZ   LYS   9           HZ1      LYS   9  46.371  19.574  -4.252
   84   2HZ   LYS   9           HZ3      LYS   9  46.411  20.501  -5.672
   85   3HZ   LYS   9           HZ2      LYS   9  46.305  18.808  -5.767
   86    NH1  ARG  10           NH2      ARG  10  53.332  19.696   1.785
   87    NH2  ARG  10           NH1      ARG  10  54.786  19.378   3.488
   88    H    ARG  10           HN       ARG  10  49.127  15.879   0.674
   89    HA   ARG  10           HA       ARG  10  51.427  14.277  -0.088
   90   1HB   ARG  10           HB2      ARG  10  52.699  14.860   2.033
   91   2HB   ARG  10           HB1      ARG  10  52.686  16.118   0.798
   92   1HG   ARG  10           HG2      ARG  10  50.977  17.351   1.952
   93   2HG   ARG  10           HG1      ARG  10  50.693  16.021   3.075
   94   1HD   ARG  10           HD2      ARG  10  52.094  17.895   4.022
   95   2HD   ARG  10           HD1      ARG  10  52.867  16.311   4.082
   96    HE   ARG  10           HE       ARG  10  54.202  17.010   2.091
   97   1HH1  ARG  10          HH21      ARG  10  52.672  19.329   1.131
   98   2HH1  ARG  10          HH22      ARG  10  53.539  20.675   1.790
   99   1HH2  ARG  10          HH11      ARG  10  55.238  18.767   4.137
  100   2HH2  ARG  10          HH12      ARG  10  54.994  20.356   3.493
  101    H    LYS  11           HN       LYS  11  48.711  13.670   0.500
  102    HA   LYS  11           HA       LYS  11  48.537  12.650   3.220
  103   1HB   LYS  11           HB2      LYS  11  46.795  12.392   0.767
  104   2HB   LYS  11           HB1      LYS  11  46.438  11.520   2.258
  105   1HG   LYS  11           HG2      LYS  11  46.830  13.979   3.286
  106   2HG   LYS  11           HG1      LYS  11  46.263  14.433   1.679
  107   1HD   LYS  11           HD2      LYS  11  44.756  12.309   3.149
  108   2HD   LYS  11           HD1      LYS  11  44.546  13.983   3.664
  109   1HE   LYS  11           HE2      LYS  11  43.600  14.631   1.641
  110   2HE   LYS  11           HE1      LYS  11  44.388  13.336   0.739
  111   1HZ   LYS  11           HZ1      LYS  11  42.911  11.860   2.298
  112   2HZ   LYS  11           HZ3      LYS  11  41.954  13.259   2.370
  113   3HZ   LYS  11           HZ2      LYS  11  42.277  12.527   0.870
  114    NH1  ARG  12           NH2      ARG  12  56.396  13.117   2.675
  115    NH2  ARG  12           NH1      ARG  12  56.295  12.413   0.529
  116    H    ARG  12           HN       ARG  12  50.422  11.265   3.273
  117    HA   ARG  12           HA       ARG  12  50.018   8.699   1.791
  118   1HB   ARG  12           HB2      ARG  12  52.539   8.494   1.804
  119   2HB   ARG  12           HB1      ARG  12  51.917   9.792   0.784
  120   1HG   ARG  12           HG2      ARG  12  52.313  11.402   2.648
  121   2HG   ARG  12           HG1      ARG  12  53.030  10.094   3.590
  122   1HD   ARG  12           HD2      ARG  12  54.975  10.170   2.424
  123   2HD   ARG  12           HD1      ARG  12  54.146  10.339   0.877
  124    HE   ARG  12           HE       ARG  12  53.791  12.811   2.027
  125   1HH1  ARG  12          HH21      ARG  12  55.964  13.232   3.570
  126   2HH1  ARG  12          HH22      ARG  12  57.336  13.426   2.530
  127   1HH2  ARG  12          HH11      ARG  12  55.787  11.988  -0.219
  128   2HH2  ARG  12          HH12      ARG  12  57.235  12.722   0.383
  129    H    THR  13           HN       THR  13  48.808   8.617   4.079
  130    HA   THR  13           HA       THR  13  50.663   7.838   6.255
  131    HB   THR  13           HB       THR  13  47.634   7.800   6.298
  132    HG1  THR  13           HG1      THR  13  49.446   9.890   6.924
  133   1HG2  THR  13          HG21      THR  13  49.214   6.687   8.084
  134   2HG2  THR  13          HG23      THR  13  49.455   8.350   8.617
  135   3HG2  THR  13          HG22      THR  13  47.836   7.652   8.612
  136    H    SER  14           HN       SER  14  48.404   6.438   3.961
  137    HA   SER  14           HA       SER  14  48.941   3.727   5.095
  138   1HB   SER  14           HB2      SER  14  46.937   2.998   3.952
  139   2HB   SER  14           HB1      SER  14  46.543   4.471   4.834
  140    HG   SER  14           HG       SER  14  46.562   3.977   2.150
  141    H    ILE  15           HN       ILE  15  48.507   2.149   2.895
  142    HA   ILE  15           HA       ILE  15  50.925   2.639   1.317
  143    HB   ILE  15           HB       ILE  15  48.852   0.433   1.294
  144   1HG1  ILE  15          HG12      ILE  15  50.457   0.512   3.195
  145   2HG1  ILE  15          HG11      ILE  15  50.696  -0.914   2.187
  146   1HG2  ILE  15          HG21      ILE  15  50.776   1.158  -0.779
  147   2HG2  ILE  15          HG23      ILE  15  51.096  -0.453  -0.141
  148   3HG2  ILE  15          HG22      ILE  15  49.512  -0.071  -0.815
  149   1HD1  ILE  15          HD11      ILE  15  52.495   0.410   0.951
  150   2HD1  ILE  15          HD13      ILE  15  52.356   1.620   2.225
  151   3HD1  ILE  15          HD12      ILE  15  52.880  -0.017   2.613
  152    H    GLU  16           HN       GLU  16  50.407   4.546   0.143
  153    HA   GLU  16           HA       GLU  16  48.070   4.676  -1.569
  154   1HB   GLU  16           HB2      GLU  16  49.658   6.616  -0.652
  155   2HB   GLU  16           HB1      GLU  16  50.538   6.275  -2.143
  156   1HG   GLU  16           HG2      GLU  16  48.615   6.739  -3.493
  157   2HG   GLU  16           HG1      GLU  16  47.553   6.771  -2.085
  158    H    ASN  17           HN       ASN  17  48.128   4.335  -3.879
  159    HA   ASN  17           HA       ASN  17  49.675   2.112  -4.730
  160   1HB   ASN  17           HB2      ASN  17  47.505   3.123  -5.768
  161   2HB   ASN  17           HB1      ASN  17  48.610   4.144  -6.687
  162   1HD2  ASN  17          HD22      ASN  17  47.998   1.025  -8.669
  163   2HD2  ASN  17          HD21      ASN  17  47.013   2.272  -8.072
  164    NH1  ARG  18           NH1      ARG  18  50.217  10.149  -7.880
  165    NH2  ARG  18           NH2      ARG  18  48.277   9.286  -7.104
  166    H    ARG  18           HN       ARG  18  50.470   5.486  -4.615
  167    HA   ARG  18           HA       ARG  18  52.717   5.208  -6.490
  168   1HB   ARG  18           HB2      ARG  18  51.490   7.427  -4.905
  169   2HB   ARG  18           HB1      ARG  18  53.193   7.581  -5.339
  170   1HG   ARG  18           HG2      ARG  18  51.861   8.596  -7.096
  171   2HG   ARG  18           HG1      ARG  18  52.569   7.106  -7.722
  172   1HD   ARG  18           HD2      ARG  18  50.546   6.041  -7.854
  173   2HD   ARG  18           HD1      ARG  18  49.911   6.845  -6.419
  174    HE   ARG  18           HE       ARG  18  49.519   7.727  -9.127
  175   1HH1  ARG  18          HH11      ARG  18  51.086  10.031  -8.359
  176   2HH1  ARG  18          HH12      ARG  18  49.964  11.045  -7.516
  177   1HH2  ARG  18          HH21      ARG  18  47.661   8.507  -6.989
  178   2HH2  ARG  18          HH22      ARG  18  48.024  10.182  -6.740
  179    H    VAL  19           HN       VAL  19  52.120   5.163  -3.019
  180    HA   VAL  19           HA       VAL  19  54.862   5.416  -2.228
  181    HB   VAL  19           HB       VAL  19  52.536   5.401  -0.813
  182   1HG1  VAL  19          HG13      VAL  19  53.803   2.696  -0.255
  183   2HG1  VAL  19          HG12      VAL  19  52.569   3.466   0.731
  184   3HG1  VAL  19          HG11      VAL  19  52.190   2.969  -0.917
  185   1HG2  VAL  19          HG21      VAL  19  55.414   5.000  -0.093
  186   2HG2  VAL  19          HG23      VAL  19  54.376   6.398   0.190
  187   3HG2  VAL  19          HG22      VAL  19  54.210   4.957   1.194
  188    NH1  ARG  20           NH1      ARG  20  50.869  -4.675  -2.628
  189    NH2  ARG  20           NH2      ARG  20  49.714  -3.519  -4.189
  190    H    ARG  20           HN       ARG  20  52.823   2.586  -2.890
  191    HA   ARG  20           HA       ARG  20  54.800   0.630  -2.250
  192   1HB   ARG  20           HB2      ARG  20  52.222   0.699  -3.675
  193   2HB   ARG  20           HB1      ARG  20  53.321  -0.548  -4.256
  194   1HG   ARG  20           HG2      ARG  20  53.532  -1.504  -2.055
  195   2HG   ARG  20           HG1      ARG  20  52.665  -0.150  -1.328
  196   1HD   ARG  20           HD2      ARG  20  51.021  -1.843  -1.497
  197   2HD   ARG  20           HD1      ARG  20  50.713  -0.817  -2.897
  198    HE   ARG  20           HE       ARG  20  52.437  -2.723  -3.888
  199   1HH1  ARG  20          HH11      ARG  20  51.651  -4.753  -2.010
  200   2HH1  ARG  20          HH12      ARG  20  50.186  -5.405  -2.664
  201   1HH2  ARG  20          HH21      ARG  20  49.610  -2.711  -4.769
  202   2HH2  ARG  20          HH22      ARG  20  49.032  -4.250  -4.223
  203    CH2  TRP  21           CH2      TRP  21  54.325  -3.510  -7.310
  204    H    TRP  21           HN       TRP  21  53.993   2.034  -5.463
  205    HA   TRP  21           HA       TRP  21  56.291   0.636  -6.555
  206   1HB   TRP  21           HB2      TRP  21  54.101   2.221  -7.694
  207   2HB   TRP  21           HB1      TRP  21  55.653   2.535  -8.485
  208    HD1  TRP  21           HD1      TRP  21  55.480   1.009 -10.625
  209    HE1  TRP  21           HE1      TRP  21  55.259  -1.547 -10.975
  210    HE3  TRP  21           HE3      TRP  21  54.354  -0.456  -5.893
  211    HZ2  TRP  21           HZ2      TRP  21  54.696  -3.907  -9.386
  212    HZ3  TRP  21           HZ3      TRP  21  54.006  -2.789  -5.295
  213    HH2  TRP  21           HH2      TRP  21  54.180  -4.548  -7.054
  214    H    SER  22           HN       SER  22  56.052   3.348  -4.630
  215    HA   SER  22           HA       SER  22  58.350   4.786  -5.702
  216   1HB   SER  22           HB2      SER  22  56.683   5.974  -4.290
  217   2HB   SER  22           HB1      SER  22  57.032   4.875  -2.961
  218    HG   SER  22           HG       SER  22  58.938   5.815  -2.664
  219    H    LEU  23           HN       LEU  23  57.563   2.328  -3.288
  220    HA   LEU  23           HA       LEU  23  60.099   1.935  -2.061
  221   1HB   LEU  23           HB2      LEU  23  57.956  -0.086  -2.819
  222   2HB   LEU  23           HB1      LEU  23  59.323  -0.459  -1.798
  223    HG   LEU  23           HG       LEU  23  57.627   1.862  -1.011
  224   1HD1  LEU  23          HD13      LEU  23  56.355  -0.484  -1.684
  225   2HD1  LEU  23          HD12      LEU  23  56.726  -0.769   0.016
  226   3HD1  LEU  23          HD11      LEU  23  55.774   0.638  -0.455
  227   1HD2  LEU  23          HD22      LEU  23  59.469  -0.143   0.199
  228   2HD2  LEU  23          HD21      LEU  23  59.253   1.563   0.593
  229   3HD2  LEU  23          HD23      LEU  23  58.114   0.365   1.205
  230    H    GLU  24           HN       GLU  24  58.609   0.553  -4.949
  231    HA   GLU  24           HA       GLU  24  60.646  -1.191  -5.804
  232   1HB   GLU  24           HB2      GLU  24  58.267  -0.490  -6.825
  233   2HB   GLU  24           HB1      GLU  24  59.304   0.447  -7.902
  234   1HG   GLU  24           HG2      GLU  24  60.667  -1.833  -8.011
  235   2HG   GLU  24           HG1      GLU  24  59.105  -2.523  -7.573
  236    H    THR  25           HN       THR  25  60.373   2.304  -6.547
  237    HA   THR  25           HA       THR  25  62.693   2.379  -8.229
  238    HB   THR  25           HB       THR  25  61.643   4.671  -6.555
  239    HG1  THR  25           HG1      THR  25  60.789   3.813  -9.117
  240   1HG2  THR  25          HG22      THR  25  63.343   4.360  -9.005
  241   2HG2  THR  25          HG21      THR  25  62.342   5.802  -8.832
  242   3HG2  THR  25          HG23      THR  25  63.567   5.428  -7.619
  243    H    MET  26           HN       MET  26  62.270   2.635  -4.746
  244    HA   MET  26           HA       MET  26  64.982   3.571  -4.249
  245   1HB   MET  26           HB2      MET  26  62.610   2.843  -2.659
  246   2HB   MET  26           HB1      MET  26  64.142   2.476  -1.868
  247   1HG   MET  26           HG2      MET  26  64.852   4.724  -1.931
  248   2HG   MET  26           HG1      MET  26  63.674   5.155  -3.171
  249   1HE   MET  26           HE3      MET  26  64.241   3.506  -0.036
  250   2HE   MET  26           HE2      MET  26  63.615   4.633   1.165
  251   3HE   MET  26           HE1      MET  26  62.619   3.280   0.633
  252    H    PHE  27           HN       PHE  27  63.482   0.402  -4.510
  253    HA   PHE  27           HA       PHE  27  65.867  -0.934  -3.410
  254   1HB   PHE  27           HB2      PHE  27  63.144  -1.879  -4.309
  255   2HB   PHE  27           HB1      PHE  27  64.458  -3.018  -4.062
  256    HD1  PHE  27           HD1      PHE  27  65.693  -2.980  -1.798
  257    HD2  PHE  27           HD2      PHE  27  61.928  -1.031  -2.471
  258    HE1  PHE  27           HE1      PHE  27  65.297  -2.897   0.648
  259    HE2  PHE  27           HE2      PHE  27  61.530  -0.946  -0.027
  260    HZ   PHE  27           HZ       PHE  27  63.214  -1.880   1.533
  261    H    LEU  28           HN       LEU  28  64.653   0.001  -6.503
  262    HA   LEU  28           HA       LEU  28  66.208  -2.057  -7.927
  263   1HB   LEU  28           HB2      LEU  28  64.457   0.204  -8.918
  264   2HB   LEU  28           HB1      LEU  28  65.260  -0.969  -9.964
  265    HG   LEU  28           HG       LEU  28  63.397  -1.771  -7.718
  266   1HD1  LEU  28          HD12      LEU  28  62.858  -1.012 -10.572
  267   2HD1  LEU  28          HD11      LEU  28  61.891  -2.279  -9.817
  268   3HD1  LEU  28          HD13      LEU  28  61.913  -0.657  -9.126
  269   1HD2  LEU  28          HD22      LEU  28  64.511  -3.216 -10.143
  270   2HD2  LEU  28          HD21      LEU  28  64.955  -3.507  -8.461
  271   3HD2  LEU  28          HD23      LEU  28  63.329  -3.895  -9.024
  272    H    LYS  29           HN       LYS  29  67.093   0.786  -6.480
  273    HA   LYS  29           HA       LYS  29  68.913   1.598  -8.690
  274   1HB   LYS  29           HB2      LYS  29  69.339   3.617  -7.391
  275   2HB   LYS  29           HB1      LYS  29  67.600   3.380  -7.522
  276   1HG   LYS  29           HG2      LYS  29  67.740   2.194  -5.249
  277   2HG   LYS  29           HG1      LYS  29  69.373   2.848  -5.128
  278   1HD   LYS  29           HD2      LYS  29  68.012   5.086  -5.852
  279   2HD   LYS  29           HD1      LYS  29  66.760   4.238  -4.945
  280   1HE   LYS  29           HE2      LYS  29  67.955   4.312  -2.957
  281   2HE   LYS  29           HE1      LYS  29  69.514   4.404  -3.777
  282   1HZ   LYS  29           HZ2      LYS  29  67.529   6.589  -3.942
  283   2HZ   LYS  29           HZ1      LYS  29  68.666   6.505  -2.682
  284   3HZ   LYS  29           HZ3      LYS  29  69.192   6.644  -4.289
  285    H    CYS  30           HN       CYS  30  68.864   0.345  -5.415
  286    HA   CYS  30           HA       CYS  30  71.688  -0.490  -5.741
  287   1HB   CYS  30           HB2      CYS  30  70.521   1.001  -3.377
  288   2HB   CYS  30           HB1      CYS  30  72.045   0.116  -3.299
  289    HG   CYS  30           HG       CYS  30  72.182   1.977  -5.637
  290    HA   PRO  31           HA       PRO  31  69.467  -4.073  -4.074
  291   1HB   PRO  31           HB2      PRO  31  71.371  -5.934  -4.696
  292   2HB   PRO  31           HB1      PRO  31  70.266  -5.262  -5.908
  293   1HG   PRO  31           HG2      PRO  31  73.163  -4.734  -5.519
  294   2HG   PRO  31           HG1      PRO  31  72.176  -4.543  -6.977
  295   1HD   PRO  31           HD2      PRO  31  73.019  -2.478  -5.172
  296   2HD   PRO  31           HD1      PRO  31  71.923  -2.305  -6.560
  297    H    LYS  32           HN       LYS  32  71.110  -2.357  -2.283
  298    HA   LYS  32           HA       LYS  32  72.371  -4.486  -0.642
  299   1HB   LYS  32           HB2      LYS  32  73.886  -2.632   0.206
  300   2HB   LYS  32           HB1      LYS  32  74.129  -3.105  -1.474
  301   1HG   LYS  32           HG2      LYS  32  73.375  -1.106  -2.285
  302   2HG   LYS  32           HG1      LYS  32  72.130  -0.959  -1.045
  303   1HD   LYS  32           HD2      LYS  32  74.107  -0.544   0.587
  304   2HD   LYS  32           HD1      LYS  32  75.051  -0.235  -0.872
  305   1HE   LYS  32           HE2      LYS  32  74.058   1.847   0.082
  306   2HE   LYS  32           HE1      LYS  32  73.498   1.515  -1.557
  307   1HZ   LYS  32           HZ3      LYS  32  71.969   0.472   0.724
  308   2HZ   LYS  32           HZ2      LYS  32  71.808   2.109   0.303
  309   3HZ   LYS  32           HZ1      LYS  32  71.432   0.897  -0.827
  310    HA   PRO  33           HA       PRO  33  69.310  -1.911   1.924
  311   1HB   PRO  33           HB2      PRO  33  67.115  -3.552   1.978
  312   2HB   PRO  33           HB1      PRO  33  67.322  -2.245   0.798
  313   1HG   PRO  33           HG2      PRO  33  67.593  -5.186   0.409
  314   2HG   PRO  33           HG1      PRO  33  67.149  -3.934  -0.761
  315   1HD   PRO  33           HD2      PRO  33  69.692  -5.151  -0.548
  316   2HD   PRO  33           HD1      PRO  33  69.304  -3.665  -1.440
  317    H    SER  34           HN       SER  34  69.465  -2.307   4.114
  318    HA   SER  34           HA       SER  34  70.399  -4.948   5.013
  319   1HB   SER  34           HB2      SER  34  69.921  -2.704   6.906
  320   2HB   SER  34           HB1      SER  34  71.237  -3.873   6.870
  321    HG   SER  34           HG       SER  34  72.132  -2.024   6.142
  322    H    LEU  35           HN       LEU  35  69.281  -6.187   6.616
  323    HA   LEU  35           HA       LEU  35  66.420  -6.168   6.442
  324   1HB   LEU  35           HB2      LEU  35  68.217  -7.338   8.597
  325   2HB   LEU  35           HB1      LEU  35  66.501  -7.700   8.405
  326    HG   LEU  35           HG       LEU  35  67.601  -8.077   5.848
  327   1HD1  LEU  35          HD11      LEU  35  69.773  -8.135   7.445
  328   2HD1  LEU  35          HD13      LEU  35  69.247  -9.809   7.625
  329   3HD1  LEU  35          HD12      LEU  35  69.615  -9.168   6.024
  330   1HD2  LEU  35          HD22      LEU  35  65.817  -9.376   7.198
  331   2HD2  LEU  35          HD21      LEU  35  66.854 -10.315   6.123
  332   3HD2  LEU  35          HD23      LEU  35  67.171 -10.294   7.858
  333    H    GLN  36           HN       GLN  36  68.699  -4.379   8.347
  334    HA   GLN  36           HA       GLN  36  66.803  -3.516  10.403
  335   1HB   GLN  36           HB2      GLN  36  69.500  -3.443  10.294
  336   2HB   GLN  36           HB1      GLN  36  69.156  -1.819   9.698
  337   1HG   GLN  36           HG2      GLN  36  67.962  -2.955  12.241
  338   2HG   GLN  36           HG1      GLN  36  69.420  -1.961  12.205
  339   1HE2  GLN  36          HE22      GLN  36  66.175   0.089  12.583
  340   2HE2  GLN  36          HE21      GLN  36  66.615  -1.379  13.314
  341    H    GLN  37           HN       GLN  37  68.017  -2.328   7.312
  342    HA   GLN  37           HA       GLN  37  66.541   0.165   7.392
  343   1HB   GLN  37           HB2      GLN  37  68.622  -0.434   5.953
  344   2HB   GLN  37           HB1      GLN  37  67.458  -1.168   4.850
  345   1HG   GLN  37           HG2      GLN  37  66.661   0.846   4.153
  346   2HG   GLN  37           HG1      GLN  37  66.686   1.525   5.779
  347   1HE2  GLN  37          HE22      GLN  37  69.952   2.000   3.350
  348   2HE2  GLN  37          HE21      GLN  37  68.737   0.895   2.922
  349    H    ILE  38           HN       ILE  38  65.650  -3.118   6.715
  350    HA   ILE  38           HA       ILE  38  63.390  -2.395   5.004
  351    HB   ILE  38           HB       ILE  38  64.260  -4.991   6.306
  352   1HG1  ILE  38          HG12      ILE  38  65.458  -4.245   4.282
  353   2HG1  ILE  38          HG11      ILE  38  64.499  -5.684   3.943
  354   1HG2  ILE  38          HG22      ILE  38  61.560  -4.276   5.558
  355   2HG2  ILE  38          HG21      ILE  38  62.160  -5.485   4.427
  356   3HG2  ILE  38          HG23      ILE  38  62.160  -5.821   6.157
  357   1HD1  ILE  38          HD11      ILE  38  62.716  -3.623   3.414
  358   2HD1  ILE  38          HD13      ILE  38  64.250  -2.975   2.835
  359   3HD1  ILE  38          HD12      ILE  38  63.642  -4.503   2.200
  360    H    THR  39           HN       THR  39  64.038  -3.100   8.382
  361    HA   THR  39           HA       THR  39  61.290  -2.943   9.290
  362    HB   THR  39           HB       THR  39  63.771  -2.151  10.852
  363    HG1  THR  39           HG1      THR  39  62.609  -4.711  10.481
  364   1HG2  THR  39          HG22      THR  39  61.046  -3.209  11.643
  365   2HG2  THR  39          HG21      THR  39  62.393  -3.007  12.761
  366   3HG2  THR  39          HG23      THR  39  61.687  -1.600  11.967
  367    H    HIS  40           HN       HIS  40  63.889  -0.656   8.678
  368    HA   HIS  40           HA       HIS  40  62.482   1.698   9.623
  369   1HB   HIS  40           HB2      HIS  40  65.092   1.176   8.971
  370   2HB   HIS  40           HB1      HIS  40  64.552   2.040   7.532
  371    HD1  HIS  40           HD1      HIS  40  65.802   4.232   8.085
  372    HD2  HIS  40           HD2      HIS  40  63.174   3.028  11.090
  373    HE1  HIS  40           HE1      HIS  40  65.613   6.179   9.693
  374    H    ILE  41           HN       ILE  41  62.507  -0.188   6.690
  375    HA   ILE  41           HA       ILE  41  61.470   1.802   4.897
  376    HB   ILE  41           HB       ILE  41  62.001  -1.062   4.853
  377   1HG1  ILE  41          HG12      ILE  41  61.740  -0.328   2.246
  378   2HG1  ILE  41          HG11      ILE  41  61.942   1.253   2.997
  379   1HG2  ILE  41          HG22      ILE  41  59.518  -1.292   4.818
  380   2HG2  ILE  41          HG21      ILE  41  59.457  -0.207   3.432
  381   3HG2  ILE  41          HG23      ILE  41  60.240  -1.776   3.287
  382   1HD1  ILE  41          HD13      ILE  41  63.800  -1.007   3.704
  383   2HD1  ILE  41          HD12      ILE  41  64.068  -0.061   2.244
  384   3HD1  ILE  41          HD11      ILE  41  64.080   0.728   3.822
  385    H    ALA  42           HN       ALA  42  60.052  -0.575   7.082
  386    HA   ALA  42           HA       ALA  42  57.321  -0.141   6.482
  387   1HB   ALA  42           HB1      ALA  42  58.291  -2.013   7.874
  388   2HB   ALA  42           HB3      ALA  42  58.461  -0.852   9.190
  389   3HB   ALA  42           HB2      ALA  42  56.862  -1.253   8.569
  390    H    ASN  43           HN       ASN  43  59.288   1.230   9.117
  391    HA   ASN  43           HA       ASN  43  57.312   3.136   9.952
  392   1HB   ASN  43           HB2      ASN  43  59.907   2.378  10.748
  393   2HB   ASN  43           HB1      ASN  43  60.036   4.084  10.328
  394   1HD2  ASN  43          HD22      ASN  43  57.971   5.181  13.022
  395   2HD2  ASN  43          HD21      ASN  43  58.624   5.614  11.516
  396    H    GLN  44           HN       GLN  44  59.385   2.972   7.209
  397    HA   GLN  44           HA       GLN  44  59.618   5.793   6.672
  398   1HB   GLN  44           HB2      GLN  44  60.580   3.333   5.585
  399   2HB   GLN  44           HB1      GLN  44  59.859   4.253   4.278
  400   1HG   GLN  44           HG2      GLN  44  62.213   4.844   4.455
  401   2HG   GLN  44           HG1      GLN  44  61.243   6.224   4.967
  402   1HE2  GLN  44          HE22      GLN  44  62.376   6.097   8.340
  403   2HE2  GLN  44          HE21      GLN  44  61.230   6.761   7.280
  404    H    LEU  45           HN       LEU  45  57.351   3.235   5.603
  405    HA   LEU  45           HA       LEU  45  55.858   5.379   4.196
  406   1HB   LEU  45           HB2      LEU  45  54.506   3.232   3.325
  407   2HB   LEU  45           HB1      LEU  45  55.895   3.897   2.501
  408    HG   LEU  45           HG       LEU  45  56.276   1.724   4.565
  409   1HD1  LEU  45          HD12      LEU  45  54.984   1.524   1.911
  410   2HD1  LEU  45          HD11      LEU  45  56.360   0.443   2.106
  411   3HD1  LEU  45          HD13      LEU  45  55.007   0.356   3.223
  412   1HD2  LEU  45          HD22      LEU  45  58.179   3.060   3.543
  413   2HD2  LEU  45          HD21      LEU  45  58.273   1.315   3.341
  414   3HD2  LEU  45          HD23      LEU  45  57.743   2.324   2.001
  415    H    GLY  46           HN       GLY  46  55.817   4.064   7.168
  416   1HA   GLY  46           HA2      GLY  46  54.195   4.564   8.825
  417   2HA   GLY  46           HA1      GLY  46  53.045   4.950   7.553
  418    H    LEU  47           HN       LEU  47  54.575   1.897   7.125
  419    HA   LEU  47           HA       LEU  47  52.219   0.576   8.423
  420   1HB   LEU  47           HB2      LEU  47  52.411  -1.185   6.532
  421   2HB   LEU  47           HB1      LEU  47  51.662   0.347   6.158
  422    HG   LEU  47           HG       LEU  47  53.263  -0.532   4.459
  423   1HD1  LEU  47          HD13      LEU  47  52.760   2.043   5.275
  424   2HD1  LEU  47          HD12      LEU  47  54.510   1.989   5.198
  425   3HD1  LEU  47          HD11      LEU  47  53.560   1.587   3.784
  426   1HD2  LEU  47          HD21      LEU  47  54.944  -1.227   6.312
  427   2HD2  LEU  47          HD23      LEU  47  55.568  -0.611   4.793
  428   3HD2  LEU  47          HD22      LEU  47  55.490   0.437   6.204
  429    H    GLU  48           HN       GLU  48  52.963  -2.081   7.924
  430    HA   GLU  48           HA       GLU  48  55.160  -2.373   9.873
  431   1HB   GLU  48           HB2      GLU  48  52.893  -3.588  10.017
  432   2HB   GLU  48           HB1      GLU  48  53.484  -4.585   8.687
  433   1HG   GLU  48           HG2      GLU  48  54.983  -5.686   9.999
  434   2HG   GLU  48           HG1      GLU  48  55.387  -4.241  10.926
  435    H    LYS  49           HN       LYS  49  56.826  -4.027   9.447
  436    HA   LYS  49           HA       LYS  49  57.938  -3.770   6.781
  437   1HB   LYS  49           HB2      LYS  49  59.360  -3.964   8.785
  438   2HB   LYS  49           HB1      LYS  49  58.741  -5.590   9.067
  439   1HG   LYS  49           HG2      LYS  49  59.798  -5.129   6.346
  440   2HG   LYS  49           HG1      LYS  49  61.004  -5.035   7.630
  441   1HD   LYS  49           HD2      LYS  49  59.037  -7.323   7.403
  442   2HD   LYS  49           HD1      LYS  49  60.632  -7.357   6.650
  443   1HE   LYS  49           HE2      LYS  49  61.601  -6.829   8.941
  444   2HE   LYS  49           HE1      LYS  49  59.994  -7.124   9.601
  445   1HZ   LYS  49           HZ1      LYS  49  60.778  -9.236   7.861
  446   2HZ   LYS  49           HZ3      LYS  49  61.941  -8.999   9.071
  447   3HZ   LYS  49           HZ2      LYS  49  60.326  -9.299   9.496
  448    H    ASP  50           HN       ASP  50  55.555  -5.840   8.091
  449    HA   ASP  50           HA       ASP  50  56.194  -8.211   6.535
  450   1HB   ASP  50           HB2      ASP  50  54.637  -7.811   8.700
  451   2HB   ASP  50           HB1      ASP  50  53.403  -7.736   7.442
  452    H    VAL  51           HN       VAL  51  54.176  -5.334   6.047
  453    HA   VAL  51           HA       VAL  51  52.855  -6.410   3.685
  454    HB   VAL  51           HB       VAL  51  51.944  -4.494   5.094
  455   1HG1  VAL  51          HG11      VAL  51  54.238  -3.272   5.095
  456   2HG1  VAL  51          HG13      VAL  51  53.785  -2.697   3.498
  457   3HG1  VAL  51          HG12      VAL  51  52.796  -2.301   4.903
  458   1HG2  VAL  51          HG23      VAL  51  52.271  -4.328   2.107
  459   2HG2  VAL  51          HG22      VAL  51  50.860  -4.831   3.037
  460   3HG2  VAL  51          HG21      VAL  51  51.316  -3.129   2.979
  461    H    VAL  52           HN       VAL  52  55.603  -4.331   4.345
  462    HA   VAL  52           HA       VAL  52  56.284  -3.856   1.601
  463    HB   VAL  52           HB       VAL  52  57.081  -2.855   4.043
  464   1HG1  VAL  52          HG13      VAL  52  58.659  -4.895   4.191
  465   2HG1  VAL  52          HG12      VAL  52  59.611  -4.062   2.963
  466   3HG1  VAL  52          HG11      VAL  52  59.323  -3.296   4.525
  467   1HG2  VAL  52          HG22      VAL  52  57.300  -2.182   1.389
  468   2HG2  VAL  52          HG21      VAL  52  57.910  -1.215   2.726
  469   3HG2  VAL  52          HG23      VAL  52  58.990  -2.314   1.870
  470    NH1  ARG  53           NH2      ARG  53  60.529 -12.741   5.554
  471    NH2  ARG  53           NH1      ARG  53  61.565 -10.971   6.505
  472    H    ARG  53           HN       ARG  53  56.856  -6.524   3.781
  473    HA   ARG  53           HA       ARG  53  59.057  -7.687   2.299
  474   1HB   ARG  53           HB2      ARG  53  58.545  -8.181   4.707
  475   2HB   ARG  53           HB1      ARG  53  57.122  -9.075   4.171
  476   1HG   ARG  53           HG2      ARG  53  58.611 -10.824   4.213
  477   2HG   ARG  53           HG1      ARG  53  58.956 -10.235   2.586
  478   1HD   ARG  53           HD2      ARG  53  60.922  -9.144   3.261
  479   2HD   ARG  53           HD1      ARG  53  60.434  -9.110   4.955
  480    HE   ARG  53           HE       ARG  53  61.680 -11.382   3.561
  481   1HH1  ARG  53          HH21      ARG  53  60.160 -13.196   4.744
  482   2HH1  ARG  53          HH22      ARG  53  60.473 -13.187   6.448
  483   1HH2  ARG  53          HH11      ARG  53  61.989 -10.069   6.423
  484   2HH2  ARG  53          HH12      ARG  53  61.510 -11.419   7.397
  485    H    VAL  54           HN       VAL  54  55.524  -8.267   2.351
  486    HA   VAL  54           HA       VAL  54  55.559 -10.461   0.498
  487    HB   VAL  54           HB       VAL  54  53.361  -8.402   0.919
  488   1HG1  VAL  54          HG11      VAL  54  53.455 -11.153  -0.331
  489   2HG1  VAL  54          HG13      VAL  54  51.949 -10.447   0.254
  490   3HG1  VAL  54          HG12      VAL  54  52.850  -9.656  -1.039
  491   1HG2  VAL  54          HG22      VAL  54  54.189  -9.590   2.999
  492   2HG2  VAL  54          HG21      VAL  54  52.496  -9.896   2.611
  493   3HG2  VAL  54          HG23      VAL  54  53.721 -11.109   2.237
  494    CH2  TRP  55           CH2      TRP  55  59.734  -2.409  -3.666
  495    H    TRP  55           HN       TRP  55  55.296  -6.934  -0.012
  496    HA   TRP  55           HA       TRP  55  55.095  -7.230  -2.892
  497   1HB   TRP  55           HB2      TRP  55  54.341  -5.119  -2.093
  498   2HB   TRP  55           HB1      TRP  55  55.763  -4.896  -1.077
  499    HD1  TRP  55           HD1      TRP  55  54.696  -4.802  -4.800
  500    HE1  TRP  55           HE1      TRP  55  56.466  -3.449  -6.091
  501    HE3  TRP  55           HE3      TRP  55  58.171  -4.033  -1.113
  502    HZ2  TRP  55           HZ2      TRP  55  58.951  -2.225  -5.650
  503    HZ3  TRP  55           HZ3      TRP  55  60.252  -2.787  -1.623
  504    HH2  TRP  55           HH2      TRP  55  60.638  -1.858  -3.878
  505    H    PHE  56           HN       PHE  56  57.731  -7.171  -0.543
  506    HA   PHE  56           HA       PHE  56  59.697  -6.945  -2.704
  507   1HB   PHE  56           HB2      PHE  56  59.870  -6.112  -0.121
  508   2HB   PHE  56           HB1      PHE  56  60.706  -7.663  -0.014
  509    HD1  PHE  56           HD1      PHE  56  60.463  -5.075  -2.698
  510    HD2  PHE  56           HD2      PHE  56  63.051  -7.321  -0.127
  511    HE1  PHE  56           HE1      PHE  56  62.417  -4.060  -3.812
  512    HE2  PHE  56           HE2      PHE  56  65.024  -6.315  -1.257
  513    HZ   PHE  56           HZ       PHE  56  64.686  -4.693  -3.110
  514    H    CYS  57           HN       CYS  57  57.863  -9.442  -1.591
  515    HA   CYS  57           HA       CYS  57  59.916 -11.525  -1.682
  516   1HB   CYS  57           HB2      CYS  57  57.411 -11.523  -0.641
  517   2HB   CYS  57           HB1      CYS  57  57.049 -12.168  -2.242
  518    HG   CYS  57           HG       CYS  57  57.891 -13.976  -0.272
  519    H    ASN  58           HN       ASN  58  57.519 -10.011  -3.764
  520    HA   ASN  58           HA       ASN  58  58.278 -11.622  -6.106
  521   1HB   ASN  58           HB2      ASN  58  56.739 -10.061  -7.320
  522   2HB   ASN  58           HB1      ASN  58  55.969 -10.842  -5.938
  523   1HD2  ASN  58          HD22      ASN  58  56.597  -6.806  -5.895
  524   2HD2  ASN  58          HD21      ASN  58  57.264  -7.763  -7.128
  525    NH1  ARG  59           NH1      ARG  59  59.840  -6.626  -9.920
  526    NH2  ARG  59           NH2      ARG  59  62.094  -6.590  -9.734
  527    H    ARG  59           HN       ARG  59  58.978  -8.406  -4.751
  528    HA   ARG  59           HA       ARG  59  60.410  -7.463  -7.093
  529   1HB   ARG  59           HB2      ARG  59  59.663  -6.332  -4.560
  530   2HB   ARG  59           HB1      ARG  59  61.409  -6.161  -4.706
  531   1HG   ARG  59           HG2      ARG  59  59.347  -5.248  -6.730
  532   2HG   ARG  59           HG1      ARG  59  60.310  -4.223  -5.672
  533   1HD   ARG  59           HD2      ARG  59  62.046  -4.247  -7.102
  534   2HD   ARG  59           HD1      ARG  59  62.032  -6.008  -7.175
  535    HE   ARG  59           HE       ARG  59  60.401  -4.236  -8.946
  536   1HH1  ARG  59          HH11      ARG  59  58.946  -6.244  -9.687
  537   2HH1  ARG  59          HH12      ARG  59  59.903  -7.419 -10.526
  538   1HH2  ARG  59          HH21      ARG  59  62.926  -6.180  -9.359
  539   2HH2  ARG  59          HH22      ARG  59  62.157  -7.383 -10.339
  540    NH1  ARG  60           NH2      ARG  60  64.916 -11.085   1.491
  541    NH2  ARG  60           NH1      ARG  60  63.882 -12.828   0.492
  542    H    ARG  60           HN       ARG  60  61.215  -9.563  -4.440
  543    HA   ARG  60           HA       ARG  60  64.118  -9.310  -4.959
  544   1HB   ARG  60           HB2      ARG  60  62.431 -10.747  -2.929
  545   2HB   ARG  60           HB1      ARG  60  64.075 -11.306  -3.231
  546   1HG   ARG  60           HG2      ARG  60  64.988  -9.134  -2.683
  547   2HG   ARG  60           HG1      ARG  60  63.373  -8.433  -2.577
  548   1HD   ARG  60           HD2      ARG  60  64.383  -8.978  -0.340
  549   2HD   ARG  60           HD1      ARG  60  62.844  -9.785  -0.638
  550    HE   ARG  60           HE       ARG  60  65.037 -11.461  -1.471
  551   1HH1  ARG  60          HH21      ARG  60  65.347 -10.185   1.433
  552   2HH1  ARG  60          HH22      ARG  60  64.846 -11.550   2.373
  553   1HH2  ARG  60          HH11      ARG  60  63.522 -13.265  -0.332
  554   2HH2  ARG  60          HH12      ARG  60  63.813 -13.292   1.375
  555    H    GLN  61           HN       GLN  61  61.395 -11.431  -5.591
  556    HA   GLN  61           HA       GLN  61  63.195 -13.153  -7.245
  557   1HB   GLN  61           HB2      GLN  61  62.250 -14.323  -5.234
  558   2HB   GLN  61           HB1      GLN  61  60.631 -14.001  -5.857
  559   1HG   GLN  61           HG2      GLN  61  60.830 -15.535  -7.561
  560   2HG   GLN  61           HG1      GLN  61  62.568 -15.278  -7.728
  561   1HE2  GLN  61          HE22      GLN  61  63.317 -17.506  -4.926
  562   2HE2  GLN  61          HE21      GLN  61  63.786 -15.987  -5.519
  563    H    LYS  62           HN       LYS  62  62.520 -11.206  -8.707
  564    HA   LYS  62           HA       LYS  62  59.812 -11.273  -9.782
  565   1HB   LYS  62           HB2      LYS  62  60.760  -9.693 -11.479
  566   2HB   LYS  62           HB1      LYS  62  61.071  -9.187  -9.817
  567   1HG   LYS  62           HG2      LYS  62  63.322  -9.550  -9.983
  568   2HG   LYS  62           HG1      LYS  62  63.124 -10.954 -11.029
  569   1HD   LYS  62           HD2      LYS  62  63.059  -9.685 -12.958
  570   2HD   LYS  62           HD1      LYS  62  62.388  -8.276 -12.134
  571   1HE   LYS  62           HE2      LYS  62  64.470  -7.601 -11.311
  572   2HE   LYS  62           HE1      LYS  62  65.164  -9.214 -11.465
  573   1HZ   LYS  62           HZ3      LYS  62  64.929  -8.940 -13.915
  574   2HZ   LYS  62           HZ2      LYS  62  64.514  -7.315 -13.647
  575   3HZ   LYS  62           HZ1      LYS  62  66.049  -7.888 -13.197
  576    H    GLY  63           HN       GLY  63  62.795 -12.954 -10.440
  577   1HA   GLY  63           HA2      GLY  63  62.038 -15.066 -11.852
  578   2HA   GLY  63           HA1      GLY  63  61.823 -13.836 -13.098
  579    H    LYS  64           HN       LYS  64  64.218 -15.395 -11.014
  580    HA   LYS  64           HA       LYS  64  66.468 -14.078 -12.347
  581   1HB   LYS  64           HB2      LYS  64  66.329 -15.017  -9.898
  582   2HB   LYS  64           HB1      LYS  64  66.743 -16.551 -10.664
  583   1HG   LYS  64           HG2      LYS  64  68.825 -15.770 -11.405
  584   2HG   LYS  64           HG1      LYS  64  68.342 -14.078 -11.280
  585   1HD   LYS  64           HD2      LYS  64  69.603 -14.214  -9.359
  586   2HD   LYS  64           HD1      LYS  64  68.061 -14.765  -8.701
  587   1HE   LYS  64           HE2      LYS  64  68.896 -17.133  -9.479
  588   2HE   LYS  64           HE1      LYS  64  70.488 -16.375  -9.440
  589   1HZ   LYS  64           HZ1      LYS  64  68.558 -16.403  -7.185
  590   2HZ   LYS  64           HZ3      LYS  64  69.901 -17.429  -7.328
  591   3HZ   LYS  64           HZ2      LYS  64  70.127 -15.753  -7.157
  592    NH1  ARG  65           NH1      ARG  65  67.316 -23.865 -13.189
  593    NH2  ARG  65           NH2      ARG  65  67.672 -24.261 -15.385
  594    H    ARG  65           HN       ARG  65  64.800 -17.181 -12.519
  595    HA   ARG  65           HA       ARG  65  66.190 -17.695 -15.087
  596   1HB   ARG  65           HB2      ARG  65  67.101 -18.948 -12.839
  597   2HB   ARG  65           HB1      ARG  65  65.876 -20.095 -13.376
  598   1HG   ARG  65           HG2      ARG  65  67.435 -19.159 -15.641
  599   2HG   ARG  65           HG1      ARG  65  68.498 -19.803 -14.392
  600   1HD   ARG  65           HD2      ARG  65  66.095 -21.441 -14.868
  601   2HD   ARG  65           HD1      ARG  65  67.176 -21.332 -16.256
  602    HE   ARG  65           HE       ARG  65  68.919 -21.902 -14.231
  603   1HH1  ARG  65          HH11      ARG  65  67.319 -23.237 -12.411
  604   2HH1  ARG  65          HH12      ARG  65  67.035 -24.816 -13.063
  605   1HH2  ARG  65          HH21      ARG  65  67.948 -23.936 -16.289
  606   2HH2  ARG  65          HH22      ARG  65  67.393 -25.213 -15.259
  607    H    SER  66           HN       SER  66  64.417 -17.696 -16.408
  608    HA   SER  66           HA       SER  66  62.289 -19.687 -15.848
  609   1HB   SER  66           HB2      SER  66  61.942 -16.739 -15.919
  610   2HB   SER  66           HB1      SER  66  60.754 -17.675 -16.821
  611    HG   SER  66           HG       SER  66  60.574 -17.230 -14.362
  612    H    SER  67           HN       SER  67  61.927 -20.835 -17.677
  613    HA   SER  67           HA       SER  67  63.153 -19.976 -20.198
  614   1HB   SER  67           HB2      SER  67  63.250 -22.337 -19.572
  615   2HB   SER  67           HB1      SER  67  61.492 -22.412 -19.485
  616    HG   SER  67           HG       SER  67  61.376 -22.160 -21.661
   
  Start of MODEL          18
 Raw file had  616 H/Q atoms
  Start of MODEL   18
    1   1H    MET   1           HT2      MET   1  31.441  -4.475  13.122
    2   2H    MET   1           HT1      MET   1  29.839  -4.516  13.685
    3   3H    MET   1           HT3      MET   1  30.887  -5.807  14.019
    4    HA   MET   1           HA       MET   1  30.803  -6.641  11.894
    5   1HB   MET   1           HB2      MET   1  28.139  -5.299  12.443
    6   2HB   MET   1           HB1      MET   1  28.385  -6.540  11.213
    7   1HG   MET   1           HG2      MET   1  29.093  -8.142  12.907
    8   2HG   MET   1           HG1      MET   1  28.999  -6.904  14.160
    9   1HE   MET   1           HE2      MET   1  28.075  -9.569  14.086
   10   2HE   MET   1           HE1      MET   1  26.586  -9.434  15.018
   11   3HE   MET   1           HE3      MET   1  26.538 -10.000  13.342
   12    H    GLU   2           HN       GLU   2  29.699  -3.265  11.947
   13    HA   GLU   2           HA       GLU   2  30.830  -2.950   9.205
   14   1HB   GLU   2           HB2      GLU   2  28.139  -1.963  10.191
   15   2HB   GLU   2           HB1      GLU   2  28.901  -1.402   8.702
   16   1HG   GLU   2           HG2      GLU   2  28.636  -4.352   9.135
   17   2HG   GLU   2           HG1      GLU   2  27.200  -3.440   8.668
   18    H    THR   3           HN       THR   3  31.993  -2.297  11.768
   19    HA   THR   3           HA       THR   3  31.725   0.647  11.979
   20    HB   THR   3           HB       THR   3  31.783  -0.574  14.084
   21    HG1  THR   3           HG1      THR   3  33.165   0.765  14.967
   22   1HG2  THR   3          HG22      THR   3  34.274  -1.778  12.885
   23   2HG2  THR   3          HG21      THR   3  34.006  -1.775  14.628
   24   3HG2  THR   3          HG23      THR   3  32.872  -2.605  13.563
   25    H    LEU   4           HN       LEU   4  32.736   0.159   9.556
   26    HA   LEU   4           HA       LEU   4  35.697   0.488   9.829
   27   1HB   LEU   4           HB2      LEU   4  33.973  -0.890   7.843
   28   2HB   LEU   4           HB1      LEU   4  35.335   0.012   7.177
   29    HG   LEU   4           HG       LEU   4  35.806  -1.767   9.543
   30   1HD1  LEU   4          HD12      LEU   4  35.230  -2.631   6.722
   31   2HD1  LEU   4          HD11      LEU   4  36.414  -3.520   7.679
   32   3HD1  LEU   4          HD13      LEU   4  34.747  -3.391   8.239
   33   1HD2  LEU   4          HD22      LEU   4  37.345  -0.604   7.242
   34   2HD2  LEU   4          HD21      LEU   4  37.741  -0.603   8.961
   35   3HD2  LEU   4          HD23      LEU   4  37.939  -2.076   8.011
   36    H    VAL   5           HN       VAL   5  36.340   1.702   7.495
   37    HA   VAL   5           HA       VAL   5  34.678   4.189   7.446
   38    HB   VAL   5           HB       VAL   5  37.696   4.050   7.177
   39   1HG1  VAL   5          HG12      VAL   5  36.340   5.935   6.067
   40   2HG1  VAL   5          HG11      VAL   5  35.951   6.460   7.705
   41   3HG1  VAL   5          HG13      VAL   5  37.630   6.426   7.166
   42   1HG2  VAL   5          HG21      VAL   5  35.881   4.564   9.527
   43   2HG2  VAL   5          HG23      VAL   5  37.326   3.557   9.448
   44   3HG2  VAL   5          HG22      VAL   5  37.475   5.315   9.452
   45    H    GLN   6           HN       GLN   6  33.679   3.007   5.579
   46    HA   GLN   6           HA       GLN   6  35.397   3.018   3.140
   47   1HB   GLN   6           HB2      GLN   6  33.505   1.694   2.132
   48   2HB   GLN   6           HB1      GLN   6  34.277   0.898   3.504
   49   1HG   GLN   6           HG2      GLN   6  32.483   1.355   4.945
   50   2HG   GLN   6           HG1      GLN   6  31.885   2.673   3.936
   51   1HE2  GLN   6          HE22      GLN   6  31.181  -1.146   2.552
   52   2HE2  GLN   6          HE21      GLN   6  32.653  -0.812   3.329
   53    H    ALA   7           HN       ALA   7  34.779   5.537   3.922
   54    HA   ALA   7           HA       ALA   7  32.293   6.601   3.035
   55   1HB   ALA   7           HB3      ALA   7  35.030   7.752   3.484
   56   2HB   ALA   7           HB2      ALA   7  33.778   8.743   2.735
   57   3HB   ALA   7           HB1      ALA   7  33.529   8.082   4.351
   58    NH1  ARG   8           NH2      ARG   8  35.008  10.283  -5.334
   59    NH2  ARG   8           NH1      ARG   8  36.368   8.479  -5.360
   60    H    ARG   8           HN       ARG   8  35.248   5.804   1.295
   61    HA   ARG   8           HA       ARG   8  33.814   6.114  -1.242
   62   1HB   ARG   8           HB2      ARG   8  36.138   7.824  -0.413
   63   2HB   ARG   8           HB1      ARG   8  35.943   7.387  -2.110
   64   1HG   ARG   8           HG2      ARG   8  33.396   8.148  -1.495
   65   2HG   ARG   8           HG1      ARG   8  34.321   9.209  -0.431
   66   1HD   ARG   8           HD2      ARG   8  33.945  10.260  -2.639
   67   2HD   ARG   8           HD1      ARG   8  35.661   9.982  -2.345
   68    HE   ARG   8           HE       ARG   8  34.387   7.784  -3.775
   69   1HH1  ARG   8          HH21      ARG   8  34.257  10.796  -4.917
   70   2HH1  ARG   8          HH22      ARG   8  35.467  10.641  -6.146
   71   1HH2  ARG   8          HH11      ARG   8  36.661   7.608  -4.963
   72   2HH2  ARG   8          HH12      ARG   8  36.828   8.837  -6.172
   73    H    LYS   9           HN       LYS   9  35.720   5.621  -3.053
   74    HA   LYS   9           HA       LYS   9  36.581   2.924  -2.381
   75   1HB   LYS   9           HB2      LYS   9  35.709   3.617  -4.653
   76   2HB   LYS   9           HB1      LYS   9  37.223   4.492  -4.888
   77   1HG   LYS   9           HG2      LYS   9  38.515   2.503  -4.809
   78   2HG   LYS   9           HG1      LYS   9  37.186   1.573  -4.118
   79   1HD   LYS   9           HD2      LYS   9  36.036   1.451  -6.153
   80   2HD   LYS   9           HD1      LYS   9  36.870   2.855  -6.820
   81   1HE   LYS   9           HE2      LYS   9  39.016   1.378  -6.579
   82   2HE   LYS   9           HE1      LYS   9  37.874   0.036  -6.511
   83   1HZ   LYS   9           HZ2      LYS   9  37.601   2.049  -8.634
   84   2HZ   LYS   9           HZ1      LYS   9  38.797   0.851  -8.781
   85   3HZ   LYS   9           HZ3      LYS   9  37.166   0.406  -8.642
   86    NH1  ARG  10           NH1      ARG  10  42.767   9.560  -1.904
   87    NH2  ARG  10           NH2      ARG  10  44.886   8.998  -1.354
   88    H    ARG  10           HN       ARG  10  38.197   3.191  -0.780
   89    HA   ARG  10           HA       ARG  10  40.841   3.813  -1.812
   90   1HB   ARG  10           HB2      ARG  10  39.881   6.057  -1.123
   91   2HB   ARG  10           HB1      ARG  10  39.832   5.441   0.529
   92   1HG   ARG  10           HG2      ARG  10  42.134   5.415   0.740
   93   2HG   ARG  10           HG1      ARG  10  42.394   5.174  -0.988
   94   1HD   ARG  10           HD2      ARG  10  41.166   7.642  -0.933
   95   2HD   ARG  10           HD1      ARG  10  42.142   7.678   0.536
   96    HE   ARG  10           HE       ARG  10  43.754   6.689  -1.597
   97   1HH1  ARG  10          HH11      ARG  10  41.806   9.309  -2.017
   98   2HH1  ARG  10          HH12      ARG  10  43.066  10.495  -2.098
   99   1HH2  ARG  10          HH21      ARG  10  45.549   8.315  -1.046
  100   2HH2  ARG  10          HH22      ARG  10  45.185   9.932  -1.548
  101    H    LYS  11           HN       LYS  11  41.294   1.649  -1.194
  102    HA   LYS  11           HA       LYS  11  40.964   0.930   1.640
  103   1HB   LYS  11           HB2      LYS  11  41.591  -0.588  -0.868
  104   2HB   LYS  11           HB1      LYS  11  42.016  -1.287   0.695
  105   1HG   LYS  11           HG2      LYS  11  39.251  -0.259  -0.001
  106   2HG   LYS  11           HG1      LYS  11  39.729  -1.951  -0.124
  107   1HD   LYS  11           HD2      LYS  11  40.437  -0.791   2.472
  108   2HD   LYS  11           HD1      LYS  11  38.706  -0.701   2.151
  109   1HE   LYS  11           HE2      LYS  11  39.956  -3.283   1.441
  110   2HE   LYS  11           HE1      LYS  11  39.960  -2.907   3.164
  111   1HZ   LYS  11           HZ2      LYS  11  37.534  -2.322   2.841
  112   2HZ   LYS  11           HZ1      LYS  11  37.642  -3.113   1.341
  113   3HZ   LYS  11           HZ3      LYS  11  37.935  -3.972   2.775
  114    NH1  ARG  12           NH2      ARG  12  44.488   6.300   6.758
  115    NH2  ARG  12           NH1      ARG  12  42.253   6.201   6.431
  116    H    ARG  12           HN       ARG  12  42.606   1.237   3.039
  117    HA   ARG  12           HA       ARG  12  45.408   0.846   2.193
  118   1HB   ARG  12           HB2      ARG  12  46.050   3.091   3.175
  119   2HB   ARG  12           HB1      ARG  12  45.187   3.175   1.642
  120   1HG   ARG  12           HG2      ARG  12  43.499   4.346   2.572
  121   2HG   ARG  12           HG1      ARG  12  43.306   3.154   3.856
  122   1HD   ARG  12           HD2      ARG  12  44.951   4.214   5.223
  123   2HD   ARG  12           HD1      ARG  12  45.518   5.215   3.887
  124    HE   ARG  12           HE       ARG  12  43.167   6.281   4.011
  125   1HH1  ARG  12          HH21      ARG  12  45.419   6.225   6.402
  126   2HH1  ARG  12          HH22      ARG  12  44.337   6.527   7.720
  127   1HH2  ARG  12          HH11      ARG  12  41.472   6.049   5.825
  128   2HH2  ARG  12          HH12      ARG  12  42.103   6.427   7.394
  129    H    THR  13           HN       THR  13  45.458  -0.829   3.748
  130    HA   THR  13           HA       THR  13  44.638  -0.334   6.510
  131    HB   THR  13           HB       THR  13  46.401  -2.596   5.554
  132    HG1  THR  13           HG1      THR  13  43.575  -2.388   5.443
  133   1HG2  THR  13          HG23      THR  13  44.477  -2.140   7.831
  134   2HG2  THR  13          HG22      THR  13  44.959  -3.765   7.344
  135   3HG2  THR  13          HG21      THR  13  46.173  -2.617   7.908
  136    H    SER  14           HN       SER  14  47.778  -1.210   5.069
  137    HA   SER  14           HA       SER  14  49.086   0.935   6.564
  138   1HB   SER  14           HB2      SER  14  49.829  -1.950   7.094
  139   2HB   SER  14           HB1      SER  14  50.651  -0.538   7.753
  140    HG   SER  14           HG       SER  14  49.233  -0.745   9.295
  141    H    ILE  15           HN       ILE  15  48.757  -0.246   3.746
  142    HA   ILE  15           HA       ILE  15  51.467   0.401   2.880
  143    HB   ILE  15           HB       ILE  15  50.356  -2.396   2.508
  144   1HG1  ILE  15          HG12      ILE  15  51.737  -2.038   4.519
  145   2HG1  ILE  15          HG11      ILE  15  52.585  -3.054   3.364
  146   1HG2  ILE  15          HG21      ILE  15  52.234  -0.840   0.790
  147   2HG2  ILE  15          HG23      ILE  15  52.699  -2.502   1.155
  148   3HG2  ILE  15          HG22      ILE  15  51.161  -2.170   0.360
  149   1HD1  ILE  15          HD12      ILE  15  53.387  -0.536   2.579
  150   2HD1  ILE  15          HD11      ILE  15  53.286  -0.356   4.325
  151   3HD1  ILE  15          HD13      ILE  15  54.312  -1.602   3.631
  152    H    GLU  16           HN       GLU  16  49.849   2.096   2.147
  153    HA   GLU  16           HA       GLU  16  48.021   1.495   0.023
  154   1HB   GLU  16           HB2      GLU  16  47.957   3.597   1.413
  155   2HB   GLU  16           HB1      GLU  16  49.436   4.116   0.608
  156   1HG   GLU  16           HG2      GLU  16  47.720   5.174  -0.621
  157   2HG   GLU  16           HG1      GLU  16  48.128   3.768  -1.598
  158    H    ASN  17           HN       ASN  17  48.429   1.918  -2.273
  159    HA   ASN  17           HA       ASN  17  50.929   0.928  -3.206
  160   1HB   ASN  17           HB2      ASN  17  48.476   1.472  -4.370
  161   2HB   ASN  17           HB1      ASN  17  49.523   2.680  -5.114
  162   1HD2  ASN  17          HD22      ASN  17  51.727   0.057  -6.479
  163   2HD2  ASN  17          HD21      ASN  17  51.889   1.491  -5.585
  164    NH1  ARG  18           NH1      ARG  18  51.129  11.207  -3.381
  165    NH2  ARG  18           NH2      ARG  18  52.527  11.803  -1.710
  166    H    ARG  18           HN       ARG  18  49.975   4.112  -2.228
  167    HA   ARG  18           HA       ARG  18  52.152   5.456  -3.643
  168   1HB   ARG  18           HB2      ARG  18  49.784   6.343  -2.597
  169   2HB   ARG  18           HB1      ARG  18  50.906   6.804  -1.316
  170   1HG   ARG  18           HG2      ARG  18  51.736   7.386  -4.120
  171   2HG   ARG  18           HG1      ARG  18  50.447   8.381  -3.442
  172   1HD   ARG  18           HD2      ARG  18  52.774   7.929  -1.661
  173   2HD   ARG  18           HD1      ARG  18  53.091   8.912  -3.089
  174    HE   ARG  18           HE       ARG  18  51.132   9.586  -0.950
  175   1HH1  ARG  18          HH11      ARG  18  50.549  10.523  -3.823
  176   2HH1  ARG  18          HH12      ARG  18  51.216  12.120  -3.778
  177   1HH2  ARG  18          HH21      ARG  18  53.020  11.575  -0.870
  178   2HH2  ARG  18          HH22      ARG  18  52.614  12.715  -2.109
  179    H    VAL  19           HN       VAL  19  51.563   4.043  -0.470
  180    HA   VAL  19           HA       VAL  19  53.800   5.211   0.857
  181    HB   VAL  19           HB       VAL  19  51.768   3.648   1.754
  182   1HG1  VAL  19          HG12      VAL  19  54.142   1.767   1.513
  183   2HG1  VAL  19          HG11      VAL  19  52.890   1.570   2.719
  184   3HG1  VAL  19          HG13      VAL  19  52.475   1.486   1.010
  185   1HG2  VAL  19          HG21      VAL  19  53.260   5.133   3.059
  186   2HG2  VAL  19          HG23      VAL  19  53.012   3.594   3.884
  187   3HG2  VAL  19          HG22      VAL  19  54.518   3.898   3.018
  188    NH1  ARG  20           NH2      ARG  20  56.405  -4.630  -2.220
  189    NH2  ARG  20           NH1      ARG  20  56.627  -3.428  -4.121
  190    H    ARG  20           HN       ARG  20  53.487   2.157  -0.934
  191    HA   ARG  20           HA       ARG  20  56.169   1.272  -0.540
  192   1HB   ARG  20           HB2      ARG  20  54.119   0.779  -2.686
  193   2HB   ARG  20           HB1      ARG  20  55.747   0.121  -2.846
  194   1HG   ARG  20           HG2      ARG  20  54.616  -0.337  -0.179
  195   2HG   ARG  20           HG1      ARG  20  53.641  -1.060  -1.457
  196   1HD   ARG  20           HD2      ARG  20  56.621  -1.415  -1.514
  197   2HD   ARG  20           HD1      ARG  20  55.652  -2.411  -0.427
  198    HE   ARG  20           HE       ARG  20  54.365  -2.613  -2.886
  199   1HH1  ARG  20          HH21      ARG  20  55.995  -4.753  -1.315
  200   2HH1  ARG  20          HH22      ARG  20  57.051  -5.307  -2.571
  201   1HH2  ARG  20          HH11      ARG  20  56.389  -2.630  -4.674
  202   2HH2  ARG  20          HH12      ARG  20  57.274  -4.105  -4.474
  203    CH2  TRP  21           CH2      TRP  21  57.932  -0.262  -6.947
  204    H    TRP  21           HN       TRP  21  54.852   3.185  -3.269
  205    HA   TRP  21           HA       TRP  21  57.540   3.504  -4.292
  206   1HB   TRP  21           HB2      TRP  21  54.867   4.303  -5.179
  207   2HB   TRP  21           HB1      TRP  21  56.071   5.570  -5.462
  208    HD1  TRP  21           HD1      TRP  21  56.582   5.189  -8.016
  209    HE1  TRP  21           HE1      TRP  21  57.644   3.240  -9.339
  210    HE3  TRP  21           HE3      TRP  21  56.485   1.523  -4.462
  211    HZ2  TRP  21           HZ2      TRP  21  58.380   0.482  -8.906
  212    HZ3  TRP  21           HZ3      TRP  21  57.374  -0.719  -4.915
  213    HH2  TRP  21           HH2      TRP  21  58.335  -1.243  -7.142
  214    H    SER  22           HN       SER  22  55.894   4.888  -1.684
  215    HA   SER  22           HA       SER  22  57.280   7.430  -1.605
  216   1HB   SER  22           HB2      SER  22  55.211   6.288  -0.120
  217   2HB   SER  22           HB1      SER  22  56.569   6.257   0.998
  218    HG   SER  22           HG       SER  22  55.123   8.365   0.027
  219    H    LEU  23           HN       LEU  23  57.770   4.104  -0.488
  220    HA   LEU  23           HA       LEU  23  60.136   4.406   1.066
  221   1HB   LEU  23           HB2      LEU  23  59.435   2.171  -0.888
  222   2HB   LEU  23           HB1      LEU  23  60.708   2.092   0.303
  223    HG   LEU  23           HG       LEU  23  57.952   2.720   1.260
  224   1HD1  LEU  23          HD11      LEU  23  58.136   0.660  -0.432
  225   2HD1  LEU  23          HD13      LEU  23  58.803  -0.142   0.989
  226   3HD1  LEU  23          HD12      LEU  23  57.177   0.539   1.043
  227   1HD2  LEU  23          HD22      LEU  23  60.256   2.512   2.572
  228   2HD2  LEU  23          HD21      LEU  23  58.774   1.860   3.273
  229   3HD2  LEU  23          HD23      LEU  23  59.914   0.785   2.462
  230    H    GLU  24           HN       GLU  24  59.572   3.957  -2.389
  231    HA   GLU  24           HA       GLU  24  62.230   4.007  -3.368
  232   1HB   GLU  24           HB2      GLU  24  59.819   3.870  -4.558
  233   2HB   GLU  24           HB1      GLU  24  60.193   5.562  -4.891
  234   1HG   GLU  24           HG2      GLU  24  62.564   4.507  -5.548
  235   2HG   GLU  24           HG1      GLU  24  61.559   3.092  -5.860
  236    H    THR  25           HN       THR  25  60.117   6.753  -2.552
  237    HA   THR  25           HA       THR  25  61.873   8.810  -3.480
  238    HB   THR  25           HB       THR  25  60.079   9.199  -1.101
  239    HG1  THR  25           HG1      THR  25  59.250   8.914  -3.798
  240   1HG2  THR  25          HG22      THR  25  61.540  10.963  -2.448
  241   2HG2  THR  25          HG21      THR  25  60.161  10.915  -3.547
  242   3HG2  THR  25          HG23      THR  25  59.929  11.377  -1.861
  243    H    MET  26           HN       MET  26  61.657   7.090  -0.403
  244    HA   MET  26           HA       MET  26  63.537   8.798   0.994
  245   1HB   MET  26           HB2      MET  26  62.375   6.067   1.512
  246   2HB   MET  26           HB1      MET  26  63.645   6.720   2.547
  247   1HG   MET  26           HG2      MET  26  62.255   8.731   2.960
  248   2HG   MET  26           HG1      MET  26  60.975   8.035   1.966
  249   1HE   MET  26           HE3      MET  26  59.852   6.248   2.175
  250   2HE   MET  26           HE2      MET  26  60.347   4.845   3.119
  251   3HE   MET  26           HE1      MET  26  59.046   5.877   3.705
  252    H    PHE  27           HN       PHE  27  63.859   5.886  -0.971
  253    HA   PHE  27           HA       PHE  27  66.709   5.609  -0.271
  254   1HB   PHE  27           HB2      PHE  27  64.829   4.000  -2.017
  255   2HB   PHE  27           HB1      PHE  27  66.552   3.666  -1.911
  256    HD1  PHE  27           HD1      PHE  27  67.573   3.305   0.435
  257    HD2  PHE  27           HD2      PHE  27  63.358   3.201  -0.355
  258    HE1  PHE  27           HE1      PHE  27  67.197   2.095   2.569
  259    HE2  PHE  27           HE2      PHE  27  62.981   1.994   1.768
  260    HZ   PHE  27           HZ       PHE  27  64.897   1.444   3.230
  261    H    LEU  28           HN       LEU  28  64.885   7.311  -2.604
  262    HA   LEU  28           HA       LEU  28  67.013   7.192  -4.639
  263   1HB   LEU  28           HB2      LEU  28  64.289   8.488  -4.545
  264   2HB   LEU  28           HB1      LEU  28  65.429   8.782  -5.862
  265    HG   LEU  28           HG       LEU  28  64.593   6.009  -4.980
  266   1HD1  LEU  28          HD13      LEU  28  63.469   7.821  -7.124
  267   2HD1  LEU  28          HD12      LEU  28  63.248   6.071  -7.143
  268   3HD1  LEU  28          HD11      LEU  28  62.598   7.028  -5.811
  269   1HD2  LEU  28          HD21      LEU  28  66.165   7.157  -7.290
  270   2HD2  LEU  28          HD23      LEU  28  66.653   5.903  -6.150
  271   3HD2  LEU  28          HD22      LEU  28  65.436   5.554  -7.378
  272    H    LYS  29           HN       LYS  29  66.671   8.877  -1.808
  273    HA   LYS  29           HA       LYS  29  67.769  11.405  -2.926
  274   1HB   LYS  29           HB2      LYS  29  67.383  12.369  -0.713
  275   2HB   LYS  29           HB1      LYS  29  65.911  11.569  -1.254
  276   1HG   LYS  29           HG2      LYS  29  66.853   9.501   0.056
  277   2HG   LYS  29           HG1      LYS  29  67.868  10.694   0.867
  278   1HD   LYS  29           HD2      LYS  29  64.877  11.064   0.624
  279   2HD   LYS  29           HD1      LYS  29  65.589  10.151   1.953
  280   1HE   LYS  29           HE2      LYS  29  65.914  12.107   3.023
  281   2HE   LYS  29           HE1      LYS  29  67.104  12.523   1.792
  282   1HZ   LYS  29           HZ1      LYS  29  64.248  12.921   1.226
  283   2HZ   LYS  29           HZ3      LYS  29  65.062  14.048   2.197
  284   3HZ   LYS  29           HZ2      LYS  29  65.595  13.752   0.611
  285    H    CYS  30           HN       CYS  30  68.503   8.775  -0.695
  286    HA   CYS  30           HA       CYS  30  71.383   9.369  -1.018
  287   1HB   CYS  30           HB2      CYS  30  69.905   9.079   1.606
  288   2HB   CYS  30           HB1      CYS  30  71.650   8.862   1.473
  289    HG   CYS  30           HG       CYS  30  70.597  11.526   0.334
  290    HA   PRO  31           HA       PRO  31  70.942   4.875  -1.375
  291   1HB   PRO  31           HB2      PRO  31  73.385   4.415  -2.516
  292   2HB   PRO  31           HB1      PRO  31  72.004   5.038  -3.436
  293   1HG   PRO  31           HG2      PRO  31  74.454   6.461  -2.545
  294   2HG   PRO  31           HG1      PRO  31  73.350   6.856  -3.872
  295   1HD   PRO  31           HD2      PRO  31  73.434   8.069  -1.275
  296   2HD   PRO  31           HD1      PRO  31  72.242   8.367  -2.557
  297    H    LYS  32           HN       LYS  32  72.181   6.362   1.053
  298    HA   LYS  32           HA       LYS  32  74.116   4.254   1.828
  299   1HB   LYS  32           HB2      LYS  32  75.079   6.028   3.347
  300   2HB   LYS  32           HB1      LYS  32  75.250   6.365   1.624
  301   1HG   LYS  32           HG2      LYS  32  73.470   7.953   1.648
  302   2HG   LYS  32           HG1      LYS  32  72.906   7.410   3.229
  303   1HD   LYS  32           HD2      LYS  32  75.142   8.164   4.167
  304   2HD   LYS  32           HD1      LYS  32  75.456   8.917   2.603
  305   1HE   LYS  32           HE2      LYS  32  74.520  10.660   3.898
  306   2HE   LYS  32           HE1      LYS  32  73.171  10.082   2.922
  307   1HZ   LYS  32           HZ3      LYS  32  72.510   8.665   4.791
  308   2HZ   LYS  32           HZ2      LYS  32  73.767   9.320   5.728
  309   3HZ   LYS  32           HZ1      LYS  32  72.490  10.311   5.203
  310    HA   PRO  33           HA       PRO  33  70.619   4.594   5.031
  311   1HB   PRO  33           HB2      PRO  33  69.146   2.355   4.429
  312   2HB   PRO  33           HB1      PRO  33  68.768   3.967   3.796
  313   1HG   PRO  33           HG2      PRO  33  70.028   1.648   2.403
  314   2HG   PRO  33           HG1      PRO  33  69.037   2.957   1.739
  315   1HD   PRO  33           HD2      PRO  33  71.846   2.801   1.553
  316   2HD   PRO  33           HD1      PRO  33  70.862   4.260   1.294
  317    H    SER  34           HN       SER  34  70.671   3.248   6.936
  318    HA   SER  34           HA       SER  34  72.891   1.321   7.011
  319   1HB   SER  34           HB2      SER  34  71.189   2.683   9.073
  320   2HB   SER  34           HB1      SER  34  72.148   1.272   9.506
  321    HG   SER  34           HG       SER  34  73.662   2.724   9.729
  322    H    LEU  35           HN       LEU  35  72.632  -0.886   7.581
  323    HA   LEU  35           HA       LEU  35  70.267  -2.212   6.676
  324   1HB   LEU  35           HB2      LEU  35  72.507  -3.060   8.531
  325   2HB   LEU  35           HB1      LEU  35  71.185  -4.147   8.108
  326    HG   LEU  35           HG       LEU  35  72.126  -2.935   5.695
  327   1HD1  LEU  35          HD13      LEU  35  74.203  -2.802   7.401
  328   2HD1  LEU  35          HD12      LEU  35  74.396  -4.471   6.864
  329   3HD1  LEU  35          HD11      LEU  35  74.414  -3.158   5.686
  330   1HD2  LEU  35          HD23      LEU  35  71.042  -5.162   5.941
  331   2HD2  LEU  35          HD22      LEU  35  72.571  -5.274   5.070
  332   3HD2  LEU  35          HD21      LEU  35  72.484  -5.757   6.764
  333    H    GLN  36           HN       GLN  36  71.156  -0.721   9.676
  334    HA   GLN  36           HA       GLN  36  69.078  -1.938  11.318
  335   1HB   GLN  36           HB2      GLN  36  71.295  -0.341  11.818
  336   2HB   GLN  36           HB1      GLN  36  69.953   0.770  12.086
  337   1HG   GLN  36           HG2      GLN  36  69.674  -1.953  13.254
  338   2HG   GLN  36           HG1      GLN  36  70.864  -0.890  14.006
  339   1HE2  GLN  36          HE22      GLN  36  68.324   1.559  14.945
  340   2HE2  GLN  36          HE21      GLN  36  69.894   1.507  14.303
  341    H    GLN  37           HN       GLN  37  69.432   1.027   9.423
  342    HA   GLN  37           HA       GLN  37  66.885   2.164  10.067
  343   1HB   GLN  37           HB2      GLN  37  68.760   3.403   8.952
  344   2HB   GLN  37           HB1      GLN  37  68.446   2.475   7.484
  345   1HG   GLN  37           HG2      GLN  37  66.032   3.306   7.644
  346   2HG   GLN  37           HG1      GLN  37  66.610   4.443   8.863
  347   1HE2  GLN  37          HE22      GLN  37  68.409   6.453   6.511
  348   2HE2  GLN  37          HE21      GLN  37  68.288   6.038   8.153
  349    H    ILE  38           HN       ILE  38  67.881  -0.358   7.817
  350    HA   ILE  38           HA       ILE  38  65.413  -0.349   6.302
  351    HB   ILE  38           HB       ILE  38  67.711  -2.304   6.563
  352   1HG1  ILE  38          HG12      ILE  38  68.008  -0.348   5.108
  353   2HG1  ILE  38          HG11      ILE  38  67.919  -1.814   4.135
  354   1HG2  ILE  38          HG21      ILE  38  64.987  -2.808   5.400
  355   2HG2  ILE  38          HG23      ILE  38  66.395  -3.471   4.568
  356   3HG2  ILE  38          HG22      ILE  38  66.064  -3.922   6.241
  357   1HD1  ILE  38          HD13      ILE  38  65.368  -1.282   3.974
  358   2HD1  ILE  38          HD12      ILE  38  65.837   0.332   4.498
  359   3HD1  ILE  38          HD11      ILE  38  66.481  -0.324   2.996
  360    H    THR  39           HN       THR  39  66.577  -1.867   9.234
  361    HA   THR  39           HA       THR  39  64.329  -3.651   9.603
  362    HB   THR  39           HB       THR  39  65.577  -2.415  12.009
  363    HG1  THR  39           HG1      THR  39  67.014  -4.002  10.149
  364   1HG2  THR  39          HG23      THR  39  65.143  -5.265  11.069
  365   2HG2  THR  39          HG22      THR  39  65.720  -4.797  12.669
  366   3HG2  THR  39          HG21      THR  39  64.089  -4.363  12.157
  367    H    HIS  40           HN       HIS  40  64.994  -0.265  10.272
  368    HA   HIS  40           HA       HIS  40  62.559   0.275  11.747
  369   1HB   HIS  40           HB2      HIS  40  64.882   1.668  11.314
  370   2HB   HIS  40           HB1      HIS  40  63.782   2.490  10.210
  371    HD1  HIS  40           HD1      HIS  40  63.361   1.114  13.755
  372    HD2  HIS  40           HD2      HIS  40  62.666   4.604  11.582
  373    HE1  HIS  40           HE1      HIS  40  62.283   2.752  15.357
  374    H    ILE  41           HN       ILE  41  63.429   0.038   8.351
  375    HA   ILE  41           HA       ILE  41  61.149   1.457   7.304
  376    HB   ILE  41           HB       ILE  41  63.216  -0.385   6.187
  377   1HG1  ILE  41          HG12      ILE  41  62.851   1.317   4.242
  378   2HG1  ILE  41          HG11      ILE  41  61.874   2.203   5.410
  379   1HG2  ILE  41          HG21      ILE  41  60.418  -0.223   5.026
  380   2HG2  ILE  41          HG23      ILE  41  61.815  -0.565   4.012
  381   3HG2  ILE  41          HG22      ILE  41  61.383  -1.665   5.321
  382   1HD1  ILE  41          HD12      ILE  41  63.811   2.240   6.969
  383   2HD1  ILE  41          HD11      ILE  41  64.779   1.408   5.757
  384   3HD1  ILE  41          HD13      ILE  41  64.183   3.033   5.438
  385    H    ALA  42           HN       ALA  42  61.824  -1.948   8.010
  386    HA   ALA  42           HA       ALA  42  59.426  -3.140   7.256
  387   1HB   ALA  42           HB3      ALA  42  61.313  -3.764   9.536
  388   2HB   ALA  42           HB2      ALA  42  59.936  -4.794   9.143
  389   3HB   ALA  42           HB1      ALA  42  61.222  -4.552   7.961
  390    H    ASN  43           HN       ASN  43  60.217  -1.989  10.548
  391    HA   ASN  43           HA       ASN  43  57.537  -2.280  11.534
  392   1HB   ASN  43           HB2      ASN  43  59.688  -0.355  12.478
  393   2HB   ASN  43           HB1      ASN  43  58.269  -0.858  13.396
  394   1HD2  ASN  43          HD22      ASN  43  59.860  -3.740  14.619
  395   2HD2  ASN  43          HD21      ASN  43  58.608  -2.605  14.776
  396    H    GLN  44           HN       GLN  44  59.080   0.053   9.519
  397    HA   GLN  44           HA       GLN  44  57.205   2.213  10.002
  398   1HB   GLN  44           HB2      GLN  44  59.525   1.753   8.208
  399   2HB   GLN  44           HB1      GLN  44  58.399   3.032   7.784
  400   1HG   GLN  44           HG2      GLN  44  59.484   2.837  10.584
  401   2HG   GLN  44           HG1      GLN  44  60.451   3.585   9.312
  402   1HE2  GLN  44          HE22      GLN  44  58.217   6.379   8.917
  403   2HE2  GLN  44          HE21      GLN  44  59.320   5.407   8.070
  404    H    LEU  45           HN       LEU  45  57.176  -0.551   7.850
  405    HA   LEU  45           HA       LEU  45  54.662   0.535   6.711
  406   1HB   LEU  45           HB2      LEU  45  55.254   0.256   4.455
  407   2HB   LEU  45           HB1      LEU  45  56.720   0.909   5.162
  408    HG   LEU  45           HG       LEU  45  56.291  -2.059   4.823
  409   1HD1  LEU  45          HD13      LEU  45  57.655  -0.124   2.941
  410   2HD1  LEU  45          HD12      LEU  45  57.713  -1.880   2.809
  411   3HD1  LEU  45          HD11      LEU  45  56.182  -1.030   2.596
  412   1HD2  LEU  45          HD23      LEU  45  58.526  -0.203   5.491
  413   2HD2  LEU  45          HD22      LEU  45  58.000  -1.650   6.352
  414   3HD2  LEU  45          HD21      LEU  45  58.869  -1.797   4.823
  415    H    GLY  46           HN       GLY  46  55.585  -1.722   8.611
  416   1HA   GLY  46           HA2      GLY  46  54.798  -3.857   9.151
  417   2HA   GLY  46           HA1      GLY  46  53.497  -3.554   8.005
  418    H    LEU  47           HN       LEU  47  56.776  -3.445   6.797
  419    HA   LEU  47           HA       LEU  47  56.258  -6.021   5.358
  420   1HB   LEU  47           HB2      LEU  47  57.619  -3.504   4.630
  421   2HB   LEU  47           HB1      LEU  47  58.504  -4.946   4.171
  422    HG   LEU  47           HG       LEU  47  56.271  -5.781   3.189
  423   1HD1  LEU  47          HD13      LEU  47  55.215  -3.648   4.439
  424   2HD1  LEU  47          HD12      LEU  47  55.565  -2.911   2.877
  425   3HD1  LEU  47          HD11      LEU  47  54.515  -4.319   2.969
  426   1HD2  LEU  47          HD22      LEU  47  58.391  -4.488   2.075
  427   2HD2  LEU  47          HD21      LEU  47  57.006  -5.048   1.138
  428   3HD2  LEU  47          HD23      LEU  47  57.097  -3.366   1.657
  429    H    GLU  48           HN       GLU  48  57.623  -7.764   5.767
  430    HA   GLU  48           HA       GLU  48  59.523  -7.596   7.939
  431   1HB   GLU  48           HB2      GLU  48  60.217  -9.890   7.212
  432   2HB   GLU  48           HB1      GLU  48  58.478  -9.749   7.455
  433   1HG   GLU  48           HG2      GLU  48  58.682  -9.081   4.823
  434   2HG   GLU  48           HG1      GLU  48  60.007 -10.226   4.969
  435    H    LYS  49           HN       LYS  49  61.915  -8.509   7.280
  436    HA   LYS  49           HA       LYS  49  62.936  -6.415   5.513
  437   1HB   LYS  49           HB2      LYS  49  63.982  -7.688   7.707
  438   2HB   LYS  49           HB1      LYS  49  64.862  -8.456   6.386
  439   1HG   LYS  49           HG2      LYS  49  64.618  -5.542   6.056
  440   2HG   LYS  49           HG1      LYS  49  65.488  -5.997   7.520
  441   1HD   LYS  49           HD2      LYS  49  66.185  -7.444   5.001
  442   2HD   LYS  49           HD1      LYS  49  66.732  -5.775   5.161
  443   1HE   LYS  49           HE2      LYS  49  67.885  -6.281   7.226
  444   2HE   LYS  49           HE1      LYS  49  67.200  -7.905   7.265
  445   1HZ   LYS  49           HZ2      LYS  49  68.771  -7.049   4.931
  446   2HZ   LYS  49           HZ1      LYS  49  69.578  -7.530   6.347
  447   3HZ   LYS  49           HZ3      LYS  49  68.536  -8.611   5.557
  448    H    ASP  50           HN       ASP  50  61.916  -9.652   5.067
  449    HA   ASP  50           HA       ASP  50  63.710 -10.264   2.848
  450   1HB   ASP  50           HB2      ASP  50  62.576 -12.027   4.241
  451   2HB   ASP  50           HB1      ASP  50  61.038 -11.530   3.536
  452    H    VAL  51           HN       VAL  51  60.327  -9.196   3.194
  453    HA   VAL  51           HA       VAL  51  59.845  -8.975   0.348
  454    HB   VAL  51           HB       VAL  51  57.980  -9.161   1.974
  455   1HG1  VAL  51          HG13      VAL  51  59.289  -7.654   3.663
  456   2HG1  VAL  51          HG12      VAL  51  58.522  -6.330   2.812
  457   3HG1  VAL  51          HG11      VAL  51  57.532  -7.542   3.618
  458   1HG2  VAL  51          HG23      VAL  51  58.097  -6.551   0.427
  459   2HG2  VAL  51          HG22      VAL  51  57.413  -8.081  -0.122
  460   3HG2  VAL  51          HG21      VAL  51  56.626  -7.177   1.172
  461    H    VAL  52           HN       VAL  52  60.908  -6.772   2.899
  462    HA   VAL  52           HA       VAL  52  60.876  -4.411   1.279
  463    HB   VAL  52           HB       VAL  52  61.113  -4.827   3.911
  464   1HG1  VAL  52          HG11      VAL  52  63.480  -5.733   3.583
  465   2HG1  VAL  52          HG13      VAL  52  63.952  -4.070   3.234
  466   3HG1  VAL  52          HG12      VAL  52  63.270  -4.482   4.807
  467   1HG2  VAL  52          HG22      VAL  52  61.474  -2.597   2.097
  468   2HG2  VAL  52          HG21      VAL  52  60.708  -2.634   3.684
  469   3HG2  VAL  52          HG23      VAL  52  62.445  -2.374   3.551
  470    NH1  ARG  53           NH1      ARG  53  70.783  -8.164   0.160
  471    NH2  ARG  53           NH2      ARG  53  70.308  -9.135  -1.825
  472    H    ARG  53           HN       ARG  53  63.266  -6.957   1.710
  473    HA   ARG  53           HA       ARG  53  65.384  -5.527   0.307
  474   1HB   ARG  53           HB2      ARG  53  65.395  -7.710   1.916
  475   2HB   ARG  53           HB1      ARG  53  65.414  -8.498   0.340
  476   1HG   ARG  53           HG2      ARG  53  67.263  -6.192   0.714
  477   2HG   ARG  53           HG1      ARG  53  67.668  -7.684   1.562
  478   1HD   ARG  53           HD2      ARG  53  66.859  -8.310  -1.138
  479   2HD   ARG  53           HD1      ARG  53  68.122  -7.079  -1.169
  480    HE   ARG  53           HE       ARG  53  68.431  -9.709   0.227
  481   1HH1  ARG  53          HH11      ARG  53  70.490  -7.857   1.066
  482   2HH1  ARG  53          HH12      ARG  53  71.731  -8.034  -0.130
  483   1HH2  ARG  53          HH21      ARG  53  69.653  -9.573  -2.441
  484   2HH2  ARG  53          HH22      ARG  53  71.257  -9.005  -2.116
  485    H    VAL  54           HN       VAL  54  62.713  -7.622  -0.592
  486    HA   VAL  54           HA       VAL  54  63.653  -8.248  -3.250
  487    HB   VAL  54           HB       VAL  54  60.808  -8.134  -2.191
  488   1HG1  VAL  54          HG11      VAL  54  61.932  -8.724  -4.812
  489   2HG1  VAL  54          HG13      VAL  54  61.076 -10.123  -4.165
  490   3HG1  VAL  54          HG12      VAL  54  60.242  -8.579  -4.331
  491   1HG2  VAL  54          HG23      VAL  54  62.839  -9.727  -1.263
  492   2HG2  VAL  54          HG22      VAL  54  61.136 -10.184  -1.244
  493   3HG2  VAL  54          HG21      VAL  54  62.179 -10.730  -2.556
  494    CH2  TRP  55           CH2      TRP  55  62.233   1.649  -2.287
  495    H    TRP  55           HN       TRP  55  61.400  -5.725  -2.021
  496    HA   TRP  55           HA       TRP  55  60.996  -4.553  -4.612
  497   1HB   TRP  55           HB2      TRP  55  59.408  -3.871  -2.961
  498   2HB   TRP  55           HB1      TRP  55  60.669  -3.449  -1.805
  499    HD1  TRP  55           HD1      TRP  55  59.168  -2.188  -5.164
  500    HE1  TRP  55           HE1      TRP  55  59.753   0.310  -5.395
  501    HE3  TRP  55           HE3      TRP  55  62.126  -1.511  -1.034
  502    HZ2  TRP  55           HZ2      TRP  55  61.222   2.302  -4.060
  503    HZ3  TRP  55           HZ3      TRP  55  63.135   0.702  -0.596
  504    HH2  TRP  55           HH2      TRP  55  62.665   2.612  -2.078
  505    H    PHE  56           HN       PHE  56  63.474  -4.086  -2.089
  506    HA   PHE  56           HA       PHE  56  64.631  -1.883  -3.590
  507   1HB   PHE  56           HB2      PHE  56  64.795  -2.400  -0.974
  508   2HB   PHE  56           HB1      PHE  56  66.278  -3.207  -1.494
  509    HD1  PHE  56           HD1      PHE  56  64.461  -0.121  -2.587
  510    HD2  PHE  56           HD2      PHE  56  68.166  -1.803  -1.244
  511    HE1  PHE  56           HE1      PHE  56  65.541   2.075  -2.875
  512    HE2  PHE  56           HE2      PHE  56  69.262   0.405  -1.545
  513    HZ   PHE  56           HZ       PHE  56  67.933   2.336  -2.377
  514    H    CYS  57           HN       CYS  57  64.804  -5.242  -3.916
  515    HA   CYS  57           HA       CYS  57  67.531  -5.390  -4.916
  516   1HB   CYS  57           HB2      CYS  57  65.143  -7.169  -4.843
  517   2HB   CYS  57           HB1      CYS  57  66.245  -7.431  -6.194
  518    HG   CYS  57           HG       CYS  57  67.443  -8.791  -4.461
  519    H    ASN  58           HN       ASN  58  64.317  -4.769  -6.201
  520    HA   ASN  58           HA       ASN  58  65.285  -4.449  -8.957
  521   1HB   ASN  58           HB2      ASN  58  62.616  -3.972  -7.604
  522   2HB   ASN  58           HB1      ASN  58  62.904  -3.590  -9.302
  523   1HD2  ASN  58          HD22      ASN  58  62.531  -6.930 -10.336
  524   2HD2  ASN  58          HD21      ASN  58  62.619  -5.290 -10.765
  525    NH1  ARG  59           NH1      ARG  59  66.915   3.723  -7.192
  526    NH2  ARG  59           NH2      ARG  59  67.695   3.396  -5.098
  527    H    ARG  59           HN       ARG  59  64.638  -2.448  -6.126
  528    HA   ARG  59           HA       ARG  59  64.730   0.065  -7.586
  529   1HB   ARG  59           HB2      ARG  59  64.035  -0.665  -4.942
  530   2HB   ARG  59           HB1      ARG  59  65.450   0.363  -4.764
  531   1HG   ARG  59           HG2      ARG  59  62.892   1.037  -6.237
  532   2HG   ARG  59           HG1      ARG  59  63.459   1.731  -4.724
  533   1HD   ARG  59           HD2      ARG  59  65.094   1.952  -7.258
  534   2HD   ARG  59           HD1      ARG  59  63.847   3.125  -6.853
  535    HE   ARG  59           HE       ARG  59  65.216   3.329  -4.623
  536   1HH1  ARG  59          HH11      ARG  59  66.155   3.736  -7.842
  537   2HH1  ARG  59          HH12      ARG  59  67.839   3.955  -7.498
  538   1HH2  ARG  59          HH21      ARG  59  67.534   3.158  -4.141
  539   2HH2  ARG  59          HH22      ARG  59  68.617   3.628  -5.408
  540    NH1  ARG  60           NH2      ARG  60  73.369  -2.852  -5.183
  541    NH2  ARG  60           NH1      ARG  60  73.238  -4.078  -3.288
  542    H    ARG  60           HN       ARG  60  67.097  -2.197  -6.502
  543    HA   ARG  60           HA       ARG  60  69.266  -0.188  -6.422
  544   1HB   ARG  60           HB2      ARG  60  69.066  -3.146  -5.889
  545   2HB   ARG  60           HB1      ARG  60  70.642  -2.413  -6.191
  546   1HG   ARG  60           HG2      ARG  60  70.129  -0.737  -4.385
  547   2HG   ARG  60           HG1      ARG  60  68.671  -1.658  -4.016
  548   1HD   ARG  60           HD2      ARG  60  70.123  -2.662  -2.529
  549   2HD   ARG  60           HD1      ARG  60  70.418  -3.678  -3.940
  550    HE   ARG  60           HE       ARG  60  72.179  -1.371  -3.204
  551   1HH1  ARG  60          HH21      ARG  60  73.068  -2.073  -5.733
  552   2HH1  ARG  60          HH22      ARG  60  74.071  -3.471  -5.536
  553   1HH2  ARG  60          HH11      ARG  60  72.837  -4.238  -2.387
  554   2HH2  ARG  60          HH12      ARG  60  73.941  -4.697  -3.640
  555    H    GLN  61           HN       GLN  61  68.001  -2.769  -8.470
  556    HA   GLN  61           HA       GLN  61  69.982  -1.994 -10.575
  557   1HB   GLN  61           HB2      GLN  61  68.481  -4.609 -10.211
  558   2HB   GLN  61           HB1      GLN  61  69.584  -4.247 -11.538
  559   1HG   GLN  61           HG2      GLN  61  71.189  -3.631  -9.459
  560   2HG   GLN  61           HG1      GLN  61  70.184  -4.861  -8.692
  561   1HE2  GLN  61          HE22      GLN  61  71.963  -7.456 -10.247
  562   2HE2  GLN  61          HE21      GLN  61  71.064  -6.915  -8.914
  563    H    LYS  62           HN       LYS  62  68.098  -0.245 -10.553
  564    HA   LYS  62           HA       LYS  62  65.695  -1.037 -12.011
  565   1HB   LYS  62           HB2      LYS  62  65.208   1.386 -12.033
  566   2HB   LYS  62           HB1      LYS  62  65.648   0.843 -10.416
  567   1HG   LYS  62           HG2      LYS  62  67.104   2.594 -10.464
  568   2HG   LYS  62           HG1      LYS  62  68.103   1.512 -11.434
  569   1HD   LYS  62           HD2      LYS  62  66.675   2.433 -13.435
  570   2HD   LYS  62           HD1      LYS  62  66.344   3.772 -12.336
  571   1HE   LYS  62           HE2      LYS  62  68.743   4.172 -12.051
  572   2HE   LYS  62           HE1      LYS  62  69.115   2.786 -13.077
  573   1HZ   LYS  62           HZ3      LYS  62  67.570   5.167 -13.948
  574   2HZ   LYS  62           HZ2      LYS  62  69.220   4.915 -14.268
  575   3HZ   LYS  62           HZ1      LYS  62  68.055   3.866 -14.923
  576    H    GLY  63           HN       GLY  63  68.914   0.035 -12.815
  577   1HA   GLY  63           HA2      GLY  63  68.606  -0.580 -15.583
  578   2HA   GLY  63           HA1      GLY  63  68.503   1.169 -15.368
  579    H    LYS  64           HN       LYS  64  70.482  -1.159 -13.553
  580    HA   LYS  64           HA       LYS  64  72.884   0.447 -14.286
  581   1HB   LYS  64           HB2      LYS  64  72.104  -1.240 -11.951
  582   2HB   LYS  64           HB1      LYS  64  73.813  -1.205 -12.384
  583   1HG   LYS  64           HG2      LYS  64  73.953   1.147 -12.087
  584   2HG   LYS  64           HG1      LYS  64  72.199   1.332 -12.096
  585   1HD   LYS  64           HD2      LYS  64  72.870   1.503  -9.803
  586   2HD   LYS  64           HD1      LYS  64  72.162  -0.103  -9.989
  587   1HE   LYS  64           HE2      LYS  64  74.156  -0.538  -8.818
  588   2HE   LYS  64           HE1      LYS  64  74.597  -0.871 -10.493
  589   1HZ   LYS  64           HZ2      LYS  64  75.240   1.614 -10.508
  590   2HZ   LYS  64           HZ1      LYS  64  75.291   1.446  -8.818
  591   3HZ   LYS  64           HZ3      LYS  64  76.295   0.490  -9.794
  592    NH1  ARG  65           NH1      ARG  65  72.499  -9.365 -15.288
  593    NH2  ARG  65           NH2      ARG  65  71.243  -9.018 -13.442
  594    H    ARG  65           HN       ARG  65  71.705  -1.444 -16.156
  595    HA   ARG  65           HA       ARG  65  73.979  -3.376 -16.353
  596   1HB   ARG  65           HB2      ARG  65  71.029  -3.851 -16.758
  597   2HB   ARG  65           HB1      ARG  65  72.232  -4.874 -17.545
  598   1HG   ARG  65           HG2      ARG  65  73.221  -4.859 -15.023
  599   2HG   ARG  65           HG1      ARG  65  71.502  -4.677 -14.674
  600   1HD   ARG  65           HD2      ARG  65  70.982  -6.670 -15.980
  601   2HD   ARG  65           HD1      ARG  65  72.671  -6.826 -16.464
  602    HE   ARG  65           HE       ARG  65  72.684  -6.837 -13.659
  603   1HH1  ARG  65          HH11      ARG  65  73.088  -9.010 -16.014
  604   2HH1  ARG  65          HH12      ARG  65  72.284 -10.341 -15.252
  605   1HH2  ARG  65          HH21      ARG  65  70.869  -8.397 -12.753
  606   2HH2  ARG  65          HH22      ARG  65  71.028  -9.994 -13.404
  607    H    SER  66           HN       SER  66  71.464  -1.566 -18.111
  608    HA   SER  66           HA       SER  66  72.704  -2.089 -20.704
  609   1HB   SER  66           HB2      SER  66  70.186  -1.428 -20.004
  610   2HB   SER  66           HB1      SER  66  70.805   0.180 -20.370
  611    HG   SER  66           HG       SER  66  69.895  -1.045 -22.180
  612    H    SER  67           HN       SER  67  74.817  -1.265 -20.593
  613    HA   SER  67           HA       SER  67  75.159   1.607 -19.909
  614   1HB   SER  67           HB2      SER  67  77.626   1.009 -20.172
  615   2HB   SER  67           HB1      SER  67  76.784   0.203 -18.851
  616    HG   SER  67           HG       SER  67  77.392  -1.571 -19.788
   
  Start of MODEL          19
 Raw file had  616 H/Q atoms
  Start of MODEL   19
    1   1H    MET   1           HT3      MET   1  42.050  15.770  19.051
    2   2H    MET   1           HT2      MET   1  42.123  14.875  20.493
    3   3H    MET   1           HT1      MET   1  42.647  14.182  19.033
    4    HA   MET   1           HA       MET   1  40.580  13.231  19.279
    5   1HB   MET   1           HB2      MET   1  38.605  14.611  20.012
    6   2HB   MET   1           HB1      MET   1  39.862  14.459  21.238
    7   1HG   MET   1           HG2      MET   1  40.269  16.755  19.443
    8   2HG   MET   1           HG1      MET   1  38.762  16.846  20.351
    9   1HE   MET   1           HE2      MET   1  39.765  19.065  21.286
   10   2HE   MET   1           HE1      MET   1  38.713  18.163  22.373
   11   3HE   MET   1           HE3      MET   1  40.182  18.927  22.993
   12    H    GLU   2           HN       GLU   2  41.113  13.253  16.962
   13    HA   GLU   2           HA       GLU   2  39.332  15.117  15.453
   14   1HB   GLU   2           HB2      GLU   2  42.192  14.340  14.836
   15   2HB   GLU   2           HB1      GLU   2  41.109  15.004  13.612
   16   1HG   GLU   2           HG2      GLU   2  41.499  16.401  16.255
   17   2HG   GLU   2           HG1      GLU   2  42.618  16.661  14.916
   18    H    THR   3           HN       THR   3  38.100  12.935  15.960
   19    HA   THR   3           HA       THR   3  38.773  10.841  13.962
   20    HB   THR   3           HB       THR   3  36.629   9.826  15.234
   21    HG1  THR   3           HG1      THR   3  36.255  11.530  16.578
   22   1HG2  THR   3          HG23      THR   3  38.927   8.870  15.095
   23   2HG2  THR   3          HG22      THR   3  39.409   9.911  16.434
   24   3HG2  THR   3          HG21      THR   3  38.197   8.654  16.686
   25    H    LEU   4           HN       LEU   4  38.110  12.389  12.219
   26    HA   LEU   4           HA       LEU   4  35.215  12.079  11.663
   27   1HB   LEU   4           HB2      LEU   4  36.571  14.606  12.262
   28   2HB   LEU   4           HB1      LEU   4  35.759  14.634  10.697
   29    HG   LEU   4           HG       LEU   4  34.396  13.650  13.211
   30   1HD1  LEU   4          HD12      LEU   4  35.199  16.073  13.341
   31   2HD1  LEU   4          HD11      LEU   4  34.113  16.405  11.992
   32   3HD1  LEU   4          HD13      LEU   4  33.462  15.828  13.527
   33   1HD2  LEU   4          HD21      LEU   4  33.468  14.540  10.465
   34   2HD2  LEU   4          HD23      LEU   4  33.333  12.927  11.165
   35   3HD2  LEU   4          HD22      LEU   4  32.372  14.255  11.817
   36    H    VAL   5           HN       VAL   5  37.996  13.787  10.221
   37    HA   VAL   5           HA       VAL   5  37.705  12.035   7.818
   38    HB   VAL   5           HB       VAL   5  38.265  15.016   7.742
   39   1HG1  VAL   5          HG13      VAL   5  39.025  13.267   5.901
   40   2HG1  VAL   5          HG12      VAL   5  37.327  13.352   5.433
   41   3HG1  VAL   5          HG11      VAL   5  38.317  14.812   5.430
   42   1HG2  VAL   5          HG21      VAL   5  35.737  13.441   7.709
   43   2HG2  VAL   5          HG23      VAL   5  36.023  15.097   8.246
   44   3HG2  VAL   5          HG22      VAL   5  35.868  14.743   6.526
   45    H    GLN   6           HN       GLN   6  39.535  10.922   8.946
   46    HA   GLN   6           HA       GLN   6  42.083  12.353   9.144
   47   1HB   GLN   6           HB2      GLN   6  41.370   9.420   9.446
   48   2HB   GLN   6           HB1      GLN   6  42.979  10.085   9.732
   49   1HG   GLN   6           HG2      GLN   6  42.218  11.412  11.560
   50   2HG   GLN   6           HG1      GLN   6  40.525  11.151  11.139
   51   1HE2  GLN   6          HE21      GLN   6  43.386   9.596  12.569
   52   2HE2  GLN   6          HE22      GLN   6  42.544   8.293  13.257
   53    H    ALA   7           HN       ALA   7  43.982  10.785   8.121
   54    HA   ALA   7           HA       ALA   7  43.930  11.301   5.326
   55   1HB   ALA   7           HB1      ALA   7  45.893  10.689   7.069
   56   2HB   ALA   7           HB3      ALA   7  45.688   9.113   6.305
   57   3HB   ALA   7           HB2      ALA   7  46.086  10.523   5.324
   58    NH1  ARG   8           NH2      ARG   8  36.218   6.575   1.868
   59    NH2  ARG   8           NH1      ARG   8  35.710   5.242   3.621
   60    H    ARG   8           HN       ARG   8  42.381  10.334   4.072
   61    HA   ARG   8           HA       ARG   8  41.646   7.530   4.503
   62   1HB   ARG   8           HB2      ARG   8  40.477   9.856   3.193
   63   2HB   ARG   8           HB1      ARG   8  40.397   8.432   2.158
   64   1HG   ARG   8           HG2      ARG   8  39.694   7.913   4.978
   65   2HG   ARG   8           HG1      ARG   8  38.595   9.016   4.151
   66   1HD   ARG   8           HD2      ARG   8  38.617   7.265   2.235
   67   2HD   ARG   8           HD1      ARG   8  39.275   6.165   3.445
   68    HE   ARG   8           HE       ARG   8  37.079   7.139   4.733
   69   1HH1  ARG   8          HH21      ARG   8  36.756   7.320   1.473
   70   2HH1  ARG   8          HH22      ARG   8  35.531   6.106   1.312
   71   1HH2  ARG   8          HH11      ARG   8  35.859   4.965   4.570
   72   2HH2  ARG   8          HH12      ARG   8  35.023   4.773   3.066
   73    H    LYS   9           HN       LYS   9  41.414   6.240   2.297
   74    HA   LYS   9           HA       LYS   9  44.088   6.280   1.051
   75   1HB   LYS   9           HB2      LYS   9  41.872   4.218   1.056
   76   2HB   LYS   9           HB1      LYS   9  43.382   4.030   0.163
   77   1HG   LYS   9           HG2      LYS   9  44.680   3.999   2.154
   78   2HG   LYS   9           HG1      LYS   9  43.345   4.618   3.126
   79   1HD   LYS   9           HD2      LYS   9  42.085   2.481   2.478
   80   2HD   LYS   9           HD1      LYS   9  43.636   1.870   1.902
   81   1HE   LYS   9           HE2      LYS   9  43.203   2.946   4.700
   82   2HE   LYS   9           HE1      LYS   9  43.085   1.236   4.287
   83   1HZ   LYS   9           HZ2      LYS   9  45.474   2.857   3.639
   84   2HZ   LYS   9           HZ1      LYS   9  45.309   2.043   5.121
   85   3HZ   LYS   9           HZ3      LYS   9  45.329   1.165   3.669
   86    NH1  ARG  10           NH2      ARG  10  36.453  11.040  -3.820
   87    NH2  ARG  10           NH1      ARG  10  35.967   8.835  -3.919
   88    H    ARG  10           HN       ARG  10  42.274   8.339   0.251
   89    HA   ARG  10           HA       ARG  10  41.105   7.521  -2.301
   90   1HB   ARG  10           HB2      ARG  10  40.035   9.227  -0.798
   91   2HB   ARG  10           HB1      ARG  10  41.381  10.309  -1.158
   92   1HG   ARG  10           HG2      ARG  10  39.702  10.923  -2.715
   93   2HG   ARG  10           HG1      ARG  10  40.808   9.904  -3.638
   94   1HD   ARG  10           HD2      ARG  10  39.353   8.013  -3.477
   95   2HD   ARG  10           HD1      ARG  10  38.353   8.802  -2.256
   96    HE   ARG  10           HE       ARG  10  38.478   9.723  -5.102
   97   1HH1  ARG  10          HH21      ARG  10  37.120  11.783  -3.873
   98   2HH1  ARG  10          HH22      ARG  10  35.491  11.243  -3.640
   99   1HH2  ARG  10          HH11      ARG  10  36.260   7.889  -4.049
  100   2HH2  ARG  10          HH12      ARG  10  35.005   9.040  -3.740
  101    H    LYS  11           HN       LYS  11  43.781   9.601  -1.199
  102    HA   LYS  11           HA       LYS  11  44.637  10.152  -3.927
  103   1HB   LYS  11           HB2      LYS  11  46.105  10.662  -1.326
  104   2HB   LYS  11           HB1      LYS  11  46.452  11.401  -2.889
  105   1HG   LYS  11           HG2      LYS  11  43.661  11.684  -1.904
  106   2HG   LYS  11           HG1      LYS  11  44.892  12.583  -1.019
  107   1HD   LYS  11           HD2      LYS  11  45.716  13.375  -3.331
  108   2HD   LYS  11           HD1      LYS  11  44.171  12.782  -3.943
  109   1HE   LYS  11           HE2      LYS  11  44.443  14.755  -1.658
  110   2HE   LYS  11           HE1      LYS  11  44.134  15.218  -3.332
  111   1HZ   LYS  11           HZ2      LYS  11  42.422  13.252  -1.946
  112   2HZ   LYS  11           HZ1      LYS  11  42.145  14.921  -1.787
  113   3HZ   LYS  11           HZ3      LYS  11  42.068  14.191  -3.317
  114    NH1  ARG  12           NH1      ARG  12  52.345  10.814  -7.349
  115    NH2  ARG  12           NH2      ARG  12  52.760   8.967  -8.585
  116    H    ARG  12           HN       ARG  12  47.262   9.819  -4.105
  117    HA   ARG  12           HA       ARG  12  47.750   6.939  -3.449
  118   1HB   ARG  12           HB2      ARG  12  48.991   6.744  -5.553
  119   2HB   ARG  12           HB1      ARG  12  47.345   7.288  -5.866
  120   1HG   ARG  12           HG2      ARG  12  48.339   8.928  -7.092
  121   2HG   ARG  12           HG1      ARG  12  48.654   9.680  -5.528
  122   1HD   ARG  12           HD2      ARG  12  50.881   9.144  -5.568
  123   2HD   ARG  12           HD1      ARG  12  50.599   7.607  -6.385
  124    HE   ARG  12           HE       ARG  12  50.046   9.379  -8.375
  125   1HH1  ARG  12          HH11      ARG  12  51.718  11.364  -6.798
  126   2HH1  ARG  12          HH12      ARG  12  53.282  11.127  -7.504
  127   1HH2  ARG  12          HH21      ARG  12  52.450   8.103  -8.981
  128   2HH2  ARG  12          HH22      ARG  12  53.697   9.280  -8.739
  129    H    THR  13           HN       THR  13  48.615   9.755  -2.291
  130    HA   THR  13           HA       THR  13  51.524   9.654  -2.557
  131    HB   THR  13           HB       THR  13  50.453  11.816  -2.199
  132    HG1  THR  13           HG1      THR  13  52.194  12.210  -1.127
  133   1HG2  THR  13          HG22      THR  13  49.310  10.431   0.224
  134   2HG2  THR  13          HG21      THR  13  49.408  12.188   0.130
  135   3HG2  THR  13          HG23      THR  13  48.451  11.294  -1.051
  136    H    SER  14           HN       SER  14  49.084   8.362  -0.416
  137    HA   SER  14           HA       SER  14  50.967   7.687   1.719
  138   1HB   SER  14           HB2      SER  14  49.080   6.683   2.802
  139   2HB   SER  14           HB1      SER  14  48.475   8.141   2.022
  140    HG   SER  14           HG       SER  14  47.088   6.650   1.327
  141    H    ILE  15           HN       ILE  15  50.204   5.036   2.282
  142    HA   ILE  15           HA       ILE  15  51.760   3.618   0.224
  143    HB   ILE  15           HB       ILE  15  50.626   2.686   2.874
  144   1HG1  ILE  15          HG12      ILE  15  52.437   4.360   3.050
  145   2HG1  ILE  15          HG11      ILE  15  52.981   2.779   3.604
  146   1HG2  ILE  15          HG22      ILE  15  52.327   1.289   0.794
  147   2HG2  ILE  15          HG21      ILE  15  52.287   0.768   2.479
  148   3HG2  ILE  15          HG23      ILE  15  50.814   0.734   1.509
  149   1HD1  ILE  15          HD12      ILE  15  53.729   2.533   1.050
  150   2HD1  ILE  15          HD11      ILE  15  53.754   4.293   1.138
  151   3HD1  ILE  15          HD13      ILE  15  54.754   3.340   2.229
  152    H    GLU  16           HN       GLU  16  50.201   3.643  -1.515
  153    HA   GLU  16           HA       GLU  16  47.584   2.450  -1.216
  154   1HB   GLU  16           HB2      GLU  16  48.522   3.999  -3.133
  155   2HB   GLU  16           HB1      GLU  16  49.112   2.483  -3.813
  156   1HG   GLU  16           HG2      GLU  16  47.061   2.186  -4.701
  157   2HG   GLU  16           HG1      GLU  16  46.467   1.923  -3.062
  158    H    ASN  17           HN       ASN  17  47.041   0.264  -1.838
  159    HA   ASN  17           HA       ASN  17  48.933  -1.712  -1.073
  160   1HB   ASN  17           HB2      ASN  17  46.242  -1.739  -1.519
  161   2HB   ASN  17           HB1      ASN  17  46.814  -2.591  -2.954
  162   1HD2  ASN  17          HD22      ASN  17  47.686  -5.516  -1.180
  163   2HD2  ASN  17          HD21      ASN  17  47.604  -4.733  -2.684
  164    NH1  ARG  18           NH1      ARG  18  47.505  -0.828 -11.251
  165    NH2  ARG  18           NH2      ARG  18  46.333   1.016 -10.672
  166    H    ARG  18           HN       ARG  18  48.451  -0.122  -4.116
  167    HA   ARG  18           HA       ARG  18  49.966  -2.170  -5.598
  168   1HB   ARG  18           HB2      ARG  18  48.347   0.207  -6.261
  169   2HB   ARG  18           HB1      ARG  18  49.790   0.032  -7.258
  170   1HG   ARG  18           HG2      ARG  18  49.097  -2.009  -8.143
  171   2HG   ARG  18           HG1      ARG  18  48.049  -2.363  -6.769
  172   1HD   ARG  18           HD2      ARG  18  46.681  -1.779  -8.713
  173   2HD   ARG  18           HD1      ARG  18  46.534  -0.523  -7.484
  174    HE   ARG  18           HE       ARG  18  48.396   0.649  -8.908
  175   1HH1  ARG  18          HH11      ARG  18  48.151  -1.554 -11.012
  176   2HH1  ARG  18          HH12      ARG  18  47.112  -0.791 -12.169
  177   1HH2  ARG  18          HH21      ARG  18  46.081   1.704  -9.991
  178   2HH2  ARG  18          HH22      ARG  18  45.939   1.055 -11.591
  179    H    VAL  19           HN       VAL  19  50.481   0.921  -4.010
  180    HA   VAL  19           HA       VAL  19  53.005   1.489  -5.247
  181    HB   VAL  19           HB       VAL  19  51.392   2.953  -3.634
  182   1HG1  VAL  19          HG13      VAL  19  53.675   2.099  -1.829
  183   2HG1  VAL  19          HG12      VAL  19  52.560   3.424  -1.517
  184   3HG1  VAL  19          HG11      VAL  19  51.964   1.765  -1.558
  185   1HG2  VAL  19          HG21      VAL  19  54.356   3.180  -4.158
  186   2HG2  VAL  19          HG23      VAL  19  53.038   3.946  -5.043
  187   3HG2  VAL  19          HG22      VAL  19  53.432   4.482  -3.409
  188    NH1  ARG  20           NH1      ARG  20  53.692  -1.719   4.469
  189    NH2  ARG  20           NH2      ARG  20  51.573  -2.493   4.335
  190    H    ARG  20           HN       ARG  20  52.118  -0.223  -2.261
  191    HA   ARG  20           HA       ARG  20  54.792  -0.726  -1.395
  192   1HB   ARG  20           HB2      ARG  20  52.482  -1.142  -0.201
  193   2HB   ARG  20           HB1      ARG  20  52.614  -2.737  -0.943
  194   1HG   ARG  20           HG2      ARG  20  54.862  -3.003   0.081
  195   2HG   ARG  20           HG1      ARG  20  54.666  -1.439   0.873
  196   1HD   ARG  20           HD2      ARG  20  52.647  -3.656   1.227
  197   2HD   ARG  20           HD1      ARG  20  54.071  -3.525   2.259
  198    HE   ARG  20           HE       ARG  20  52.270  -1.170   2.013
  199   1HH1  ARG  20          HH11      ARG  20  54.520  -1.380   4.023
  200   2HH1  ARG  20          HH12      ARG  20  53.659  -1.803   5.465
  201   1HH2  ARG  20          HH21      ARG  20  50.777  -2.748   3.787
  202   2HH2  ARG  20          HH22      ARG  20  51.542  -2.579   5.332
  203    CH2  TRP  21           CH2      TRP  21  54.899  -7.302   0.064
  204    H    TRP  21           HN       TRP  21  52.624  -2.892  -3.273
  205    HA   TRP  21           HA       TRP  21  54.883  -4.657  -3.695
  206   1HB   TRP  21           HB2      TRP  21  52.025  -4.764  -4.291
  207   2HB   TRP  21           HB1      TRP  21  53.002  -5.389  -5.627
  208    HD1  TRP  21           HD1      TRP  21  52.691  -7.981  -5.171
  209    HE1  TRP  21           HE1      TRP  21  53.499  -9.542  -3.274
  210    HE3  TRP  21           HE3      TRP  21  54.117  -4.528  -1.701
  211    HZ2  TRP  21           HZ2      TRP  21  54.628  -9.317  -0.619
  212    HZ3  TRP  21           HZ3      TRP  21  55.051  -5.186   0.462
  213    HH2  TRP  21           HH2      TRP  21  55.322  -7.596   1.014
  214    H    SER  22           HN       SER  22  54.088  -1.683  -5.030
  215    HA   SER  22           HA       SER  22  55.254  -2.142  -7.658
  216   1HB   SER  22           HB2      SER  22  53.715  -0.233  -7.337
  217   2HB   SER  22           HB1      SER  22  54.782   0.429  -6.103
  218    HG   SER  22           HG       SER  22  55.244   1.421  -8.050
  219    H    LEU  23           HN       LEU  23  56.226  -1.128  -4.411
  220    HA   LEU  23           HA       LEU  23  58.934  -0.357  -4.889
  221   1HB   LEU  23           HB2      LEU  23  57.722  -1.859  -2.532
  222   2HB   LEU  23           HB1      LEU  23  59.333  -1.190  -2.539
  223    HG   LEU  23           HG       LEU  23  57.103   0.673  -3.187
  224   1HD1  LEU  23          HD13      LEU  23  56.726  -0.963  -1.048
  225   2HD1  LEU  23          HD12      LEU  23  57.727   0.279  -0.298
  226   3HD1  LEU  23          HD11      LEU  23  56.202   0.720  -1.066
  227   1HD2  LEU  23          HD23      LEU  23  59.740   0.762  -1.690
  228   2HD2  LEU  23          HD22      LEU  23  59.318   1.602  -3.181
  229   3HD2  LEU  23          HD21      LEU  23  58.596   2.104  -1.652
  230    H    GLU  24           HN       GLU  24  57.359  -3.439  -4.231
  231    HA   GLU  24           HA       GLU  24  59.615  -5.155  -4.274
  232   1HB   GLU  24           HB2      GLU  24  57.096  -5.645  -3.775
  233   2HB   GLU  24           HB1      GLU  24  56.998  -5.981  -5.504
  234   1HG   GLU  24           HG2      GLU  24  58.376  -7.836  -5.364
  235   2HG   GLU  24           HG1      GLU  24  59.229  -7.225  -3.946
  236    H    THR  25           HN       THR  25  57.546  -4.133  -7.002
  237    HA   THR  25           HA       THR  25  58.878  -5.660  -9.002
  238    HB   THR  25           HB       THR  25  57.783  -4.216 -10.610
  239    HG1  THR  25           HG1      THR  25  56.809  -2.286  -9.883
  240   1HG2  THR  25          HG22      THR  25  56.386  -5.243  -8.251
  241   2HG2  THR  25          HG21      THR  25  55.512  -3.932  -9.041
  242   3HG2  THR  25          HG23      THR  25  55.957  -5.371  -9.956
  243    H    MET  26           HN       MET  26  59.751  -2.646  -7.449
  244    HA   MET  26           HA       MET  26  61.761  -2.010  -9.513
  245   1HB   MET  26           HB2      MET  26  60.956  -0.689  -6.916
  246   2HB   MET  26           HB1      MET  26  62.310  -0.118  -7.892
  247   1HG   MET  26           HG2      MET  26  59.635  -0.563  -9.187
  248   2HG   MET  26           HG1      MET  26  59.923   0.915  -8.270
  249   1HE   MET  26           HE3      MET  26  59.206   1.966 -10.463
  250   2HE   MET  26           HE2      MET  26  60.188   2.107 -11.920
  251   3HE   MET  26           HE1      MET  26  59.329   0.606 -11.587
  252    H    PHE  27           HN       PHE  27  61.664  -3.613  -6.398
  253    HA   PHE  27           HA       PHE  27  64.599  -3.455  -6.115
  254   1HB   PHE  27           HB2      PHE  27  62.394  -4.529  -4.354
  255   2HB   PHE  27           HB1      PHE  27  64.078  -4.949  -4.065
  256    HD1  PHE  27           HD2      PHE  27  65.792  -3.007  -3.965
  257    HD2  PHE  27           HD1      PHE  27  61.554  -2.471  -3.550
  258    HE1  PHE  27           HE2      PHE  27  66.175  -0.817  -2.865
  259    HE2  PHE  27           HE1      PHE  27  61.933  -0.285  -2.451
  260    HZ   PHE  27           HZ       PHE  27  64.243   0.540  -2.106
  261    H    LEU  28           HN       LEU  28  62.314  -5.554  -7.571
  262    HA   LEU  28           HA       LEU  28  64.009  -7.943  -7.253
  263   1HB   LEU  28           HB2      LEU  28  61.397  -7.466  -8.704
  264   2HB   LEU  28           HB1      LEU  28  62.226  -9.023  -8.658
  265    HG   LEU  28           HG       LEU  28  61.397  -7.467  -6.194
  266   1HD1  LEU  28          HD13      LEU  28  60.048  -9.672  -7.746
  267   2HD1  LEU  28          HD12      LEU  28  59.744  -9.448  -6.024
  268   3HD1  LEU  28          HD11      LEU  28  59.358  -8.158  -7.162
  269   1HD2  LEU  28          HD22      LEU  28  62.690 -10.139  -6.712
  270   2HD2  LEU  28          HD21      LEU  28  63.168  -8.882  -5.571
  271   3HD2  LEU  28          HD23      LEU  28  61.748  -9.875  -5.244
  272    H    LYS  29           HN       LYS  29  64.729  -5.398  -8.921
  273    HA   LYS  29           HA       LYS  29  65.167  -6.729 -11.542
  274   1HB   LYS  29           HB2      LYS  29  65.731  -4.502 -12.389
  275   2HB   LYS  29           HB1      LYS  29  64.190  -4.420 -11.541
  276   1HG   LYS  29           HG2      LYS  29  65.493  -3.675  -9.480
  277   2HG   LYS  29           HG1      LYS  29  66.900  -3.512 -10.530
  278   1HD   LYS  29           HD2      LYS  29  64.311  -2.202 -11.308
  279   2HD   LYS  29           HD1      LYS  29  65.354  -1.430 -10.113
  280   1HE   LYS  29           HE2      LYS  29  66.323  -2.350 -12.831
  281   2HE   LYS  29           HE1      LYS  29  65.792  -0.702 -12.491
  282   1HZ   LYS  29           HZ1      LYS  29  67.472  -0.903 -10.545
  283   2HZ   LYS  29           HZ3      LYS  29  68.153  -2.138 -11.487
  284   3HZ   LYS  29           HZ2      LYS  29  68.036  -0.562 -12.111
  285    H    CYS  30           HN       CYS  30  66.840  -5.096  -8.899
  286    HA   CYS  30           HA       CYS  30  69.278  -6.621  -9.536
  287   1HB   CYS  30           HB2      CYS  30  69.031  -3.625  -9.335
  288   2HB   CYS  30           HB1      CYS  30  70.545  -4.427  -8.917
  289    HG   CYS  30           HG       CYS  30  69.822  -3.800 -11.675
  290    HA   PRO  31           HA       PRO  31  68.971  -6.890  -5.061
  291   1HB   PRO  31           HB2      PRO  31  71.222  -8.384  -4.635
  292   2HB   PRO  31           HB1      PRO  31  69.734  -9.073  -5.309
  293   1HG   PRO  31           HG2      PRO  31  72.300  -8.457  -6.679
  294   2HG   PRO  31           HG1      PRO  31  71.042  -9.620  -7.127
  295   1HD   PRO  31           HD2      PRO  31  71.458  -7.024  -8.258
  296   2HD   PRO  31           HD1      PRO  31  70.097  -8.121  -8.574
  297    H    LYS  32           HN       LYS  32  70.811  -4.733  -6.589
  298    HA   LYS  32           HA       LYS  32  72.547  -4.206  -4.241
  299   1HB   LYS  32           HB2      LYS  32  74.136  -3.155  -5.864
  300   2HB   LYS  32           HB1      LYS  32  73.901  -4.882  -6.138
  301   1HG   LYS  32           HG2      LYS  32  72.582  -4.535  -8.045
  302   2HG   LYS  32           HG1      LYS  32  72.156  -2.892  -7.571
  303   1HD   LYS  32           HD2      LYS  32  75.018  -3.616  -8.174
  304   2HD   LYS  32           HD1      LYS  32  73.900  -3.203  -9.474
  305   1HE   LYS  32           HE2      LYS  32  73.452  -1.037  -8.483
  306   2HE   LYS  32           HE1      LYS  32  74.397  -1.451  -7.053
  307   1HZ   LYS  32           HZ3      LYS  32  75.531  -1.388  -9.791
  308   2HZ   LYS  32           HZ2      LYS  32  75.576  -0.059  -8.734
  309   3HZ   LYS  32           HZ1      LYS  32  76.376  -1.500  -8.324
  310    HA   PRO  33           HA       PRO  33  69.852  -0.473  -5.231
  311   1HB   PRO  33           HB2      PRO  33  68.367  -0.425  -2.919
  312   2HB   PRO  33           HB1      PRO  33  67.844  -1.247  -4.400
  313   1HG   PRO  33           HG2      PRO  33  68.925  -2.423  -1.878
  314   2HG   PRO  33           HG1      PRO  33  67.796  -3.122  -3.051
  315   1HD   PRO  33           HD2      PRO  33  70.535  -3.751  -2.872
  316   2HD   PRO  33           HD1      PRO  33  69.489  -4.080  -4.270
  317    H    SER  34           HN       SER  34  70.905   1.391  -4.696
  318    HA   SER  34           HA       SER  34  72.908   1.469  -2.619
  319   1HB   SER  34           HB2      SER  34  71.874   3.290  -4.701
  320   2HB   SER  34           HB1      SER  34  72.562   4.076  -3.284
  321    HG   SER  34           HG       SER  34  73.774   2.136  -4.967
  322    H    LEU  35           HN       LEU  35  72.896   2.631  -0.674
  323    HA   LEU  35           HA       LEU  35  70.416   2.754   0.769
  324   1HB   LEU  35           HB2      LEU  35  73.107   4.071   1.257
  325   2HB   LEU  35           HB1      LEU  35  71.766   4.137   2.404
  326    HG   LEU  35           HG       LEU  35  71.858   1.463   1.812
  327   1HD1  LEU  35          HD12      LEU  35  74.636   2.615   1.616
  328   2HD1  LEU  35          HD11      LEU  35  74.377   0.973   2.205
  329   3HD1  LEU  35          HD13      LEU  35  73.862   1.417   0.578
  330   1HD2  LEU  35          HD23      LEU  35  72.027   3.002   4.039
  331   2HD2  LEU  35          HD22      LEU  35  72.282   1.257   4.056
  332   3HD2  LEU  35          HD21      LEU  35  73.665   2.351   3.998
  333    H    GLN  36           HN       GLN  36  72.143   4.933  -1.307
  334    HA   GLN  36           HA       GLN  36  70.677   7.354  -0.619
  335   1HB   GLN  36           HB2      GLN  36  72.898   7.226  -1.897
  336   2HB   GLN  36           HB1      GLN  36  71.955   6.698  -3.292
  337   1HG   GLN  36           HG2      GLN  36  70.881   8.753  -3.515
  338   2HG   GLN  36           HG1      GLN  36  71.131   9.182  -1.822
  339   1HE2  GLN  36          HE22      GLN  36  73.837  10.348  -4.558
  340   2HE2  GLN  36          HE21      GLN  36  72.344   9.658  -4.979
  341    H    GLN  37           HN       GLN  37  70.348   4.713  -2.921
  342    HA   GLN  37           HA       GLN  37  68.070   5.699  -4.344
  343   1HB   GLN  37           HB2      GLN  37  69.616   3.673  -4.882
  344   2HB   GLN  37           HB1      GLN  37  68.553   2.772  -3.800
  345   1HG   GLN  37           HG2      GLN  37  66.773   2.869  -5.242
  346   2HG   GLN  37           HG1      GLN  37  67.220   4.463  -5.851
  347   1HE2  GLN  37          HE22      GLN  37  68.966   1.142  -7.549
  348   2HE2  GLN  37          HE21      GLN  37  68.336   1.032  -5.976
  349    H    ILE  38           HN       ILE  38  68.462   4.100  -1.223
  350    HA   ILE  38           HA       ILE  38  65.652   3.472  -0.927
  351    HB   ILE  38           HB       ILE  38  67.899   3.616   1.106
  352   1HG1  ILE  38          HG12      ILE  38  67.984   1.747  -0.506
  353   2HG1  ILE  38          HG11      ILE  38  67.590   1.153   1.106
  354   1HG2  ILE  38          HG21      ILE  38  65.017   3.642   1.542
  355   2HG2  ILE  38          HG23      ILE  38  65.711   2.144   2.163
  356   3HG2  ILE  38          HG22      ILE  38  66.312   3.699   2.736
  357   1HD1  ILE  38          HD13      ILE  38  65.095   1.748  -0.007
  358   2HD1  ILE  38          HD12      ILE  38  65.998   1.044  -1.347
  359   3HD1  ILE  38          HD11      ILE  38  65.797   0.137   0.151
  360    H    THR  39           HN       THR  39  67.708   6.221  -0.297
  361    HA   THR  39           HA       THR  39  65.891   7.718   1.359
  362    HB   THR  39           HB       THR  39  67.638   9.130  -0.620
  363    HG1  THR  39           HG1      THR  39  68.583   7.614   1.582
  364   1HG2  THR  39          HG23      THR  39  66.815   9.423   2.257
  365   2HG2  THR  39          HG22      THR  39  68.241  10.266   1.652
  366   3HG2  THR  39          HG21      THR  39  66.660  10.580   0.936
  367    H    HIS  40           HN       HIS  40  66.411   7.523  -2.140
  368    HA   HIS  40           HA       HIS  40  64.265   9.356  -2.832
  369   1HB   HIS  40           HB2      HIS  40  66.053   7.470  -4.302
  370   2HB   HIS  40           HB1      HIS  40  64.550   7.947  -5.091
  371    HD1  HIS  40           HD1      HIS  40  64.977   9.874  -6.601
  372    HD2  HIS  40           HD2      HIS  40  67.242  10.144  -3.113
  373    HE1  HIS  40           HE1      HIS  40  66.265  12.049  -6.752
  374    H    ILE  41           HN       ILE  41  64.436   5.997  -1.963
  375    HA   ILE  41           HA       ILE  41  62.000   5.121  -3.220
  376    HB   ILE  41           HB       ILE  41  64.034   4.077  -1.444
  377   1HG1  ILE  41          HG12      ILE  41  62.603   1.917  -2.458
  378   2HG1  ILE  41          HG11      ILE  41  62.317   3.194  -3.639
  379   1HG2  ILE  41          HG23      ILE  41  61.196   3.417  -0.682
  380   2HG2  ILE  41          HG22      ILE  41  62.542   2.330  -0.340
  381   3HG2  ILE  41          HG21      ILE  41  62.512   3.946   0.368
  382   1HD1  ILE  41          HD11      ILE  41  65.097   2.617  -2.616
  383   2HD1  ILE  41          HD13      ILE  41  64.411   1.702  -3.957
  384   3HD1  ILE  41          HD12      ILE  41  64.624   3.447  -4.098
  385    H    ALA  42           HN       ALA  42  62.777   6.335   0.037
  386    HA   ALA  42           HA       ALA  42  60.127   6.218   1.064
  387   1HB   ALA  42           HB3      ALA  42  62.673   7.076   1.985
  388   2HB   ALA  42           HB2      ALA  42  61.565   8.428   2.222
  389   3HB   ALA  42           HB1      ALA  42  61.206   6.857   2.938
  390    H    ASN  43           HN       ASN  43  61.931   8.965  -0.304
  391    HA   ASN  43           HA       ASN  43  59.684  10.746  -0.346
  392   1HB   ASN  43           HB2      ASN  43  62.389  10.654  -1.564
  393   2HB   ASN  43           HB1      ASN  43  61.198  11.627  -2.426
  394   1HD2  ASN  43          HD22      ASN  43  60.791  13.945   0.333
  395   2HD2  ASN  43          HD21      ASN  43  59.901  13.189  -0.899
  396    H    GLN  44           HN       GLN  44  60.511   7.975  -2.235
  397    HA   GLN  44           HA       GLN  44  59.081   8.712  -4.631
  398   1HB   GLN  44           HB2      GLN  44  60.562   6.381  -3.644
  399   2HB   GLN  44           HB1      GLN  44  59.210   5.973  -4.688
  400   1HG   GLN  44           HG2      GLN  44  61.346   8.008  -5.390
  401   2HG   GLN  44           HG1      GLN  44  61.384   6.323  -5.909
  402   1HE2  GLN  44          HE22      GLN  44  59.754   7.871  -8.754
  403   2HE2  GLN  44          HE21      GLN  44  61.300   7.563  -8.124
  404    H    LEU  45           HN       LEU  45  58.216   7.038  -1.635
  405    HA   LEU  45           HA       LEU  45  55.415   7.016  -2.663
  406   1HB   LEU  45           HB2      LEU  45  54.965   4.872  -1.797
  407   2HB   LEU  45           HB1      LEU  45  56.540   4.721  -2.559
  408    HG   LEU  45           HG       LEU  45  56.214   5.260   0.391
  409   1HD1  LEU  45          HD13      LEU  45  55.216   3.037  -0.713
  410   2HD1  LEU  45          HD12      LEU  45  56.913   2.562  -0.677
  411   3HD1  LEU  45          HD11      LEU  45  56.086   2.993   0.814
  412   1HD2  LEU  45          HD23      LEU  45  58.416   4.601  -1.517
  413   2HD2  LEU  45          HD22      LEU  45  58.416   5.733  -0.164
  414   3HD2  LEU  45          HD21      LEU  45  58.532   4.000   0.136
  415    H    GLY  46           HN       GLY  46  57.041   8.824  -0.802
  416   1HA   GLY  46           HA2      GLY  46  56.648  10.091   1.115
  417   2HA   GLY  46           HA1      GLY  46  54.954   9.773   0.781
  418    H    LEU  47           HN       LEU  47  57.081   7.074   1.584
  419    HA   LEU  47           HA       LEU  47  55.583   6.857   4.153
  420   1HB   LEU  47           HB2      LEU  47  55.617   4.584   3.963
  421   2HB   LEU  47           HB1      LEU  47  55.920   4.917   2.272
  422    HG   LEU  47           HG       LEU  47  57.951   4.224   4.389
  423   1HD1  LEU  47          HD13      LEU  47  56.398   2.536   2.958
  424   2HD1  LEU  47          HD12      LEU  47  57.746   2.729   1.840
  425   3HD1  LEU  47          HD11      LEU  47  58.035   2.133   3.472
  426   1HD2  LEU  47          HD22      LEU  47  58.269   5.593   1.823
  427   2HD2  LEU  47          HD21      LEU  47  59.399   5.454   3.162
  428   3HD2  LEU  47          HD23      LEU  47  59.278   4.163   1.971
  429    H    GLU  48           HN       GLU  48  57.083   5.636   5.887
  430    HA   GLU  48           HA       GLU  48  59.389   7.447   6.290
  431   1HB   GLU  48           HB2      GLU  48  59.470   6.342   8.553
  432   2HB   GLU  48           HB1      GLU  48  57.951   7.167   8.213
  433   1HG   GLU  48           HG2      GLU  48  57.958   4.376   7.317
  434   2HG   GLU  48           HG1      GLU  48  58.202   4.537   9.055
  435    H    LYS  49           HN       LYS  49  61.306   6.168   7.471
  436    HA   LYS  49           HA       LYS  49  62.192   4.142   5.527
  437   1HB   LYS  49           HB2      LYS  49  63.663   6.003   6.509
  438   2HB   LYS  49           HB1      LYS  49  63.690   5.042   7.988
  439   1HG   LYS  49           HG2      LYS  49  64.260   3.166   6.023
  440   2HG   LYS  49           HG1      LYS  49  65.104   4.605   5.451
  441   1HD   LYS  49           HD2      LYS  49  65.980   4.813   7.880
  442   2HD   LYS  49           HD1      LYS  49  65.461   3.137   8.061
  443   1HE   LYS  49           HE2      LYS  49  66.816   2.622   5.966
  444   2HE   LYS  49           HE1      LYS  49  67.501   4.239   6.118
  445   1HZ   LYS  49           HZ3      LYS  49  68.022   3.541   8.500
  446   2HZ   LYS  49           HZ2      LYS  49  67.748   1.951   7.968
  447   3HZ   LYS  49           HZ1      LYS  49  68.980   2.885   7.264
  448    H    ASP  50           HN       ASP  50  60.359   4.059   8.346
  449    HA   ASP  50           HA       ASP  50  61.517   1.593   9.430
  450   1HB   ASP  50           HB2      ASP  50  59.625   3.628  10.313
  451   2HB   ASP  50           HB1      ASP  50  58.999   2.007  10.609
  452    H    VAL  51           HN       VAL  51  58.625   2.547   7.537
  453    HA   VAL  51           HA       VAL  51  57.705  -0.250   7.512
  454    HB   VAL  51           HB       VAL  51  56.026   1.557   7.519
  455   1HG1  VAL  51          HG11      VAL  51  57.726   2.581   5.383
  456   2HG1  VAL  51          HG13      VAL  51  56.030   2.539   4.908
  457   3HG1  VAL  51          HG12      VAL  51  56.520   3.422   6.351
  458   1HG2  VAL  51          HG22      VAL  51  55.677  -0.673   6.301
  459   2HG2  VAL  51          HG21      VAL  51  54.603   0.647   5.836
  460   3HG2  VAL  51          HG23      VAL  51  55.969   0.218   4.807
  461    H    VAL  52           HN       VAL  52  59.636   1.924   5.583
  462    HA   VAL  52           HA       VAL  52  59.535   0.278   3.185
  463    HB   VAL  52           HB       VAL  52  60.278   2.883   3.702
  464   1HG1  VAL  52          HG12      VAL  52  62.455   2.188   4.655
  465   2HG1  VAL  52          HG11      VAL  52  62.859   1.423   3.118
  466   3HG1  VAL  52          HG13      VAL  52  62.632   3.171   3.202
  467   1HG2  VAL  52          HG23      VAL  52  59.581   1.694   1.549
  468   2HG2  VAL  52          HG22      VAL  52  60.727   3.021   1.378
  469   3HG2  VAL  52          HG21      VAL  52  61.295   1.355   1.306
  470    NH1  ARG  53           NH1      ARG  53  64.824  -3.231  10.847
  471    NH2  ARG  53           NH2      ARG  53  66.235  -1.552  11.396
  472    H    ARG  53           HN       ARG  53  61.638   0.540   6.019
  473    HA   ARG  53           HA       ARG  53  63.619  -1.323   4.955
  474   1HB   ARG  53           HB2      ARG  53  63.946   0.538   6.735
  475   2HB   ARG  53           HB1      ARG  53  63.296  -0.643   7.872
  476   1HG   ARG  53           HG2      ARG  53  65.379  -1.707   6.069
  477   2HG   ARG  53           HG1      ARG  53  65.945  -0.449   7.166
  478   1HD   ARG  53           HD2      ARG  53  64.371  -2.885   8.046
  479   2HD   ARG  53           HD1      ARG  53  66.128  -2.758   8.126
  480    HE   ARG  53           HE       ARG  53  64.799  -0.543   9.460
  481   1HH1  ARG  53          HH11      ARG  53  64.171  -3.640  10.209
  482   2HH1  ARG  53          HH12      ARG  53  65.047  -3.698  11.703
  483   1HH2  ARG  53          HH21      ARG  53  66.663  -0.675  11.178
  484   2HH2  ARG  53          HH22      ARG  53  66.458  -2.020  12.251
  485    H    VAL  54           HN       VAL  54  60.767  -1.569   7.047
  486    HA   VAL  54           HA       VAL  54  61.304  -4.262   7.948
  487    HB   VAL  54           HB       VAL  54  58.682  -2.743   7.703
  488   1HG1  VAL  54          HG11      VAL  54  59.370  -5.387   9.013
  489   2HG1  VAL  54          HG13      VAL  54  57.946  -4.448   9.461
  490   3HG1  VAL  54          HG12      VAL  54  58.112  -5.069   7.819
  491   1HG2  VAL  54          HG23      VAL  54  60.749  -2.108   9.295
  492   2HG2  VAL  54          HG22      VAL  54  59.076  -1.944   9.826
  493   3HG2  VAL  54          HG21      VAL  54  60.015  -3.360  10.298
  494    CH2  TRP  55           CH2      TRP  55  60.303  -4.212  -2.028
  495    H    TRP  55           HN       TRP  55  59.344  -2.958   5.238
  496    HA   TRP  55           HA       TRP  55  58.540  -5.549   4.294
  497   1HB   TRP  55           HB2      TRP  55  57.303  -3.691   3.417
  498   2HB   TRP  55           HB1      TRP  55  58.769  -2.858   2.911
  499    HD1  TRP  55           HD1      TRP  55  56.592  -5.925   1.940
  500    HE1  TRP  55           HE1      TRP  55  57.141  -6.534  -0.502
  501    HE3  TRP  55           HE3      TRP  55  60.427  -2.668   1.005
  502    HZ2  TRP  55           HZ2      TRP  55  58.927  -5.776  -2.552
  503    HZ3  TRP  55           HZ3      TRP  55  61.545  -2.670  -1.204
  504    HH2  TRP  55           HH2      TRP  55  60.789  -4.200  -2.992
  505    H    PHE  56           HN       PHE  56  61.380  -3.481   3.573
  506    HA   PHE  56           HA       PHE  56  62.346  -5.475   1.689
  507   1HB   PHE  56           HB2      PHE  56  62.825  -2.823   1.800
  508   2HB   PHE  56           HB1      PHE  56  64.262  -3.418   2.634
  509    HD1  PHE  56           HD2      PHE  56  62.260  -4.914  -0.160
  510    HD2  PHE  56           HD1      PHE  56  66.056  -3.346   1.077
  511    HE1  PHE  56           HE2      PHE  56  63.222  -5.581  -2.320
  512    HE2  PHE  56           HE1      PHE  56  67.029  -4.036  -1.102
  513    HZ   PHE  56           HZ       PHE  56  65.587  -5.166  -2.791
  514    H    CYS  57           HN       CYS  57  62.357  -5.408   5.012
  515    HA   CYS  57           HA       CYS  57  65.004  -6.584   5.390
  516   1HB   CYS  57           HB2      CYS  57  63.198  -5.498   7.138
  517   2HB   CYS  57           HB1      CYS  57  62.846  -7.214   7.341
  518    HG   CYS  57           HG       CYS  57  64.797  -7.001   8.916
  519    H    ASN  58           HN       ASN  58  61.697  -7.632   4.826
  520    HA   ASN  58           HA       ASN  58  62.392 -10.487   4.927
  521   1HB   ASN  58           HB2      ASN  58  60.110  -9.511   5.545
  522   2HB   ASN  58           HB1      ASN  58  59.863  -9.244   3.819
  523   1HD2  ASN  58          HD22      ASN  58  59.318 -12.677   3.087
  524   2HD2  ASN  58          HD21      ASN  58  59.589 -11.131   2.440
  525    NH1  ARG  59           NH1      ARG  59  65.056  -8.225  -2.834
  526    NH2  ARG  59           NH2      ARG  59  63.975 -10.076  -3.549
  527    H    ARG  59           HN       ARG  59  61.871  -7.957   2.488
  528    HA   ARG  59           HA       ARG  59  61.936  -9.732   0.215
  529   1HB   ARG  59           HB2      ARG  59  61.638  -6.908   0.609
  530   2HB   ARG  59           HB1      ARG  59  62.976  -7.127  -0.510
  531   1HG   ARG  59           HG2      ARG  59  60.192  -8.272  -0.807
  532   2HG   ARG  59           HG1      ARG  59  60.887  -6.948  -1.734
  533   1HD   ARG  59           HD2      ARG  59  62.075  -9.737  -1.704
  534   2HD   ARG  59           HD1      ARG  59  60.923  -9.186  -2.915
  535    HE   ARG  59           HE       ARG  59  62.670  -7.342  -3.383
  536   1HH1  ARG  59          HH11      ARG  59  65.033  -7.280  -2.507
  537   2HH1  ARG  59          HH12      ARG  59  65.932  -8.696  -2.939
  538   1HH2  ARG  59          HH21      ARG  59  63.123 -10.550  -3.771
  539   2HH2  ARG  59          HH22      ARG  59  64.851 -10.548  -3.655
  540    NH1  ARG  60           NH2      ARG  60  69.258  -4.956   4.787
  541    NH2  ARG  60           NH1      ARG  60  70.575  -3.944   3.254
  542    H    ARG  60           HN       ARG  60  64.379  -8.402   2.308
  543    HA   ARG  60           HA       ARG  60  66.572  -8.958   0.419
  544   1HB   ARG  60           HB2      ARG  60  66.320  -7.800   3.170
  545   2HB   ARG  60           HB1      ARG  60  67.870  -8.498   2.701
  546   1HG   ARG  60           HG2      ARG  60  68.123  -6.992   0.883
  547   2HG   ARG  60           HG1      ARG  60  66.427  -6.510   0.945
  548   1HD   ARG  60           HD2      ARG  60  67.239  -4.730   2.120
  549   2HD   ARG  60           HD1      ARG  60  67.219  -5.862   3.471
  550    HE   ARG  60           HE       ARG  60  69.698  -6.029   1.979
  551   1HH1  ARG  60          HH21      ARG  60  68.551  -5.625   5.013
  552   2HH1  ARG  60          HH22      ARG  60  69.665  -4.394   5.507
  553   1HH2  ARG  60          HH11      ARG  60  70.876  -3.837   2.306
  554   2HH2  ARG  60          HH12      ARG  60  70.982  -3.382   3.974
  555    H    GLN  61           HN       GLN  61  64.952 -10.426   3.168
  556    HA   GLN  61           HA       GLN  61  66.839 -12.741   3.011
  557   1HB   GLN  61           HB2      GLN  61  64.995 -12.016   5.307
  558   2HB   GLN  61           HB1      GLN  61  66.273 -13.230   5.313
  559   1HG   GLN  61           HG2      GLN  61  66.730 -10.262   4.891
  560   2HG   GLN  61           HG1      GLN  61  66.956 -11.098   6.427
  561   1HE2  GLN  61          HE22      GLN  61  69.725 -13.093   4.962
  562   2HE2  GLN  61          HE21      GLN  61  68.259 -13.425   5.750
  563    H    LYS  62           HN       LYS  62  65.108 -12.925   1.033
  564    HA   LYS  62           HA       LYS  62  62.557 -14.119   1.803
  565   1HB   LYS  62           HB2      LYS  62  64.030 -13.723  -0.794
  566   2HB   LYS  62           HB1      LYS  62  62.611 -14.767  -0.726
  567   1HG   LYS  62           HG2      LYS  62  61.569 -12.688   0.561
  568   2HG   LYS  62           HG1      LYS  62  62.808 -11.808  -0.335
  569   1HD   LYS  62           HD2      LYS  62  60.854 -11.805  -1.722
  570   2HD   LYS  62           HD1      LYS  62  61.959 -12.985  -2.428
  571   1HE   LYS  62           HE2      LYS  62  60.679 -14.796  -1.755
  572   2HE   LYS  62           HE1      LYS  62  59.991 -13.931  -0.381
  573   1HZ   LYS  62           HZ2      LYS  62  59.376 -13.326  -3.221
  574   2HZ   LYS  62           HZ1      LYS  62  58.402 -14.289  -2.216
  575   3HZ   LYS  62           HZ3      LYS  62  58.633 -12.648  -1.852
  576    H    GLY  63           HN       GLY  63  65.797 -15.263   1.131
  577   1HA   GLY  63           HA2      GLY  63  65.766 -17.679   2.352
  578   2HA   GLY  63           HA1      GLY  63  64.934 -18.063   0.843
  579    H    LYS  64           HN       LYS  64  67.756 -16.010   1.641
  580    HA   LYS  64           HA       LYS  64  69.287 -17.521  -0.441
  581   1HB   LYS  64           HB2      LYS  64  69.391 -14.582   0.295
  582   2HB   LYS  64           HB1      LYS  64  70.568 -15.370  -0.757
  583   1HG   LYS  64           HG2      LYS  64  68.483 -16.176  -2.096
  584   2HG   LYS  64           HG1      LYS  64  67.635 -14.885  -1.243
  585   1HD   LYS  64           HD2      LYS  64  69.028 -13.203  -2.175
  586   2HD   LYS  64           HD1      LYS  64  70.231 -14.381  -2.703
  587   1HE   LYS  64           HE2      LYS  64  68.817 -13.541  -4.583
  588   2HE   LYS  64           HE1      LYS  64  68.683 -15.285  -4.356
  589   1HZ   LYS  64           HZ3      LYS  64  66.805 -13.401  -3.067
  590   2HZ   LYS  64           HZ2      LYS  64  66.543 -13.981  -4.643
  591   3HZ   LYS  64           HZ1      LYS  64  66.613 -15.064  -3.336
  592    NH1  ARG  65           NH2      ARG  65  75.480 -16.580   6.921
  593    NH2  ARG  65           NH1      ARG  65  76.269 -15.539   5.075
  594    H    ARG  65           HN       ARG  65  69.107 -18.082   2.441
  595    HA   ARG  65           HA       ARG  65  72.009 -17.850   3.065
  596   1HB   ARG  65           HB2      ARG  65  69.781 -16.632   4.539
  597   2HB   ARG  65           HB1      ARG  65  70.784 -17.658   5.560
  598   1HG   ARG  65           HG2      ARG  65  72.267 -15.877   3.713
  599   2HG   ARG  65           HG1      ARG  65  71.374 -15.062   4.997
  600   1HD   ARG  65           HD2      ARG  65  72.513 -16.324   6.700
  601   2HD   ARG  65           HD1      ARG  65  73.243 -17.390   5.500
  602    HE   ARG  65           HE       ARG  65  73.918 -14.525   5.271
  603   1HH1  ARG  65          HH21      ARG  65  74.716 -16.822   7.519
  604   2HH1  ARG  65          HH22      ARG  65  76.404 -16.895   7.139
  605   1HH2  ARG  65          HH11      ARG  65  76.109 -14.983   4.259
  606   2HH2  ARG  65          HH12      ARG  65  77.193 -15.852   5.293
  607    H    SER  66           HN       SER  66  70.885 -20.102   1.983
  608    HA   SER  66           HA       SER  66  70.485 -21.936   4.310
  609   1HB   SER  66           HB2      SER  66  69.518 -21.993   1.464
  610   2HB   SER  66           HB1      SER  66  69.669 -23.497   2.371
  611    HG   SER  66           HG       SER  66  67.614 -22.640   2.677
  612    H    SER  67           HN       SER  67  72.388 -21.309   1.423
  613    HA   SER  67           HA       SER  67  74.453 -23.167   2.401
  614   1HB   SER  67           HB2      SER  67  72.724 -24.347   0.779
  615   2HB   SER  67           HB1      SER  67  73.645 -23.508  -0.467
  616    HG   SER  67           HG       SER  67  75.512 -24.510   0.321
   
  Start of MODEL          20
 Raw file had  616 H/Q atoms
  Start of MODEL   20
    1   1H    MET   1           HT2      MET   1  70.799  15.806  -0.467
    2   2H    MET   1           HT1      MET   1  72.243  16.524  -1.000
    3   3H    MET   1           HT3      MET   1  71.113  15.956  -2.130
    4    HA   MET   1           HA       MET   1  72.678  14.279  -2.146
    5   1HB   MET   1           HB2      MET   1  72.813  14.736   0.849
    6   2HB   MET   1           HB1      MET   1  73.636  13.410   0.025
    7   1HG   MET   1           HG2      MET   1  74.543  15.359  -1.520
    8   2HG   MET   1           HG1      MET   1  74.182  16.353  -0.108
    9   1HE   MET   1           HE2      MET   1  74.753  15.350   2.352
   10   2HE   MET   1           HE1      MET   1  76.497  15.368   2.598
   11   3HE   MET   1           HE3      MET   1  75.705  16.706   1.753
   12    H    GLU   2           HN       GLU   2  71.111  12.858  -2.861
   13    HA   GLU   2           HA       GLU   2  69.748  11.236  -0.784
   14   1HB   GLU   2           HB2      GLU   2  67.602  11.369  -2.060
   15   2HB   GLU   2           HB1      GLU   2  68.083  12.917  -1.366
   16   1HG   GLU   2           HG2      GLU   2  69.321  13.094  -3.768
   17   2HG   GLU   2           HG1      GLU   2  67.952  12.075  -4.213
   18    H    THR   3           HN       THR   3  71.978  10.601  -2.468
   19    HA   THR   3           HA       THR   3  70.776   8.729  -4.455
   20    HB   THR   3           HB       THR   3  73.417   8.587  -4.981
   21    HG1  THR   3           HG1      THR   3  73.930  10.073  -3.339
   22   1HG2  THR   3          HG22      THR   3  71.346   9.384  -6.367
   23   2HG2  THR   3          HG21      THR   3  71.915  11.001  -5.953
   24   3HG2  THR   3          HG23      THR   3  72.958   9.904  -6.858
   25    H    LEU   4           HN       LEU   4  72.284   6.664  -4.661
   26    HA   LEU   4           HA       LEU   4  73.181   5.736  -1.983
   27   1HB   LEU   4           HB2      LEU   4  71.022   4.481  -3.682
   28   2HB   LEU   4           HB1      LEU   4  71.938   3.535  -2.507
   29    HG   LEU   4           HG       LEU   4  70.588   6.125  -1.743
   30   1HD1  LEU   4          HD13      LEU   4  69.443   3.316  -1.693
   31   2HD1  LEU   4          HD12      LEU   4  68.722   4.706  -0.881
   32   3HD1  LEU   4          HD11      LEU   4  68.840   4.676  -2.640
   33   1HD2  LEU   4          HD22      LEU   4  72.419   4.756  -0.386
   34   2HD2  LEU   4          HD21      LEU   4  71.036   5.472   0.441
   35   3HD2  LEU   4          HD23      LEU   4  71.030   3.755   0.039
   36    H    VAL   5           HN       VAL   5  73.996   3.284  -2.395
   37    HA   VAL   5           HA       VAL   5  75.379   3.101  -5.015
   38    HB   VAL   5           HB       VAL   5  76.824   2.917  -2.354
   39   1HG1  VAL   5          HG11      VAL   5  77.716   1.459  -4.168
   40   2HG1  VAL   5          HG13      VAL   5  77.870   2.879  -5.204
   41   3HG1  VAL   5          HG12      VAL   5  78.840   2.748  -3.737
   42   1HG2  VAL   5          HG21      VAL   5  76.582   5.098  -4.422
   43   2HG2  VAL   5          HG23      VAL   5  76.442   5.221  -2.668
   44   3HG2  VAL   5          HG22      VAL   5  78.022   4.973  -3.411
   45    H    GLN   6           HN       GLN   6  74.847   1.572  -1.846
   46    HA   GLN   6           HA       GLN   6  74.522  -1.031  -3.273
   47   1HB   GLN   6           HB2      GLN   6  76.074  -0.461  -0.739
   48   2HB   GLN   6           HB1      GLN   6  75.534  -2.084  -1.172
   49   1HG   GLN   6           HG2      GLN   6  77.192  -0.335  -3.006
   50   2HG   GLN   6           HG1      GLN   6  77.886  -1.537  -1.918
   51   1HE2  GLN   6          HE22      GLN   6  76.492  -4.321  -3.784
   52   2HE2  GLN   6          HE21      GLN   6  76.815  -3.837  -2.189
   53    H    ALA   7           HN       ALA   7  73.433  -2.651  -1.632
   54    HA   ALA   7           HA       ALA   7  70.872  -1.591  -0.948
   55   1HB   ALA   7           HB1      ALA   7  71.529  -4.033  -1.460
   56   2HB   ALA   7           HB3      ALA   7  72.033  -4.119   0.228
   57   3HB   ALA   7           HB2      ALA   7  70.351  -3.772  -0.174
   58    NH1  ARG   8           NH1      ARG   8  69.351   2.309   7.679
   59    NH2  ARG   8           NH2      ARG   8  69.698   4.026   6.253
   60    H    ARG   8           HN       ARG   8  70.369  -2.696   1.622
   61    HA   ARG   8           HA       ARG   8  72.223  -1.329   3.454
   62   1HB   ARG   8           HB2      ARG   8  69.970  -0.003   2.577
   63   2HB   ARG   8           HB1      ARG   8  69.399  -0.755   4.066
   64   1HG   ARG   8           HG2      ARG   8  71.106   0.301   5.367
   65   2HG   ARG   8           HG1      ARG   8  71.986   0.807   3.924
   66   1HD   ARG   8           HD2      ARG   8  70.890   2.783   4.411
   67   2HD   ARG   8           HD1      ARG   8  69.676   2.022   3.381
   68    HE   ARG   8           HE       ARG   8  68.460   1.373   5.429
   69   1HH1  ARG   8          HH11      ARG   8  69.144   1.344   7.839
   70   2HH1  ARG   8          HH12      ARG   8  69.496   2.924   8.454
   71   1HH2  ARG   8          HH21      ARG   8  69.758   4.378   5.319
   72   2HH2  ARG   8          HH22      ARG   8  69.843   4.640   7.028
   73    H    LYS   9           HN       LYS   9  70.509  -1.562   5.739
   74    HA   LYS   9           HA       LYS   9  70.809  -4.409   6.248
   75   1HB   LYS   9           HB2      LYS   9  70.176  -1.984   7.845
   76   2HB   LYS   9           HB1      LYS   9  69.553  -3.515   8.461
   77   1HG   LYS   9           HG2      LYS   9  71.854  -4.479   8.258
   78   2HG   LYS   9           HG1      LYS   9  72.442  -2.882   7.792
   79   1HD   LYS   9           HD2      LYS   9  70.973  -3.453  10.381
   80   2HD   LYS   9           HD1      LYS   9  72.730  -3.385  10.240
   81   1HE   LYS   9           HE2      LYS   9  70.813  -1.133   9.565
   82   2HE   LYS   9           HE1      LYS   9  71.840  -1.217  10.996
   83   1HZ   LYS   9           HZ1      LYS   9  73.736  -1.470   9.326
   84   2HZ   LYS   9           HZ3      LYS   9  72.636  -0.888   8.173
   85   3HZ   LYS   9           HZ2      LYS   9  73.047   0.072   9.513
   86    NH1  ARG  10           NH2      ARG  10  67.473 -10.394   3.082
   87    NH2  ARG  10           NH1      ARG  10  67.595 -10.104   0.843
   88    H    ARG  10           HN       ARG  10  69.259  -5.416   4.879
   89    HA   ARG  10           HA       ARG  10  66.419  -4.778   5.430
   90   1HB   ARG  10           HB2      ARG  10  65.966  -6.068   3.333
   91   2HB   ARG  10           HB1      ARG  10  66.995  -4.660   3.066
   92   1HG   ARG  10           HG2      ARG  10  68.886  -5.938   2.686
   93   2HG   ARG  10           HG1      ARG  10  68.321  -7.264   3.704
   94   1HD   ARG  10           HD2      ARG  10  66.844  -6.602   1.173
   95   2HD   ARG  10           HD1      ARG  10  68.323  -7.560   1.096
   96    HE   ARG  10           HE       ARG  10  65.834  -8.377   2.524
   97   1HH1  ARG  10          HH21      ARG  10  67.222 -10.051   3.987
   98   2HH1  ARG  10          HH22      ARG  10  67.880 -11.302   2.987
   99   1HH2  ARG  10          HH11      ARG  10  67.437  -9.540   0.033
  100   2HH2  ARG  10          HH12      ARG  10  68.004 -11.012   0.748
  101    H    LYS  11           HN       LYS  11  67.644  -6.161   7.446
  102    HA   LYS  11           HA       LYS  11  67.389  -9.032   7.077
  103   1HB   LYS  11           HB2      LYS  11  67.842  -9.115   9.531
  104   2HB   LYS  11           HB1      LYS  11  69.044  -8.175   8.649
  105   1HG   LYS  11           HG2      LYS  11  66.962  -6.367   9.338
  106   2HG   LYS  11           HG1      LYS  11  67.295  -7.320  10.782
  107   1HD   LYS  11           HD2      LYS  11  69.481  -6.019   9.141
  108   2HD   LYS  11           HD1      LYS  11  68.706  -5.217  10.506
  109   1HE   LYS  11           HE2      LYS  11  69.314  -7.647  11.605
  110   2HE   LYS  11           HE1      LYS  11  70.659  -7.434  10.485
  111   1HZ   LYS  11           HZ3      LYS  11  71.002  -5.211  11.443
  112   2HZ   LYS  11           HZ2      LYS  11  69.781  -5.524  12.582
  113   3HZ   LYS  11           HZ1      LYS  11  71.207  -6.448  12.584
  114    NH1  ARG  12           NH2      ARG  12  63.426 -15.687  11.777
  115    NH2  ARG  12           NH1      ARG  12  65.143 -15.027  13.090
  116    H    ARG  12           HN       ARG  12  66.067  -9.958   9.285
  117    HA   ARG  12           HA       ARG  12  63.290  -8.961   8.821
  118   1HB   ARG  12           HB2      ARG  12  62.588 -11.231   9.607
  119   2HB   ARG  12           HB1      ARG  12  63.572 -11.278   8.145
  120   1HG   ARG  12           HG2      ARG  12  65.393 -12.190   9.231
  121   2HG   ARG  12           HG1      ARG  12  64.984 -11.436  10.772
  122   1HD   ARG  12           HD2      ARG  12  63.101 -12.997  11.050
  123   2HD   ARG  12           HD1      ARG  12  63.484 -13.744   9.499
  124    HE   ARG  12           HE       ARG  12  65.828 -14.097  10.777
  125   1HH1  ARG  12          HH21      ARG  12  62.920 -15.625  10.917
  126   2HH1  ARG  12          HH22      ARG  12  63.120 -16.315  12.492
  127   1HH2  ARG  12          HH11      ARG  12  65.952 -14.458  13.237
  128   2HH2  ARG  12          HH12      ARG  12  64.838 -15.655  13.806
  129    H    THR  13           HN       THR  13  64.811  -7.520  10.649
  130    HA   THR  13           HA       THR  13  64.320  -8.516  13.364
  131    HB   THR  13           HB       THR  13  64.867  -5.924  13.790
  132    HG1  THR  13           HG1      THR  13  65.031  -5.116  11.822
  133   1HG2  THR  13          HG21      THR  13  66.628  -8.256  13.153
  134   2HG2  THR  13          HG23      THR  13  67.376  -6.683  13.427
  135   3HG2  THR  13          HG22      THR  13  66.388  -7.422  14.688
  136    H    SER  14           HN       SER  14  62.906  -6.232  11.104
  137    HA   SER  14           HA       SER  14  60.345  -6.383  12.538
  138   1HB   SER  14           HB2      SER  14  60.107  -3.869  12.487
  139   2HB   SER  14           HB1      SER  14  61.320  -4.446  13.626
  140    HG   SER  14           HG       SER  14  61.593  -2.928  11.370
  141    H    ILE  15           HN       ILE  15  61.502  -7.234   9.979
  142    HA   ILE  15           HA       ILE  15  59.374  -6.249   8.205
  143    HB   ILE  15           HB       ILE  15  62.321  -5.844   7.569
  144   1HG1  ILE  15          HG12      ILE  15  61.255  -4.014   8.859
  145   2HG1  ILE  15          HG11      ILE  15  61.660  -3.498   7.227
  146   1HG2  ILE  15          HG23      ILE  15  59.905  -6.016   5.799
  147   2HG2  ILE  15          HG22      ILE  15  61.163  -4.848   5.392
  148   3HG2  ILE  15          HG21      ILE  15  61.554  -6.565   5.496
  149   1HD1  ILE  15          HD11      ILE  15  59.037  -4.608   7.115
  150   2HD1  ILE  15          HD13      ILE  15  59.082  -3.508   8.492
  151   3HD1  ILE  15          HD12      ILE  15  59.513  -2.927   6.886
  152    H    GLU  16           HN       GLU  16  58.795  -8.538   8.474
  153    HA   GLU  16           HA       GLU  16  60.513 -10.707   7.808
  154   1HB   GLU  16           HB2      GLU  16  57.588 -10.285   8.072
  155   2HB   GLU  16           HB1      GLU  16  58.066 -11.621   7.023
  156   1HG   GLU  16           HG2      GLU  16  59.453 -12.561   8.820
  157   2HG   GLU  16           HG1      GLU  16  59.028 -11.209   9.871
  158    H    ASN  17           HN       ASN  17  60.873 -11.702   5.769
  159    HA   ASN  17           HA       ASN  17  61.027  -9.989   3.526
  160   1HB   ASN  17           HB2      ASN  17  61.117 -12.988   3.819
  161   2HB   ASN  17           HB1      ASN  17  61.190 -12.245   2.221
  162   1HD2  ASN  17          HD22      ASN  17  64.492 -12.278   4.516
  163   2HD2  ASN  17          HD21      ASN  17  63.092 -13.155   4.906
  164    NH1  ARG  18           NH2      ARG  18  57.012 -15.951   6.260
  165    NH2  ARG  18           NH1      ARG  18  55.341 -17.402   5.805
  166    H    ARG  18           HN       ARG  18  58.318 -11.796   4.712
  167    HA   ARG  18           HA       ARG  18  56.876 -11.570   2.147
  168   1HB   ARG  18           HB2      ARG  18  56.034 -12.606   4.876
  169   2HB   ARG  18           HB1      ARG  18  54.992 -12.605   3.452
  170   1HG   ARG  18           HG2      ARG  18  56.902 -13.895   2.286
  171   2HG   ARG  18           HG1      ARG  18  57.534 -14.165   3.910
  172   1HD   ARG  18           HD2      ARG  18  54.857 -14.803   4.197
  173   2HD   ARG  18           HD1      ARG  18  55.227 -15.398   2.578
  174    HE   ARG  18           HE       ARG  18  56.914 -16.860   3.557
  175   1HH1  ARG  18          HH21      ARG  18  57.699 -15.295   5.946
  176   2HH1  ARG  18          HH22      ARG  18  56.920 -16.151   7.235
  177   1HH2  ARG  18          HH11      ARG  18  54.748 -17.859   5.142
  178   2HH2  ARG  18          HH12      ARG  18  55.247 -17.601   6.780
  179    H    VAL  19           HN       VAL  19  57.091  -9.978   5.271
  180    HA   VAL  19           HA       VAL  19  54.689  -8.439   5.004
  181    HB   VAL  19           HB       VAL  19  56.419  -8.811   7.063
  182   1HG1  VAL  19          HG11      VAL  19  58.153  -7.307   6.100
  183   2HG1  VAL  19          HG13      VAL  19  56.986  -5.985   6.114
  184   3HG1  VAL  19          HG12      VAL  19  57.524  -6.701   7.633
  185   1HG2  VAL  19          HG22      VAL  19  54.012  -7.839   6.862
  186   2HG2  VAL  19          HG21      VAL  19  54.983  -7.375   8.259
  187   3HG2  VAL  19          HG23      VAL  19  54.812  -6.269   6.896
  188    NH1  ARG  20           NH2      ARG  20  63.895  -3.053   2.696
  189    NH2  ARG  20           NH1      ARG  20  63.570  -2.797   0.474
  190    H    ARG  20           HN       ARG  20  58.061  -7.800   4.081
  191    HA   ARG  20           HA       ARG  20  57.554  -5.123   3.166
  192   1HB   ARG  20           HB2      ARG  20  59.821  -6.568   3.548
  193   2HB   ARG  20           HB1      ARG  20  59.677  -6.664   1.792
  194   1HG   ARG  20           HG2      ARG  20  59.333  -4.139   1.806
  195   2HG   ARG  20           HG1      ARG  20  59.828  -4.171   3.499
  196   1HD   ARG  20           HD2      ARG  20  61.984  -5.103   2.917
  197   2HD   ARG  20           HD1      ARG  20  61.489  -5.307   1.235
  198    HE   ARG  20           HE       ARG  20  61.171  -2.585   1.738
  199   1HH1  ARG  20          HH21      ARG  20  63.531  -3.249   3.607
  200   2HH1  ARG  20          HH22      ARG  20  64.868  -2.859   2.577
  201   1HH2  ARG  20          HH11      ARG  20  62.958  -2.797  -0.318
  202   2HH2  ARG  20          HH12      ARG  20  64.543  -2.602   0.353
  203    CH2  TRP  21           CH2      TRP  21  60.708  -4.741  -2.772
  204    H    TRP  21           HN       TRP  21  57.865  -8.172   1.297
  205    HA   TRP  21           HA       TRP  21  56.913  -6.730  -1.040
  206   1HB   TRP  21           HB2      TRP  21  58.002  -9.397  -0.543
  207   2HB   TRP  21           HB1      TRP  21  56.645  -9.431  -1.675
  208    HD1  TRP  21           HD1      TRP  21  58.058  -9.682  -3.904
  209    HE1  TRP  21           HE1      TRP  21  59.628  -8.073  -5.180
  210    HE3  TRP  21           HE3      TRP  21  58.810  -6.114  -0.334
  211    HZ2  TRP  21           HZ2      TRP  21  61.007  -5.575  -4.719
  212    HZ3  TRP  21           HZ3      TRP  21  60.218  -4.155  -0.756
  213    HH2  TRP  21           HH2      TRP  21  61.320  -3.871  -2.964
  214    H    SER  22           HN       SER  22  55.333  -7.794   1.695
  215    HA   SER  22           HA       SER  22  52.801  -8.516   0.442
  216   1HB   SER  22           HB2      SER  22  53.016  -9.336   2.683
  217   2HB   SER  22           HB1      SER  22  53.652  -7.798   3.262
  218    HG   SER  22           HG       SER  22  51.473  -8.015   3.834
  219    H    LEU  23           HN       LEU  23  54.453  -5.721   1.849
  220    HA   LEU  23           HA       LEU  23  52.443  -3.718   1.587
  221   1HB   LEU  23           HB2      LEU  23  55.436  -3.494   1.061
  222   2HB   LEU  23           HB1      LEU  23  54.368  -2.138   1.317
  223    HG   LEU  23           HG       LEU  23  54.444  -4.225   3.446
  224   1HD1  LEU  23          HD13      LEU  23  56.842  -3.400   2.480
  225   2HD1  LEU  23          HD12      LEU  23  56.502  -2.070   3.586
  226   3HD1  LEU  23          HD11      LEU  23  56.566  -3.725   4.192
  227   1HD2  LEU  23          HD23      LEU  23  53.069  -1.992   3.350
  228   2HD2  LEU  23          HD22      LEU  23  53.906  -2.399   4.847
  229   3HD2  LEU  23          HD21      LEU  23  54.609  -1.224   3.736
  230    H    GLU  24           HN       GLU  24  54.877  -4.970  -0.640
  231    HA   GLU  24           HA       GLU  24  54.252  -3.387  -2.923
  232   1HB   GLU  24           HB2      GLU  24  56.269  -4.867  -2.639
  233   2HB   GLU  24           HB1      GLU  24  55.221  -6.257  -2.909
  234   1HG   GLU  24           HG2      GLU  24  54.628  -4.517  -5.028
  235   2HG   GLU  24           HG1      GLU  24  56.379  -4.413  -4.850
  236    H    THR  25           HN       THR  25  52.817  -6.404  -1.751
  237    HA   THR  25           HA       THR  25  51.253  -6.942  -4.098
  238    HB   THR  25           HB       THR  25  50.525  -7.703  -1.261
  239    HG1  THR  25           HG1      THR  25  52.048  -9.186  -1.323
  240   1HG2  THR  25          HG21      THR  25  48.894  -8.157  -3.112
  241   2HG2  THR  25          HG23      THR  25  50.127  -9.145  -3.895
  242   3HG2  THR  25          HG22      THR  25  49.485  -9.619  -2.322
  243    H    MET  26           HN       MET  26  50.807  -4.812  -1.354
  244    HA   MET  26           HA       MET  26  47.964  -4.365  -2.004
  245   1HB   MET  26           HB2      MET  26  49.782  -3.154   0.092
  246   2HB   MET  26           HB1      MET  26  48.063  -2.787  -0.069
  247   1HG   MET  26           HG2      MET  26  47.477  -5.114   0.327
  248   2HG   MET  26           HG1      MET  26  49.179  -5.579   0.335
  249   1HE   MET  26           HE3      MET  26  46.184  -4.515   2.150
  250   2HE   MET  26           HE2      MET  26  46.682  -3.599   3.570
  251   3HE   MET  26           HE1      MET  26  46.788  -2.862   1.973
  252    H    PHE  27           HN       PHE  27  51.046  -2.764  -2.632
  253    HA   PHE  27           HA       PHE  27  49.669  -0.268  -3.406
  254   1HB   PHE  27           HB2      PHE  27  52.584  -1.057  -3.263
  255   2HB   PHE  27           HB1      PHE  27  52.057   0.411  -4.076
  256    HD1  PHE  27           HD2      PHE  27  50.525   2.032  -2.779
  257    HD2  PHE  27           HD1      PHE  27  52.802  -1.090  -0.911
  258    HE1  PHE  27           HE2      PHE  27  50.308   3.179  -0.590
  259    HE2  PHE  27           HE1      PHE  27  52.581   0.050   1.274
  260    HZ   PHE  27           HZ       PHE  27  51.335   2.184   1.435
  261    H    LEU  28           HN       LEU  28  50.888  -3.129  -4.964
  262    HA   LEU  28           HA       LEU  28  51.113  -1.905  -7.595
  263   1HB   LEU  28           HB2      LEU  28  50.997  -4.807  -6.732
  264   2HB   LEU  28           HB1      LEU  28  51.282  -4.276  -8.391
  265    HG   LEU  28           HG       LEU  28  52.986  -3.489  -6.007
  266   1HD1  LEU  28          HD12      LEU  28  53.433  -5.500  -8.227
  267   2HD1  LEU  28          HD11      LEU  28  54.695  -4.942  -7.129
  268   3HD1  LEU  28          HD13      LEU  28  53.313  -5.838  -6.500
  269   1HD2  LEU  28          HD23      LEU  28  52.872  -2.678  -8.864
  270   2HD2  LEU  28          HD22      LEU  28  53.443  -1.779  -7.459
  271   3HD2  LEU  28          HD21      LEU  28  54.482  -2.987  -8.212
  272    H    LYS  29           HN       LYS  29  48.496  -3.120  -5.699
  273    HA   LYS  29           HA       LYS  29  46.750  -3.355  -8.098
  274   1HB   LYS  29           HB2      LYS  29  46.276  -5.184  -6.698
  275   2HB   LYS  29           HB1      LYS  29  46.550  -4.257  -5.228
  276   1HG   LYS  29           HG2      LYS  29  44.397  -3.427  -5.181
  277   2HG   LYS  29           HG1      LYS  29  44.268  -3.367  -6.940
  278   1HD   LYS  29           HD2      LYS  29  42.801  -5.126  -6.316
  279   2HD   LYS  29           HD1      LYS  29  44.266  -5.954  -6.843
  280   1HE   LYS  29           HE2      LYS  29  44.610  -5.375  -4.081
  281   2HE   LYS  29           HE1      LYS  29  42.987  -6.040  -4.266
  282   1HZ   LYS  29           HZ3      LYS  29  45.406  -7.278  -5.451
  283   2HZ   LYS  29           HZ2      LYS  29  44.775  -7.719  -3.936
  284   3HZ   LYS  29           HZ1      LYS  29  43.852  -7.947  -5.344
  285    H    CYS  30           HN       CYS  30  47.326  -1.469  -5.185
  286    HA   CYS  30           HA       CYS  30  45.115   0.354  -5.995
  287   1HB   CYS  30           HB2      CYS  30  45.777  -0.803  -3.499
  288   2HB   CYS  30           HB1      CYS  30  46.183   0.905  -3.356
  289    HG   CYS  30           HG       CYS  30  43.696   1.475  -4.041
  290    HA   PRO  31           HA       PRO  31  48.768   3.000  -6.731
  291   1HB   PRO  31           HB2      PRO  31  47.770   4.210  -8.976
  292   2HB   PRO  31           HB1      PRO  31  48.637   2.664  -9.031
  293   1HG   PRO  31           HG2      PRO  31  45.727   3.194  -9.350
  294   2HG   PRO  31           HG1      PRO  31  46.691   1.835  -9.949
  295   1HD   PRO  31           HD2      PRO  31  44.986   1.837  -7.663
  296   2HD   PRO  31           HD1      PRO  31  46.117   0.556  -8.144
  297    H    LYS  32           HN       LYS  32  45.712   3.347  -5.575
  298    HA   LYS  32           HA       LYS  32  45.768   6.301  -5.593
  299   1HB   LYS  32           HB2      LYS  32  43.258   6.010  -5.114
  300   2HB   LYS  32           HB1      LYS  32  43.807   5.596  -6.736
  301   1HG   LYS  32           HG2      LYS  32  43.402   3.338  -6.447
  302   2HG   LYS  32           HG1      LYS  32  43.855   3.369  -4.744
  303   1HD   LYS  32           HD2      LYS  32  41.697   3.545  -4.121
  304   2HD   LYS  32           HD1      LYS  32  41.480   4.977  -5.125
  305   1HE   LYS  32           HE2      LYS  32  40.477   3.801  -6.789
  306   2HE   LYS  32           HE1      LYS  32  41.606   2.455  -6.648
  307   1HZ   LYS  32           HZ2      LYS  32  40.347   2.047  -4.436
  308   2HZ   LYS  32           HZ1      LYS  32  39.113   2.951  -5.175
  309   3HZ   LYS  32           HZ3      LYS  32  39.666   1.522  -5.902
  310    HA   PRO  33           HA       PRO  33  45.738   4.580  -1.127
  311   1HB   PRO  33           HB2      PRO  33  48.367   4.846  -0.401
  312   2HB   PRO  33           HB1      PRO  33  47.687   3.345  -1.057
  313   1HG   PRO  33           HG2      PRO  33  49.425   5.370  -2.403
  314   2HG   PRO  33           HG1      PRO  33  49.306   3.625  -2.686
  315   1HD   PRO  33           HD2      PRO  33  48.129   5.595  -4.303
  316   2HD   PRO  33           HD1      PRO  33  47.681   3.876  -4.255
  317    H    SER  34           HN       SER  34  45.557   6.061   0.577
  318    HA   SER  34           HA       SER  34  46.169   8.881  -0.019
  319   1HB   SER  34           HB2      SER  34  44.682   7.606   2.283
  320   2HB   SER  34           HB1      SER  34  44.851   9.340   2.025
  321    HG   SER  34           HG       SER  34  43.259   9.205   0.673
  322    H    LEU  35           HN       LEU  35  47.522  10.160   1.377
  323    HA   LEU  35           HA       LEU  35  49.780   8.776   2.464
  324   1HB   LEU  35           HB2      LEU  35  50.567  10.887   3.234
  325   2HB   LEU  35           HB1      LEU  35  49.664  11.253   1.770
  326    HG   LEU  35           HG       LEU  35  48.417  11.416   4.522
  327   1HD1  LEU  35          HD13      LEU  35  50.396  12.932   4.348
  328   2HD1  LEU  35          HD12      LEU  35  49.668  13.666   2.919
  329   3HD1  LEU  35          HD11      LEU  35  48.873  13.810   4.487
  330   1HD2  LEU  35          HD23      LEU  35  47.686  12.252   1.725
  331   2HD2  LEU  35          HD22      LEU  35  46.694  11.433   2.932
  332   3HD2  LEU  35          HD21      LEU  35  47.042  13.154   3.096
  333    H    GLN  36           HN       GLN  36  46.607   9.450   3.697
  334    HA   GLN  36           HA       GLN  36  47.223   9.112   6.525
  335   1HB   GLN  36           HB2      GLN  36  44.993   9.935   5.155
  336   2HB   GLN  36           HB1      GLN  36  44.545   8.276   5.553
  337   1HG   GLN  36           HG2      GLN  36  43.813   9.448   7.444
  338   2HG   GLN  36           HG1      GLN  36  45.410   8.893   7.947
  339   1HE2  GLN  36          HE22      GLN  36  44.825  12.884   7.185
  340   2HE2  GLN  36          HE21      GLN  36  43.702  11.750   6.606
  341    H    GLN  37           HN       GLN  37  46.173   7.060   3.854
  342    HA   GLN  37           HA       GLN  37  46.022   4.605   5.331
  343   1HB   GLN  37           HB2      GLN  37  45.090   4.979   3.011
  344   2HB   GLN  37           HB1      GLN  37  46.745   4.936   2.403
  345   1HG   GLN  37           HG2      GLN  37  47.013   2.676   2.886
  346   2HG   GLN  37           HG1      GLN  37  45.784   2.696   4.150
  347   1HE2  GLN  37          HE22      GLN  37  44.158   0.970   1.334
  348   2HE2  GLN  37          HE21      GLN  37  45.370   0.649   2.479
  349    H    ILE  38           HN       ILE  38  48.684   6.527   4.108
  350    HA   ILE  38           HA       ILE  38  50.632   4.391   4.152
  351    HB   ILE  38           HB       ILE  38  50.780   7.401   3.944
  352   1HG1  ILE  38          HG12      ILE  38  50.414   6.035   1.924
  353   2HG1  ILE  38          HG11      ILE  38  51.998   6.805   1.863
  354   1HG2  ILE  38          HG23      ILE  38  52.947   5.605   4.946
  355   2HG2  ILE  38          HG22      ILE  38  53.410   6.734   3.674
  356   3HG2  ILE  38          HG21      ILE  38  52.727   7.340   5.182
  357   1HD1  ILE  38          HD11      ILE  38  52.852   4.575   2.953
  358   2HD1  ILE  38          HD13      ILE  38  51.327   3.909   2.372
  359   3HD1  ILE  38          HD12      ILE  38  52.483   4.585   1.229
  360    H    THR  39           HN       THR  39  49.378   6.739   6.427
  361    HA   THR  39           HA       THR  39  51.259   6.250   8.550
  362    HB   THR  39           HB       THR  39  48.344   7.083   8.758
  363    HG1  THR  39           HG1      THR  39  49.161   8.722   7.702
  364   1HG2  THR  39          HG21      THR  39  50.682   7.417  10.658
  365   2HG2  THR  39          HG23      THR  39  49.064   8.075  10.903
  366   3HG2  THR  39          HG22      THR  39  49.313   6.329  10.887
  367    H    HIS  40           HN       HIS  40  48.164   4.806   7.629
  368    HA   HIS  40           HA       HIS  40  48.158   2.863   9.806
  369   1HB   HIS  40           HB2      HIS  40  46.463   3.489   7.454
  370   2HB   HIS  40           HB1      HIS  40  46.473   1.797   7.951
  371    HD1  HIS  40           HD1      HIS  40  46.949   4.458  10.537
  372    HD2  HIS  40           HD2      HIS  40  43.852   2.064   9.100
  373    HE1  HIS  40           HE1      HIS  40  45.047   4.672  12.198
  374    H    ILE  41           HN       ILE  41  49.744   3.103   6.760
  375    HA   ILE  41           HA       ILE  41  50.068   0.270   6.244
  376    HB   ILE  41           HB       ILE  41  50.742   2.762   5.010
  377   1HG1  ILE  41          HG12      ILE  41  51.447   0.980   3.138
  378   2HG1  ILE  41          HG11      ILE  41  50.606  -0.106   4.245
  379   1HG2  ILE  41          HG23      ILE  41  53.025   2.535   5.891
  380   2HG2  ILE  41          HG22      ILE  41  53.137   0.924   5.181
  381   3HG2  ILE  41          HG21      ILE  41  52.997   2.339   4.138
  382   1HD1  ILE  41          HD11      ILE  41  49.408   2.504   3.291
  383   2HD1  ILE  41          HD13      ILE  41  49.152   0.974   2.453
  384   3HD1  ILE  41          HD12      ILE  41  48.586   1.177   4.111
  385    H    ALA  42           HN       ALA  42  51.878   2.809   7.866
  386    HA   ALA  42           HA       ALA  42  54.144   1.267   8.597
  387   1HB   ALA  42           HB3      ALA  42  53.482   3.894   8.775
  388   2HB   ALA  42           HB2      ALA  42  53.271   3.397  10.454
  389   3HB   ALA  42           HB1      ALA  42  54.829   3.176   9.657
  390    H    ASN  43           HN       ASN  43  51.252   2.148  10.468
  391    HA   ASN  43           HA       ASN  43  51.826   0.467  12.709
  392   1HB   ASN  43           HB2      ASN  43  49.570   2.031  11.710
  393   2HB   ASN  43           HB1      ASN  43  49.030   0.519  12.438
  394   1HD2  ASN  43          HD22      ASN  43  50.677   1.423  15.634
  395   2HD2  ASN  43          HD21      ASN  43  50.735   0.119  14.549
  396    H    GLN  44           HN       GLN  44  50.760  -0.182   9.473
  397    HA   GLN  44           HA       GLN  44  49.470  -2.691   9.882
  398   1HB   GLN  44           HB2      GLN  44  50.052  -0.993   7.730
  399   2HB   GLN  44           HB1      GLN  44  50.848  -2.511   7.343
  400   1HG   GLN  44           HG2      GLN  44  47.949  -2.280   8.199
  401   2HG   GLN  44           HG1      GLN  44  48.477  -2.369   6.518
  402   1HE2  GLN  44          HE22      GLN  44  49.325  -5.840   6.692
  403   2HE2  GLN  44          HE21      GLN  44  49.602  -4.399   5.839
  404    H    LEU  45           HN       LEU  45  52.844  -1.812   9.196
  405    HA   LEU  45           HA       LEU  45  53.556  -4.627   9.903
  406   1HB   LEU  45           HB2      LEU  45  55.363  -4.591   8.346
  407   2HB   LEU  45           HB1      LEU  45  53.962  -3.957   7.496
  408    HG   LEU  45           HG       LEU  45  55.856  -2.069   8.853
  409   1HD1  LEU  45          HD11      LEU  45  56.648  -3.906   6.836
  410   2HD1  LEU  45          HD13      LEU  45  56.465  -2.342   6.047
  411   3HD1  LEU  45          HD12      LEU  45  57.529  -2.516   7.429
  412   1HD2  LEU  45          HD23      LEU  45  53.638  -1.988   6.920
  413   2HD2  LEU  45          HD22      LEU  45  54.229  -0.742   8.018
  414   3HD2  LEU  45          HD21      LEU  45  55.029  -1.000   6.470
  415    H    GLY  46           HN       GLY  46  53.354  -2.047  11.545
  416   1HA   GLY  46           HA2      GLY  46  54.547  -0.972  13.252
  417   2HA   GLY  46           HA1      GLY  46  55.237  -2.568  13.505
  418    H    LEU  47           HN       LEU  47  55.828  -0.726  10.536
  419    HA   LEU  47           HA       LEU  47  58.694  -0.619  11.344
  420   1HB   LEU  47           HB2      LEU  47  59.290  -0.927   9.159
  421   2HB   LEU  47           HB1      LEU  47  57.681  -1.592   9.047
  422    HG   LEU  47           HG       LEU  47  58.551   1.194   8.259
  423   1HD1  LEU  47          HD12      LEU  47  58.703  -1.105   6.804
  424   2HD1  LEU  47          HD11      LEU  47  57.110  -0.508   6.342
  425   3HD1  LEU  47          HD13      LEU  47  58.531   0.503   6.108
  426   1HD2  LEU  47          HD21      LEU  47  55.865   0.054   8.772
  427   2HD2  LEU  47          HD23      LEU  47  56.418   1.719   8.911
  428   3HD2  LEU  47          HD22      LEU  47  56.033   1.047   7.329
  429    H    GLU  48           HN       GLU  48  59.783   1.380  10.046
  430    HA   GLU  48           HA       GLU  48  58.550   3.787  11.240
  431   1HB   GLU  48           HB2      GLU  48  60.720   4.863  10.481
  432   2HB   GLU  48           HB1      GLU  48  60.896   3.593  11.687
  433   1HG   GLU  48           HG2      GLU  48  60.968   2.619   8.911
  434   2HG   GLU  48           HG1      GLU  48  62.287   3.717   9.315
  435    H    LYS  49           HN       LYS  49  58.441   5.777   9.917
  436    HA   LYS  49           HA       LYS  49  57.211   5.299   7.345
  437   1HB   LYS  49           HB2      LYS  49  56.886   7.304   8.989
  438   2HB   LYS  49           HB1      LYS  49  58.288   7.982   8.163
  439   1HG   LYS  49           HG2      LYS  49  56.792   7.142   6.033
  440   2HG   LYS  49           HG1      LYS  49  55.527   7.594   7.176
  441   1HD   LYS  49           HD2      LYS  49  56.898   9.769   7.514
  442   2HD   LYS  49           HD1      LYS  49  57.713   9.317   6.017
  443   1HE   LYS  49           HE2      LYS  49  55.992  10.472   5.052
  444   2HE   LYS  49           HE1      LYS  49  55.130   8.952   5.271
  445   1HZ   LYS  49           HZ3      LYS  49  54.897  10.268   7.680
  446   2HZ   LYS  49           HZ2      LYS  49  54.672  11.474   6.505
  447   3HZ   LYS  49           HZ1      LYS  49  53.694  10.086   6.499
  448    H    ASP  50           HN       ASP  50  60.487   5.512   8.342
  449    HA   ASP  50           HA       ASP  50  61.531   6.585   5.840
  450   1HB   ASP  50           HB2      ASP  50  62.532   6.312   8.405
  451   2HB   ASP  50           HB1      ASP  50  63.377   5.033   7.534
  452    H    VAL  51           HN       VAL  51  60.698   3.429   7.122
  453    HA   VAL  51           HA       VAL  51  62.230   1.960   5.075
  454    HB   VAL  51           HB       VAL  51  60.122   1.105   7.096
  455   1HG1  VAL  51          HG12      VAL  51  60.017  -0.362   5.115
  456   2HG1  VAL  51          HG11      VAL  51  61.754  -0.644   5.230
  457   3HG1  VAL  51          HG13      VAL  51  60.680  -1.224   6.503
  458   1HG2  VAL  51          HG23      VAL  51  62.508   1.749   7.818
  459   2HG2  VAL  51          HG22      VAL  51  61.860   0.206   8.376
  460   3HG2  VAL  51          HG21      VAL  51  62.995   0.251   7.027
  461    H    VAL  52           HN       VAL  52  58.934   2.873   5.831
  462    HA   VAL  52           HA       VAL  52  57.783   1.581   3.520
  463    HB   VAL  52           HB       VAL  52  56.912   2.808   5.914
  464   1HG1  VAL  52          HG13      VAL  52  55.684   4.198   3.527
  465   2HG1  VAL  52          HG12      VAL  52  55.000   4.205   5.154
  466   3HG1  VAL  52          HG11      VAL  52  56.571   4.947   4.855
  467   1HG2  VAL  52          HG23      VAL  52  56.164   0.754   4.386
  468   2HG2  VAL  52          HG22      VAL  52  55.089   1.453   5.596
  469   3HG2  VAL  52          HG21      VAL  52  54.916   1.898   3.897
  470    NH1  ARG  53           NH2      ARG  53  62.774   8.591   2.648
  471    NH2  ARG  53           NH1      ARG  53  62.954  10.695   1.842
  472    H    ARG  53           HN       ARG  53  59.190   4.745   4.064
  473    HA   ARG  53           HA       ARG  53  58.099   5.820   1.557
  474   1HB   ARG  53           HB2      ARG  53  58.603   7.149   3.725
  475   2HB   ARG  53           HB1      ARG  53  60.279   7.119   3.178
  476   1HG   ARG  53           HG2      ARG  53  58.228   7.906   1.167
  477   2HG   ARG  53           HG1      ARG  53  58.560   9.063   2.456
  478   1HD   ARG  53           HD2      ARG  53  60.897   7.794   1.096
  479   2HD   ARG  53           HD1      ARG  53  60.005   9.030   0.210
  480    HE   ARG  53           HE       ARG  53  60.401  10.440   2.377
  481   1HH1  ARG  53          HH21      ARG  53  62.210   7.801   2.889
  482   2HH1  ARG  53          HH22      ARG  53  63.765   8.557   2.781
  483   1HH2  ARG  53          HH11      ARG  53  62.528  11.519   1.466
  484   2HH2  ARG  53          HH12      ARG  53  63.944  10.661   1.976
  485    H    VAL  54           HN       VAL  54  61.165   4.418   2.688
  486    HA   VAL  54           HA       VAL  54  62.621   5.219   0.290
  487    HB   VAL  54           HB       VAL  54  63.239   3.049   2.326
  488   1HG1  VAL  54          HG12      VAL  54  64.865   4.289   0.089
  489   2HG1  VAL  54          HG11      VAL  54  65.600   3.409   1.429
  490   3HG1  VAL  54          HG13      VAL  54  64.496   2.581   0.330
  491   1HG2  VAL  54          HG21      VAL  54  63.104   5.688   2.835
  492   2HG2  VAL  54          HG23      VAL  54  64.326   4.651   3.572
  493   3HG2  VAL  54          HG22      VAL  54  64.732   5.625   2.158
  494    CH2  TRP  55           CH2      TRP  55  55.239  -1.350  -1.862
  495    H    TRP  55           HN       TRP  55  60.788   2.349   1.290
  496    HA   TRP  55           HA       TRP  55  61.505   0.874  -1.111
  497   1HB   TRP  55           HB2      TRP  55  60.820  -0.485   0.751
  498   2HB   TRP  55           HB1      TRP  55  59.355   0.458   0.988
  499    HD1  TRP  55           HD1      TRP  55  60.877  -2.087  -1.544
  500    HE1  TRP  55           HE1      TRP  55  58.919  -3.132  -2.848
  501    HE3  TRP  55           HE3      TRP  55  56.963   0.655   0.286
  502    HZ2  TRP  55           HZ2      TRP  55  56.123  -2.868  -3.098
  503    HZ3  TRP  55           HZ3      TRP  55  54.672   0.239  -0.537
  504    HH2  TRP  55           HH2      TRP  55  54.234  -1.531  -2.211
  505    H    PHE  56           HN       PHE  56  58.789   3.014  -0.140
  506    HA   PHE  56           HA       PHE  56  57.511   2.500  -2.715
  507   1HB   PHE  56           HB2      PHE  56  56.418   3.268  -0.343
  508   2HB   PHE  56           HB1      PHE  56  56.513   4.821  -1.176
  509    HD1  PHE  56           HD2      PHE  56  55.935   1.355  -2.472
  510    HD2  PHE  56           HD1      PHE  56  54.353   5.315  -2.045
  511    HE1  PHE  56           HE2      PHE  56  54.007   0.716  -3.852
  512    HE2  PHE  56           HE1      PHE  56  52.409   4.675  -3.451
  513    HZ   PHE  56           HZ       PHE  56  52.250   2.365  -4.356
  514    H    CYS  57           HN       CYS  57  60.052   4.480  -1.805
  515    HA   CYS  57           HA       CYS  57  59.428   6.672  -3.641
  516   1HB   CYS  57           HB2      CYS  57  61.113   6.747  -1.658
  517   2HB   CYS  57           HB1      CYS  57  62.207   5.873  -2.728
  518    HG   CYS  57           HG       CYS  57  62.716   8.320  -3.262
  519    H    ASN  58           HN       ASN  58  61.005   3.545  -3.705
  520    HA   ASN  58           HA       ASN  58  61.827   3.883  -6.523
  521   1HB   ASN  58           HB2      ASN  58  62.126   1.649  -4.504
  522   2HB   ASN  58           HB1      ASN  58  62.556   1.446  -6.202
  523   1HD2  ASN  58          HD22      ASN  58  64.909   3.771  -3.789
  524   2HD2  ASN  58          HD21      ASN  58  63.382   3.266  -3.248
  525    NH1  ARG  59           NH2      ARG  59  54.682   0.569  -8.841
  526    NH2  ARG  59           NH1      ARG  59  52.836   0.821  -7.563
  527    H    ARG  59           HN       ARG  59  59.225   2.498  -4.609
  528    HA   ARG  59           HA       ARG  59  58.209   0.808  -6.758
  529   1HB   ARG  59           HB2      ARG  59  57.659   1.014  -4.000
  530   2HB   ARG  59           HB1      ARG  59  56.179   1.555  -4.781
  531   1HG   ARG  59           HG2      ARG  59  57.612  -1.064  -5.281
  532   2HG   ARG  59           HG1      ARG  59  56.075  -0.842  -4.453
  533   1HD   ARG  59           HD2      ARG  59  56.652  -0.308  -7.378
  534   2HD   ARG  59           HD1      ARG  59  55.591  -1.551  -6.716
  535    HE   ARG  59           HE       ARG  59  54.613   0.917  -5.766
  536   1HH1  ARG  59          HH21      ARG  59  55.664   0.406  -8.923
  537   2HH1  ARG  59          HH22      ARG  59  54.129   0.706  -9.663
  538   1HH2  ARG  59          HH11      ARG  59  52.402   0.853  -6.663
  539   2HH2  ARG  59          HH12      ARG  59  52.287   0.960  -8.387
  540    NH1  ARG  60           NH1      ARG  60  56.334  10.229  -3.971
  541    NH2  ARG  60           NH2      ARG  60  56.522  11.301  -5.953
  542    H    ARG  60           HN       ARG  60  57.927   4.178  -5.886
  543    HA   ARG  60           HA       ARG  60  55.479   4.553  -7.477
  544   1HB   ARG  60           HB2      ARG  60  55.741   6.939  -6.939
  545   2HB   ARG  60           HB1      ARG  60  55.876   5.960  -5.481
  546   1HG   ARG  60           HG2      ARG  60  58.359   6.065  -5.679
  547   2HG   ARG  60           HG1      ARG  60  58.180   7.123  -7.077
  548   1HD   ARG  60           HD2      ARG  60  57.140   7.700  -4.287
  549   2HD   ARG  60           HD1      ARG  60  58.572   8.428  -5.015
  550    HE   ARG  60           HE       ARG  60  56.329   8.873  -6.733
  551   1HH1  ARG  60          HH11      ARG  60  56.341   9.381  -3.441
  552   2HH1  ARG  60          HH12      ARG  60  56.174  11.104  -3.513
  553   1HH2  ARG  60          HH21      ARG  60  56.674  11.275  -6.941
  554   2HH2  ARG  60          HH22      ARG  60  56.363  12.176  -5.494
  555    H    GLN  61           HN       GLN  61  58.961   5.018  -7.840
  556    HA   GLN  61           HA       GLN  61  58.465   5.734 -10.704
  557   1HB   GLN  61           HB2      GLN  61  60.705   6.897 -10.599
  558   2HB   GLN  61           HB1      GLN  61  59.458   7.647  -9.603
  559   1HG   GLN  61           HG2      GLN  61  60.466   7.036  -7.636
  560   2HG   GLN  61           HG1      GLN  61  61.098   5.532  -8.305
  561   1HE2  GLN  61          HE22      GLN  61  64.017   7.161  -9.727
  562   2HE2  GLN  61          HE21      GLN  61  62.900   5.931 -10.075
  563    H    LYS  62           HN       LYS  62  58.431   3.172 -10.479
  564    HA   LYS  62           HA       LYS  62  61.089   1.947 -10.398
  565   1HB   LYS  62           HB2      LYS  62  59.888  -0.139 -10.919
  566   2HB   LYS  62           HB1      LYS  62  59.106   0.717  -9.593
  567   1HG   LYS  62           HG2      LYS  62  57.211   0.406 -10.818
  568   2HG   LYS  62           HG1      LYS  62  57.797   1.790 -11.739
  569   1HD   LYS  62           HD2      LYS  62  58.228   0.530 -13.567
  570   2HD   LYS  62           HD1      LYS  62  59.018  -0.727 -12.615
  571   1HE   LYS  62           HE2      LYS  62  56.601  -1.343 -11.857
  572   2HE   LYS  62           HE1      LYS  62  56.095  -0.417 -13.270
  573   1HZ   LYS  62           HZ3      LYS  62  57.857  -1.851 -14.469
  574   2HZ   LYS  62           HZ2      LYS  62  57.672  -2.897 -13.143
  575   3HZ   LYS  62           HZ1      LYS  62  56.337  -2.521 -14.126
  576    H    GLY  63           HN       GLY  63  58.839   3.094 -12.833
  577   1HA   GLY  63           HA2      GLY  63  60.375   3.721 -14.912
  578   2HA   GLY  63           HA1      GLY  63  60.500   1.964 -15.015
  579    H    LYS  64           HN       LYS  64  58.011   4.519 -14.751
  580    HA   LYS  64           HA       LYS  64  55.978   2.793 -15.952
  581   1HB   LYS  64           HB2      LYS  64  55.825   4.928 -14.281
  582   2HB   LYS  64           HB1      LYS  64  55.520   5.721 -15.826
  583   1HG   LYS  64           HG2      LYS  64  53.825   3.838 -16.267
  584   2HG   LYS  64           HG1      LYS  64  53.970   3.464 -14.550
  585   1HD   LYS  64           HD2      LYS  64  53.184   5.643 -13.920
  586   2HD   LYS  64           HD1      LYS  64  53.304   6.233 -15.578
  587   1HE   LYS  64           HE2      LYS  64  51.413   5.076 -16.274
  588   2HE   LYS  64           HE1      LYS  64  51.572   3.853 -15.014
  589   1HZ   LYS  64           HZ1      LYS  64  51.171   5.943 -13.490
  590   2HZ   LYS  64           HZ3      LYS  64  50.390   6.525 -14.878
  591   3HZ   LYS  64           HZ2      LYS  64  49.876   5.073 -14.161
  592    NH1  ARG  65           NH2      ARG  65  52.819   8.784 -22.800
  593    NH2  ARG  65           NH1      ARG  65  53.166  10.627 -21.536
  594    H    ARG  65           HN       ARG  65  57.184   5.999 -16.937
  595    HA   ARG  65           HA       ARG  65  56.823   5.128 -19.770
  596   1HB   ARG  65           HB2      ARG  65  55.549   7.169 -18.749
  597   2HB   ARG  65           HB1      ARG  65  57.097   7.998 -18.903
  598   1HG   ARG  65           HG2      ARG  65  57.155   7.371 -21.315
  599   2HG   ARG  65           HG1      ARG  65  55.554   6.651 -21.139
  600   1HD   ARG  65           HD2      ARG  65  55.900   9.456 -20.187
  601   2HD   ARG  65           HD1      ARG  65  55.882   9.191 -21.930
  602    HE   ARG  65           HE       ARG  65  53.674   8.042 -20.301
  603   1HH1  ARG  65          HH21      ARG  65  52.970   7.810 -22.970
  604   2HH1  ARG  65          HH22      ARG  65  52.255   9.320 -23.427
  605   1HH2  ARG  65          HH11      ARG  65  53.583  11.065 -20.739
  606   2HH2  ARG  65          HH12      ARG  65  52.602  11.164 -22.163
  607    H    SER  66           HN       SER  66  58.921   4.183 -19.974
  608    HA   SER  66           HA       SER  66  61.132   6.188 -20.050
  609   1HB   SER  66           HB2      SER  66  61.411   3.315 -19.120
  610   2HB   SER  66           HB1      SER  66  62.685   4.531 -19.169
  611    HG   SER  66           HG       SER  66  61.453   5.743 -17.661
  612    H    SER  67           HN       SER  67  60.179   6.072 -22.368
  613    HA   SER  67           HA       SER  67  61.579   3.888 -23.861
  614   1HB   SER  67           HB2      SER  67  58.805   4.791 -23.979
  615   2HB   SER  67           HB1      SER  67  59.582   4.860 -25.557
  616    HG   SER  67           HG       SER  67  58.891   2.803 -25.384
   
   
  No H/Q in entry =         616