*HEADER    DNA BINDING PROTEIN                     26-FEB-03   1OMQ              
*TITLE     STRUCTURE OF PENETRATIN IN BICELLAR SOLUTION                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HOMEOTIC ANTENNAPEDIA PROTEIN;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: C-TERMINAL FRAGMENT;                                       
*COMPND   5 SYNONYM: PENETRATIN;                                                 
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   4 SEQUENCE OF THE PEPTIDE IS NATURALLY FOUND IN DROSOPHILA             
*SOURCE   5 MELANOGASTER (FRUIT FLY). THE PEPTIDE WAS OBTAINED FROM              
*SOURCE   6 NEOSYSTEM INC. AND USED WITHOUT FURTHER PURIFICATION.                
*KEYWDS    UNSTRUCTURED AT THE TERMINALS, ALPHA HELICAL IN THE MIDDLE            
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    M.LINDBERG, H.BIVERSTAHL, A.GRASLUND, L.MALER                         
*REVDAT   2   05-AUG-03 1OMQ    1  UPDATED CONSTRAINTS FORMAT
*REVDAT   1   29-JUL-03 1OMQ    0                                                
129 distance constrataints as
used in DYANA structure calculation
of penetratin in acidic
bicellar solution. 
44 GLN  HN     44 GLN  HA      3.5
44 GLN  HN     44 GLN  QB      3.5
44 GLN  HA     44 GLN  QB      4.5
44 GLN  HN     45 ILE  HN      4.5
44 GLN  HA     45 ILE  HN      3.5
44 GLN  HA     45 ILE  HB      6.0
44 GLN  QB     45 ILE  HN      4.5
44 GLN  QG     45 ILE  HN      6.0
44 GLN  HA     46 LYS+ HN      6.0
44 GLN  QG     46 LYS+ HN      6.0
44 GLN  QB     46 LYS+ HN      6.0
44 GLN  HA     47 ILE  HB      4.5
44 GLN  QE2    47 ILE  QD1     6.0
45 ILE  HN     45 ILE  HA      3.5
45 ILE  HN     45 ILE  HB      3.5
45 ILE  HN     45 ILE  QG2     4.5
45 ILE  HN     45 ILE  QD1     4.5
45 ILE  HN     46 LYS+ HA      6.0
45 ILE  HN     46 LYS+ QB      6.0
45 ILE  HN     46 LYS+ HN      3.5
45 ILE  HA     46 LYS+ HN      3.5
45 ILE  HB     46 LYS+ HN      4.5
45 ILE  QG1    46 LYS+ HN      6.0
45 ILE  QG2    46 LYS+ HN      4.5
45 ILE  QD1    46 LYS+ HN      6.0
45 ILE  HN     47 ILE  HN      6.0
45 ILE  HA     47 ILE  HN      4.5
45 ILE  HA     48 TRP  HN      4.5
45 ILE  HA     49 PHE  HN      4.5
46 LYS+ HN     46 LYS+ HA      3.5
46 LYS+ HN     46 LYS+ QB      3.5
46 LYS+ HN     46 LYS+ QG      4.5
46 LYS+ HN     46 LYS+ QG      6.0
46 LYS+ HN     47 ILE  HN      3.5
46 LYS+ HN     47 ILE  QG1     6.0
46 LYS+ HN     47 ILE  QD1     4.5
46 LYS+ HA     47 ILE  HN      3.5
46 LYS+ QB     47 ILE  HN      4.5
46 LYS+ QG     47 ILE  HN      4.5
46 LYS+ QD     47 ILE  HN      6.0
46 LYS+ HA     49 PHE  HN      3.5
46 LYS+ HA     49 PHE  QB      4.5
46 LYS+ HN     49 PHE  QD      6.0
46 LYS+ HA     50 GLN  HN      4.5
47 ILE  HN     47 ILE  HA      3.5
47 ILE  HN     47 ILE  HB      4.5
47 ILE  HN     47 ILE  QG1     4.5
47 ILE  HN     47 ILE  QD1     4.5
47 ILE  HN     48 TRP  HN      4.5
47 ILE  QG2    48 TRP  HN      6.0
47 ILE  QD1    48 TRP  HN      4.5
47 ILE  QD1    48 TRP  HE1     6.0
47 ILE  QD1    48 TRP  HD1     4.5
47 ILE  HN     49 PHE  QD      6.0
47 ILE  HA     50 GLN  HN      3.5
47 ILE  HA     50 GLN  QB      4.5
47 ILE  QD1    50 GLN  HN      6.0
47 ILE  HA     51 ASN  HN      6.0
48 TRP  HN     48 TRP  HA      3.5
48 TRP  HN     48 TRP  QB      3.5
48 TRP  HN     48 TRP  HD1     4.5
48 TRP  HN     49 PHE  HN      3.5
48 TRP  HA     49 PHE  HN      4.5
48 TRP  QB     49 PHE  HN      3.5
48 TRP  HA     50 GLN  HN      4.5
48 TRP  HH2    51 ASN  QB      6.0
48 TRP  HZ2    51 ASN  QB      6.0
48 TRP  HA     51 ASN  HN      4.5
48 TRP  HA     52 ARG+ HN      4.5
49 PHE  HN     49 PHE  HA      3.5
49 PHE  HN     49 PHE  QB      4.5
49 PHE  HN     49 PHE  CG      4.5
49 PHE  HN     49 PHE  CZ      6.0
49 PHE  HN     50 GLN  HN      3.5
49 PHE  HA     50 GLN  HN      4.5
49 PHE  QB     50 GLN  HN      3.5
49 PHE  CG     50 GLN  HN      6.0
49 PHE  HA     52 ARG+ HN      3.5
49 PHE  HA     53 ARG+ HN      4.5
49 PHE  QB     53 ARG+ HN      6.0
50 GLN  HN     50 GLN  HA      3.5
50 GLN  HN     50 GLN  QB      3.5
50 GLN  HN     50 GLN  QG      4.5
50 GLN  HN     51 ASN  HN      3.5
50 GLN  HA     51 ASN  HN      4.5
50 GLN  QB     51 ASN  HN      4.5
50 GLN  QG     51 ASN  HN      4.5
50 GLN  QB     51 ASN  HN      4.5
50 GLN  QG     51 ASN  HN      4.5
50 GLN  QE2    51 ASN  QB      6.0
50 GLN  HA     52 ARG+ HN      6.0
50 GLN  HA     53 ARG+ HN      4.5
51 ASN  HN     51 ASN  QB      4.5
51 ASN  HN     52 ARG+ HN      3.5
51 ASN  QB     52 ARG+ HN      4.5
51 ASN  QB     53 ARG+ HN      6.0
51 ASN  HA     55 LYS+ HN      6.0
52 ARG+ HN     52 ARG+ HA      4.5
52 ARG+ HN     52 ARG+ QB      3.5
52 ARG+ HN     53 ARG+ HN      3.5
52 ARG+ HA     53 ARG+ HN      3.5
52 ARG+ HA     55 LYS+ HN      4.5
53 ARG+ HN     53 ARG+ HA      3.5
53 ARG+ HN     53 ARG+ QB      4.5
53 ARG+ HN     54 MET  HN      3.5
53 ARG+ HA     54 MET  HN      3.5
53 ARG+ QB     54 MET  HN      4.5
53 ARG+ HA     56 TRP  HN      4.5
54 MET  HN     54 MET  HA      3.5
54 MET  HN     54 MET  QB      3.5
54 MET  HN     54 MET  QG      4.5
54 MET  HN     55 LYS+ HN      3.5
54 MET  HA     55 LYS+ HN      3.5
54 MET  QB     55 LYS+ HN      4.5
54 MET  QG     55 LYS+ HN      6.0
54 MET  HA     56 TRP  HN      4.5
54 MET  HA     57 LYS+ HN      4.5
55 LYS+ HN     55 LYS+ HA      3.5
55 LYS+ HN     55 LYS+ QB      4.5
55 LYS+ HN     56 TRP  HN      3.5
55 LYS+ HA     56 TRP  HN      4.5
55 LYS+ HA     57 LYS+ HN      4.5
56 TRP  HN     56 TRP  HA      3.5
56 TRP  HN     56 TRP  HD1     4.5
56 TRP  HN     57 LYS+ HN      4.5
56 TRP  QB     57 LYS+ HN      4.5
57 LYS+ HN     57 LYS+ HA      3.5
57 LYS+ HN     57 LYS+ QB      4.5
57 LYS+ HN     57 LYS+ QG      4.5

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    ARG  43           H        ARG  43   1.884   0.000   0.829
    2    HA   ARG  43           HA       ARG  43   1.462   0.578  -1.938
    3   1HB   ARG  43          2HB       ARG  43   3.802   0.490  -0.052
    4   2HB   ARG  43          3HB       ARG  43   4.162   0.203  -1.743
    5   1HG   ARG  43          2HG       ARG  43   3.875   2.397  -2.272
    6   2HG   ARG  43          3HG       ARG  43   2.321   2.462  -1.464
    7   1HD   ARG  43          2HD       ARG  43   3.353   3.808   0.065
    8   2HD   ARG  43          3HD       ARG  43   4.070   2.338   0.696
    9    HE   ARG  43           HE       ARG  43   6.129   3.032  -0.151
   10   1HH1  ARG  43          2HH2      ARG  43   3.574   4.707  -1.897
   11   2HH1  ARG  43          1HH2      ARG  43   4.668   5.701  -2.800
   12   1HH2  ARG  43          2HH1      ARG  43   7.573   4.344  -1.342
   13   2HH2  ARG  43          1HH1      ARG  43   6.958   5.493  -2.482
   14    H    GLN  44           H        GLN  44   3.426  -1.896  -0.109
   15    HA   GLN  44           HA       GLN  44   2.583  -3.823  -2.119
   16   1HB   GLN  44          2HB       GLN  44   5.343  -2.959  -1.433
   17   2HB   GLN  44          3HB       GLN  44   5.124  -4.697  -1.483
   18   1HG   GLN  44          2HG       GLN  44   4.447  -4.679  -3.765
   19   2HG   GLN  44          3HG       GLN  44   4.032  -2.977  -3.731
   20   1HE2  GLN  44          1HE2      GLN  44   6.159  -5.095  -4.912
   21   2HE2  GLN  44          2HE2      GLN  44   7.590  -4.131  -5.067
   22    H    ILE  45           H        ILE  45   1.729  -3.128   0.705
   23    HA   ILE  45           HA       ILE  45   2.482  -5.658   1.992
   24    HB   ILE  45           HB       ILE  45   1.844  -2.934   3.059
   25   1HG1  ILE  45          2HG1      ILE  45   3.898  -4.666   4.291
   26   2HG1  ILE  45          3HG1      ILE  45   4.202  -4.247   2.616
   27   1HG2  ILE  45          1HG2      ILE  45   0.298  -4.518   4.174
   28   2HG2  ILE  45          2HG2      ILE  45   1.702  -5.482   4.693
   29   3HG2  ILE  45          3HG2      ILE  45   1.501  -3.813   5.279
   30   1HD1  ILE  45          1HD1      ILE  45   3.245  -1.912   4.099
   31   2HD1  ILE  45          2HD1      ILE  45   4.682  -2.623   4.871
   32   3HD1  ILE  45          3HD1      ILE  45   4.747  -2.116   3.166
   33    H    LYS  46           H        LYS  46  -0.021  -3.821   0.446
   34    HA   LYS  46           HA       LYS  46  -2.104  -5.406   1.727
   35   1HB   LYS  46          2HB       LYS  46  -2.783  -3.192   1.659
   36   2HB   LYS  46          3HB       LYS  46  -2.038  -2.885   0.104
   37   1HG   LYS  46          2HG       LYS  46  -3.743  -4.220  -1.050
   38   2HG   LYS  46          3HG       LYS  46  -4.423  -4.753   0.474
   39   1HD   LYS  46          2HD       LYS  46  -4.630  -2.093   0.891
   40   2HD   LYS  46          3HD       LYS  46  -4.629  -2.060  -0.861
   41   1HE   LYS  46          2HE       LYS  46  -6.443  -3.997  -0.614
   42   2HE   LYS  46          3HE       LYS  46  -6.633  -3.354   1.005
   43   1HZ   LYS  46          1HZ       LYS  46  -8.119  -2.231  -0.404
   44   2HZ   LYS  46          2HZ       LYS  46  -6.938  -1.156  -0.061
   45   3HZ   LYS  46          3HZ       LYS  46  -6.973  -1.894  -1.517
   46    H    ILE  47           H        ILE  47   0.036  -5.490  -0.946
   47    HA   ILE  47           HA       ILE  47  -1.838  -7.143  -2.476
   48    HB   ILE  47           HB       ILE  47   0.032  -6.868  -4.234
   49   1HG1  ILE  47          2HG1      ILE  47   1.363  -4.840  -4.055
   50   2HG1  ILE  47          3HG1      ILE  47   0.676  -4.479  -2.483
   51   1HG2  ILE  47          1HG2      ILE  47  -1.478  -5.556  -5.193
   52   2HG2  ILE  47          2HG2      ILE  47  -2.320  -5.454  -3.627
   53   3HG2  ILE  47          3HG2      ILE  47  -1.111  -4.225  -4.070
   54   1HD1  ILE  47          1HD1      ILE  47   1.873  -6.164  -1.404
   55   2HD1  ILE  47          2HD1      ILE  47   1.968  -7.176  -2.866
   56   3HD1  ILE  47          3HD1      ILE  47   3.017  -5.746  -2.702
   57    H    TRP  48           H        TRP  48   0.756  -7.252  -0.235
   58    HA   TRP  48           HA       TRP  48   1.735  -9.801  -1.247
   59   1HB   TRP  48          2HB       TRP  48   2.835  -7.636   0.271
   60   2HB   TRP  48          3HB       TRP  48   2.924  -9.099   1.232
   61    HD1  TRP  48           HD1      TRP  48   5.223  -7.375  -0.767
   62    HE1  TRP  48           HE1      TRP  48   6.958  -8.836  -2.117
   63    HE3  TRP  48           HE3      TRP  48   2.608 -11.724  -0.444
   64    HZ2  TRP  48           HZ2      TRP  48   7.040 -11.584  -2.880
   65    HZ3  TRP  48           HZ3      TRP  48   3.586 -13.750  -1.518
   66    HH2  TRP  48           HH2      TRP  48   5.723 -13.728  -2.705
   67    H    PHE  49           H        PHE  49  -0.294  -8.295   1.265
   68    HA   PHE  49           HA       PHE  49  -0.411 -10.520   2.975
   69   1HB   PHE  49          2HB       PHE  49  -2.018  -8.007   2.359
   70   2HB   PHE  49          3HB       PHE  49  -2.734  -9.189   3.436
   71    HD1  PHE  49           HD1      PHE  49   0.891  -8.642   3.363
   72    HD2  PHE  49           HD2      PHE  49  -2.749  -7.677   5.318
   73    HE1  PHE  49           HE1      PHE  49   2.181  -7.671   5.285
   74    HE2  PHE  49           HE2      PHE  49  -1.460  -6.707   7.240
   75    HZ   PHE  49           HZ       PHE  49   0.990  -6.715   7.201
   76    H    GLN  50           H        GLN  50  -2.186  -9.571   0.023
   77    HA   GLN  50           HA       GLN  50  -4.121 -11.642   0.449
   78   1HB   GLN  50          2HB       GLN  50  -5.265 -10.744  -1.420
   79   2HB   GLN  50          3HB       GLN  50  -4.557  -9.341  -0.643
   80   1HG   GLN  50          2HG       GLN  50  -3.729  -8.863  -2.720
   81   2HG   GLN  50          3HG       GLN  50  -2.506 -10.058  -2.336
   82   1HE2  GLN  50          1HE2      GLN  50  -2.963  -9.648  -4.896
   83   2HE2  GLN  50          2HE2      GLN  50  -3.846 -10.936  -5.643
   84    H    ASN  51           H        ASN  51  -0.938 -11.406  -0.764
   85    HA   ASN  51           HA       ASN  51  -1.311 -13.412  -2.780
   86   1HB   ASN  51          2HB       ASN  51   0.789 -11.497  -1.982
   87   2HB   ASN  51          3HB       ASN  51   1.463 -13.083  -2.300
   88   1HD2  ASN  51          1HD2      ASN  51   0.566 -10.195  -3.626
   89   2HD2  ASN  51          2HD2      ASN  51   0.431 -10.626  -5.299
   90    H    ARG  52           H        ARG  52   0.116 -12.944   0.504
   91    HA   ARG  52           HA       ARG  52   1.258 -15.490   0.635
   92   1HB   ARG  52          2HB       ARG  52   1.305 -13.159   2.186
   93   2HB   ARG  52          3HB       ARG  52   0.452 -14.283   3.225
   94   1HG   ARG  52          2HG       ARG  52   2.506 -15.888   2.325
   95   2HG   ARG  52          3HG       ARG  52   3.295 -14.323   2.318
   96   1HD   ARG  52          2HD       ARG  52   1.983 -14.243   4.756
   97   2HD   ARG  52          3HD       ARG  52   2.346 -15.953   4.626
   98    HE   ARG  52           HE       ARG  52   4.285 -13.767   4.928
   99   1HH1  ARG  52          2HH2      ARG  52   3.817 -17.116   3.953
  100   2HH1  ARG  52          1HH2      ARG  52   5.478 -17.550   4.187
  101   1HH2  ARG  52          2HH1      ARG  52   6.476 -14.339   5.237
  102   2HH2  ARG  52          1HH1      ARG  52   7.000 -15.960   4.922
  103    H    ARG  53           H        ARG  53  -1.992 -14.247   1.019
  104    HA   ARG  53           HA       ARG  53  -2.983 -16.049   2.846
  105   1HB   ARG  53          2HB       ARG  53  -4.006 -14.041   1.034
  106   2HB   ARG  53          3HB       ARG  53  -5.001 -15.472   0.853
  107   1HG   ARG  53          2HG       ARG  53  -5.923 -15.248   2.935
  108   2HG   ARG  53          3HG       ARG  53  -4.383 -14.872   3.682
  109   1HD   ARG  53          2HD       ARG  53  -4.533 -12.530   2.745
  110   2HD   ARG  53          3HD       ARG  53  -6.109 -12.918   2.084
  111    HE   ARG  53           HE       ARG  53  -5.460 -12.451   4.914
  112   1HH1  ARG  53          2HH2      ARG  53  -7.792 -13.794   2.646
  113   2HH1  ARG  53          1HH2      ARG  53  -9.115 -13.712   3.760
  114   1HH2  ARG  53          2HH1      ARG  53  -7.206 -12.343   6.385
  115   2HH2  ARG  53          1HH1      ARG  53  -8.780 -12.881   5.901
  116    H    MET  54           H        MET  54  -1.867 -16.489  -0.412
  117    HA   MET  54           HA       MET  54  -3.557 -18.721  -0.964
  118   1HB   MET  54          2HB       MET  54  -2.707 -17.236  -2.778
  119   2HB   MET  54          3HB       MET  54  -1.051 -17.588  -2.327
  120   1HG   MET  54          2HG       MET  54  -1.048 -19.611  -3.416
  121   2HG   MET  54          3HG       MET  54  -2.655 -20.028  -2.856
  122   1HE   MET  54          1HE       MET  54  -4.224 -20.632  -5.026
  123   2HE   MET  54          2HE       MET  54  -4.724 -19.466  -3.778
  124   3HE   MET  54          3HE       MET  54  -5.012 -19.107  -5.497
  125    H    LYS  55           H        LYS  55  -0.603 -18.144   0.763
  126    HA   LYS  55           HA       LYS  55   0.720 -20.561   0.268
  127   1HB   LYS  55          2HB       LYS  55   1.358 -18.266   1.529
  128   2HB   LYS  55          3HB       LYS  55   0.990 -19.253   2.929
  129   1HG   LYS  55          2HG       LYS  55   2.506 -20.988   1.343
  130   2HG   LYS  55          3HG       LYS  55   3.266 -19.438   1.044
  131   1HD   LYS  55          2HD       LYS  55   4.426 -20.063   2.958
  132   2HD   LYS  55          3HD       LYS  55   3.100 -19.191   3.701
  133   1HE   LYS  55          2HE       LYS  55   2.612 -22.099   3.151
  134   2HE   LYS  55          3HE       LYS  55   3.793 -21.741   4.395
  135   1HZ   LYS  55          1HZ       LYS  55   1.682 -21.837   5.394
  136   2HZ   LYS  55          2HZ       LYS  55   2.097 -20.258   5.380
  137   3HZ   LYS  55          3HZ       LYS  55   1.006 -20.825   4.305
  138    H    TRP  56           H        TRP  56  -1.754 -19.570   2.700
  139    HA   TRP  56           HA       TRP  56  -1.762 -21.736   4.326
  140   1HB   TRP  56          2HB       TRP  56  -3.556 -19.615   3.637
  141   2HB   TRP  56          3HB       TRP  56  -4.475 -21.100   3.780
  142    HD1  TRP  56           HD1      TRP  56  -1.415 -20.256   6.025
  143    HE1  TRP  56           HE1      TRP  56  -2.125 -20.120   8.563
  144    HE3  TRP  56           HE3      TRP  56  -6.403 -20.795   5.202
  145    HZ2  TRP  56           HZ2      TRP  56  -4.637 -20.250   9.911
  146    HZ3  TRP  56           HZ3      TRP  56  -7.916 -20.780   7.183
  147    HH2  TRP  56           HH2      TRP  56  -7.106 -20.519   9.475
  148    H    LYS  57           H        LYS  57  -3.552 -21.353   1.181
  149    HA   LYS  57           HA       LYS  57  -4.799 -23.719   1.007
  150   1HB   LYS  57          2HB       LYS  57  -4.465 -21.686  -0.672
  151   2HB   LYS  57          3HB       LYS  57  -3.309 -22.775  -1.413
  152   1HG   LYS  57          2HG       LYS  57  -5.526 -24.429  -0.906
  153   2HG   LYS  57          3HG       LYS  57  -6.256 -22.910  -1.387
  154   1HD   LYS  57          2HD       LYS  57  -5.940 -24.003  -3.455
  155   2HD   LYS  57          3HD       LYS  57  -4.550 -22.939  -3.371
  156   1HE   LYS  57          2HE       LYS  57  -3.049 -24.694  -2.915
  157   2HE   LYS  57          3HE       LYS  57  -4.287 -25.715  -2.209
  158   1HZ   LYS  57          1HZ       LYS  57  -5.211 -25.564  -4.636
  159   2HZ   LYS  57          2HZ       LYS  57  -3.639 -25.302  -4.995
  160   3HZ   LYS  57          3HZ       LYS  57  -4.083 -26.670  -4.221
  161    H    LYS  58           H        LYS  58  -4.087 -25.692   1.634
  162    HA   LYS  58           HA       LYS  58  -1.472 -26.472   1.815
  163   1HB   LYS  58          2HB       LYS  58  -4.002 -28.087   1.420
  164   2HB   LYS  58          3HB       LYS  58  -2.444 -28.817   1.753
  165   1HG   LYS  58          2HG       LYS  58  -2.397 -28.071   3.944
  166   2HG   LYS  58          3HG       LYS  58  -3.211 -26.565   3.566
  167   1HD   LYS  58          2HD       LYS  58  -4.716 -29.199   3.413
  168   2HD   LYS  58          3HD       LYS  58  -4.490 -28.400   4.956
  169   1HE   LYS  58          2HE       LYS  58  -6.483 -27.391   4.338
  170   2HE   LYS  58          3HE       LYS  58  -5.378 -26.259   3.586
  171   1HZ   LYS  58          1HZ       LYS  58  -5.739 -27.186   1.528
  172   2HZ   LYS  58          2HZ       LYS  58  -6.304 -28.603   2.113
  173   3HZ   LYS  58          3HZ       LYS  58  -7.229 -27.259   2.194
  Start of MODEL    2
    1    H    ARG  43           H        ARG  43   2.436   2.248  -1.490
    2    HA   ARG  43           HA       ARG  43   1.804   0.436  -0.292
    3   1HB   ARG  43          2HB       ARG  43  -0.025   1.344  -2.392
    4   2HB   ARG  43          3HB       ARG  43  -0.366  -0.324  -1.979
    5   1HG   ARG  43          2HG       ARG  43  -0.395   0.358   0.474
    6   2HG   ARG  43          3HG       ARG  43  -0.229   2.027  -0.035
    7   1HD   ARG  43          2HD       ARG  43  -2.452   0.341  -1.218
    8   2HD   ARG  43          3HD       ARG  43  -2.643   0.994   0.397
    9    HE   ARG  43           HE       ARG  43  -2.757   3.182  -0.495
   10   1HH1  ARG  43          2HH2      ARG  43  -1.838   0.880  -2.994
   11   2HH1  ARG  43          1HH2      ARG  43  -2.073   2.002  -4.293
   12   1HH2  ARG  43          2HH1      ARG  43  -3.067   4.662  -2.208
   13   2HH2  ARG  43          1HH1      ARG  43  -2.777   4.167  -3.843
   14    H    GLN  44           H        GLN  44   2.644  -1.610  -0.033
   15    HA   GLN  44           HA       GLN  44   2.231  -3.500  -2.154
   16   1HB   GLN  44          2HB       GLN  44   4.888  -2.341  -1.502
   17   2HB   GLN  44          3HB       GLN  44   4.863  -4.093  -1.550
   18   1HG   GLN  44          2HG       GLN  44   3.558  -3.788  -3.817
   19   2HG   GLN  44          3HG       GLN  44   4.156  -2.143  -3.768
   20   1HE2  GLN  44          1HE2      GLN  44   5.244  -2.739  -5.735
   21   2HE2  GLN  44          2HE2      GLN  44   6.783  -3.533  -5.688
   22    H    ILE  45           H        ILE  45   1.336  -2.926   0.680
   23    HA   ILE  45           HA       ILE  45   2.368  -5.376   1.930
   24    HB   ILE  45           HB       ILE  45   1.557  -2.717   3.018
   25   1HG1  ILE  45          2HG1      ILE  45   3.566  -3.733   4.574
   26   2HG1  ILE  45          3HG1      ILE  45   3.919  -4.490   3.034
   27   1HG2  ILE  45          1HG2      ILE  45   1.455  -5.288   4.619
   28   2HG2  ILE  45          2HG2      ILE  45   1.259  -3.635   5.250
   29   3HG2  ILE  45          3HG2      ILE  45   0.051  -4.310   4.130
   30   1HD1  ILE  45          1HD1      ILE  45   3.415  -1.984   2.134
   31   2HD1  ILE  45          2HD1      ILE  45   3.960  -1.589   3.782
   32   3HD1  ILE  45          3HD1      ILE  45   5.029  -2.495   2.685
   33    H    LYS  46           H        LYS  46  -0.294  -3.850   0.371
   34    HA   LYS  46           HA       LYS  46  -2.204  -5.613   1.702
   35   1HB   LYS  46          2HB       LYS  46  -3.917  -4.232   0.760
   36   2HB   LYS  46          3HB       LYS  46  -2.720  -3.188   1.503
   37   1HG   LYS  46          2HG       LYS  46  -1.818  -2.510  -0.596
   38   2HG   LYS  46          3HG       LYS  46  -2.505  -3.881  -1.444
   39   1HD   LYS  46          2HD       LYS  46  -4.635  -2.341  -0.177
   40   2HD   LYS  46          3HD       LYS  46  -3.637  -1.279  -1.153
   41   1HE   LYS  46          2HE       LYS  46  -4.314  -2.239  -3.129
   42   2HE   LYS  46          3HE       LYS  46  -4.266  -3.865  -2.476
   43   1HZ   LYS  46          1HZ       LYS  46  -6.310  -2.860  -1.149
   44   2HZ   LYS  46          2HZ       LYS  46  -6.444  -1.996  -2.528
   45   3HZ   LYS  46          3HZ       LYS  46  -6.468  -3.628  -2.581
   46    H    ILE  47           H        ILE  47  -0.064  -5.545  -0.935
   47    HA   ILE  47           HA       ILE  47  -1.812  -7.285  -2.516
   48    HB   ILE  47           HB       ILE  47   0.119  -6.900  -4.211
   49   1HG1  ILE  47          2HG1      ILE  47   1.267  -4.766  -3.993
   50   2HG1  ILE  47          3HG1      ILE  47   0.488  -4.458  -2.453
   51   1HG2  ILE  47          1HG2      ILE  47  -2.264  -5.340  -3.514
   52   2HG2  ILE  47          2HG2      ILE  47  -1.074  -4.441  -4.485
   53   3HG2  ILE  47          3HG2      ILE  47  -1.725  -5.986  -5.082
   54   1HD1  ILE  47          1HD1      ILE  47   1.793  -6.004  -1.311
   55   2HD1  ILE  47          2HD1      ILE  47   1.992  -7.048  -2.739
   56   3HD1  ILE  47          3HD1      ILE  47   2.937  -5.547  -2.596
   57    H    TRP  48           H        TRP  48   0.763  -7.260  -0.236
   58    HA   TRP  48           HA       TRP  48   1.922  -9.726  -1.237
   59   1HB   TRP  48          2HB       TRP  48   2.921  -7.552   0.158
   60   2HB   TRP  48          3HB       TRP  48   2.790  -8.793   1.389
   61    HD1  TRP  48           HD1      TRP  48   5.138  -7.655  -1.225
   62    HE1  TRP  48           HE1      TRP  48   7.064  -9.382  -1.743
   63    HE3  TRP  48           HE3      TRP  48   2.974 -11.585   1.167
   64    HZ2  TRP  48           HZ2      TRP  48   7.458 -12.136  -1.107
   65    HZ3  TRP  48           HZ3      TRP  48   4.195 -13.758   1.172
   66    HH2  TRP  48           HH2      TRP  48   6.363 -14.068   0.087
   67    H    PHE  49           H        PHE  49  -0.168  -8.416   1.380
   68    HA   PHE  49           HA       PHE  49  -0.277 -10.713   2.940
   69   1HB   PHE  49          2HB       PHE  49  -2.121  -8.349   2.316
   70   2HB   PHE  49          3HB       PHE  49  -2.635  -9.575   3.458
   71    HD1  PHE  49           HD1      PHE  49  -2.751  -7.462   4.940
   72    HD2  PHE  49           HD2      PHE  49   0.888  -9.146   3.547
   73    HE1  PHE  49           HE1      PHE  49  -1.503  -6.280   6.770
   74    HE2  PHE  49           HE2      PHE  49   2.136  -7.964   5.377
   75    HZ   PHE  49           HZ       PHE  49   0.925  -6.545   6.966
   76    H    GLN  50           H        GLN  50  -2.011  -9.764  -0.041
   77    HA   GLN  50           HA       GLN  50  -3.966 -11.773   0.209
   78   1HB   GLN  50          2HB       GLN  50  -4.581  -9.953  -1.162
   79   2HB   GLN  50          3HB       GLN  50  -3.043  -9.928  -2.001
   80   1HG   GLN  50          2HG       GLN  50  -4.505 -12.492  -2.307
   81   2HG   GLN  50          3HG       GLN  50  -5.379 -11.115  -2.948
   82   1HE2  GLN  50          1HE2      GLN  50  -2.834 -13.317  -3.378
   83   2HE2  GLN  50          2HE2      GLN  50  -2.141 -12.680  -4.832
   84    H    ASN  51           H        ASN  51  -0.689 -11.569  -1.172
   85    HA   ASN  51           HA       ASN  51  -0.884 -13.864  -2.743
   86   1HB   ASN  51          2HB       ASN  51   1.387 -12.239  -1.556
   87   2HB   ASN  51          3HB       ASN  51   1.761 -13.782  -2.298
   88   1HD2  ASN  51          1HD2      ASN  51   1.866 -13.968  -4.436
   89   2HD2  ASN  51          2HD2      ASN  51   1.498 -12.726  -5.586
   90    H    ARG  52           H        ARG  52   0.469 -13.176   0.566
   91    HA   ARG  52           HA       ARG  52   1.149 -15.851   1.031
   92   1HB   ARG  52          2HB       ARG  52   1.753 -15.115   3.244
   93   2HB   ARG  52          3HB       ARG  52   2.103 -13.761   2.187
   94   1HG   ARG  52          2HG       ARG  52   0.767 -12.474   3.491
   95   2HG   ARG  52          3HG       ARG  52  -0.606 -13.397   2.916
   96   1HD   ARG  52          2HD       ARG  52  -0.845 -13.805   5.188
   97   2HD   ARG  52          3HD       ARG  52   0.217 -15.142   4.795
   98    HE   ARG  52           HE       ARG  52   1.638 -12.665   5.486
   99   1HH1  ARG  52          2HH2      ARG  52   0.227 -15.644   6.718
  100   2HH1  ARG  52          1HH2      ARG  52   1.186 -15.652   8.160
  101   1HH2  ARG  52          2HH1      ARG  52   2.904 -12.676   7.389
  102   2HH2  ARG  52          1HH1      ARG  52   2.719 -13.953   8.544
  103    H    ARG  53           H        ARG  53  -1.854 -14.321   0.798
  104    HA   ARG  53           HA       ARG  53  -3.113 -15.632   2.975
  105   1HB   ARG  53          2HB       ARG  53  -3.755 -13.533   1.133
  106   2HB   ARG  53          3HB       ARG  53  -4.973 -14.770   0.896
  107   1HG   ARG  53          2HG       ARG  53  -5.539 -14.764   3.284
  108   2HG   ARG  53          3HG       ARG  53  -4.201 -13.690   3.645
  109   1HD   ARG  53          2HD       ARG  53  -5.233 -11.842   2.473
  110   2HD   ARG  53          3HD       ARG  53  -6.415 -12.886   1.710
  111    HE   ARG  53           HE       ARG  53  -6.543 -12.981   4.631
  112   1HH1  ARG  53          2HH2      ARG  53  -7.617 -11.237   1.770
  113   2HH1  ARG  53          1HH2      ARG  53  -9.019 -10.576   2.544
  114   1HH2  ARG  53          2HH1      ARG  53  -8.391 -12.110   5.652
  115   2HH2  ARG  53          1HH1      ARG  53  -9.463 -11.075   4.766
  116    H    MET  54           H        MET  54  -2.202 -16.416  -0.299
  117    HA   MET  54           HA       MET  54  -4.001 -18.715  -0.207
  118   1HB   MET  54          2HB       MET  54  -3.145 -16.835  -2.392
  119   2HB   MET  54          3HB       MET  54  -3.230 -18.524  -2.854
  120   1HG   MET  54          2HG       MET  54  -5.600 -18.471  -1.672
  121   2HG   MET  54          3HG       MET  54  -5.462 -16.733  -1.845
  122   1HE   MET  54          1HE       MET  54  -7.685 -18.898  -4.427
  123   2HE   MET  54          2HE       MET  54  -6.350 -20.062  -4.248
  124   3HE   MET  54          3HE       MET  54  -7.067 -19.302  -2.808
  125    H    LYS  55           H        LYS  55  -1.326 -18.456   1.058
  126    HA   LYS  55           HA       LYS  55   0.035 -20.532  -0.509
  127   1HB   LYS  55          2HB       LYS  55   1.002 -17.991  -0.208
  128   2HB   LYS  55          3HB       LYS  55   1.738 -18.792   1.167
  129   1HG   LYS  55          2HG       LYS  55   1.990 -20.625  -0.998
  130   2HG   LYS  55          3HG       LYS  55   2.377 -19.055  -1.673
  131   1HD   LYS  55          2HD       LYS  55   3.595 -19.513   0.993
  132   2HD   LYS  55          3HD       LYS  55   4.126 -20.665  -0.217
  133   1HE   LYS  55          2HE       LYS  55   4.045 -17.832  -1.151
  134   2HE   LYS  55          3HE       LYS  55   5.209 -18.148   0.120
  135   1HZ   LYS  55          1HZ       LYS  55   5.191 -19.075  -2.586
  136   2HZ   LYS  55          2HZ       LYS  55   6.452 -18.823  -1.579
  137   3HZ   LYS  55          3HZ       LYS  55   5.605 -20.217  -1.495
  138    H    TRP  56           H        TRP  56  -0.593 -19.036   2.715
  139    HA   TRP  56           HA       TRP  56   0.616 -20.906   4.305
  140   1HB   TRP  56          2HB       TRP  56  -1.403 -18.846   4.580
  141   2HB   TRP  56          3HB       TRP  56  -1.762 -20.218   5.609
  142    HD1  TRP  56           HD1      TRP  56   1.913 -19.261   4.954
  143    HE1  TRP  56           HE1      TRP  56   3.083 -18.392   7.154
  144    HE3  TRP  56           HE3      TRP  56  -2.316 -19.119   7.772
  145    HZ2  TRP  56           HZ2      TRP  56   2.130 -17.757   9.768
  146    HZ3  TRP  56           HZ3      TRP  56  -2.109 -18.363  10.139
  147    HH2  TRP  56           HH2      TRP  56   0.016 -17.696  11.143
  148    H    LYS  57           H        LYS  57  -2.730 -20.903   2.896
  149    HA   LYS  57           HA       LYS  57  -3.071 -23.644   3.799
  150   1HB   LYS  57          2HB       LYS  57  -4.873 -21.985   4.151
  151   2HB   LYS  57          3HB       LYS  57  -5.001 -21.753   2.420
  152   1HG   LYS  57          2HG       LYS  57  -6.381 -23.542   2.275
  153   2HG   LYS  57          3HG       LYS  57  -5.104 -24.583   2.872
  154   1HD   LYS  57          2HD       LYS  57  -5.786 -24.296   5.163
  155   2HD   LYS  57          3HD       LYS  57  -6.796 -22.917   4.775
  156   1HE   LYS  57          2HE       LYS  57  -8.565 -24.231   4.150
  157   2HE   LYS  57          3HE       LYS  57  -7.548 -25.339   3.250
  158   1HZ   LYS  57          1HZ       LYS  57  -7.340 -26.665   5.014
  159   2HZ   LYS  57          2HZ       LYS  57  -7.227 -25.449   6.099
  160   3HZ   LYS  57          3HZ       LYS  57  -8.692 -25.928   5.559
  161    H    LYS  58           H        LYS  58  -3.240 -21.730   0.716
  162    HA   LYS  58           HA       LYS  58  -3.219 -22.452  -1.401
  163   1HB   LYS  58          2HB       LYS  58  -1.077 -22.909  -2.048
  164   2HB   LYS  58          3HB       LYS  58  -0.776 -22.364  -0.411
  165   1HG   LYS  58          2HG       LYS  58  -0.877 -24.784   0.355
  166   2HG   LYS  58          3HG       LYS  58  -1.027 -25.269  -1.322
  167   1HD   LYS  58          2HD       LYS  58   1.164 -24.366  -1.872
  168   2HD   LYS  58          3HD       LYS  58   1.288 -23.554  -0.325
  169   1HE   LYS  58          2HE       LYS  58   0.972 -26.044   0.632
  170   2HE   LYS  58          3HE       LYS  58   1.569 -26.495  -0.953
  171   1HZ   LYS  58          1HZ       LYS  58   2.987 -24.449   0.555
  172   2HZ   LYS  58          2HZ       LYS  58   3.205 -26.019   0.949
  173   3HZ   LYS  58          3HZ       LYS  58   3.564 -25.498  -0.557
  Start of MODEL    3
    1    H    ARG  43           H        ARG  43  -0.318   0.780  -0.189
    2    HA   ARG  43           HA       ARG  43  -0.415   0.248  -2.636
    3   1HB   ARG  43          2HB       ARG  43   1.857   1.241  -1.002
    4   2HB   ARG  43          3HB       ARG  43   2.354   0.662  -2.580
    5   1HG   ARG  43          2HG       ARG  43   0.430   2.097  -3.556
    6   2HG   ARG  43          3HG       ARG  43   0.297   2.826  -1.968
    7   1HD   ARG  43          2HD       ARG  43   1.816   4.309  -2.908
    8   2HD   ARG  43          3HD       ARG  43   2.953   3.142  -2.266
    9    HE   ARG  43           HE       ARG  43   2.391   2.130  -4.778
   10   1HH1  ARG  43          2HH2      ARG  43   3.458   5.274  -3.611
   11   2HH1  ARG  43          1HH2      ARG  43   4.325   5.659  -5.060
   12   1HH2  ARG  43          2HH1      ARG  43   3.534   2.638  -6.689
   13   2HH2  ARG  43          1HH1      ARG  43   4.369   4.149  -6.823
   14    H    GLN  44           H        GLN  44   2.227  -1.364  -0.704
   15    HA   GLN  44           HA       GLN  44   2.026  -3.572  -2.597
   16   1HB   GLN  44          2HB       GLN  44   4.173  -1.904  -2.556
   17   2HB   GLN  44          3HB       GLN  44   4.682  -3.035  -1.317
   18   1HG   GLN  44          2HG       GLN  44   4.668  -4.885  -2.809
   19   2HG   GLN  44          3HG       GLN  44   3.602  -4.087  -3.948
   20   1HE2  GLN  44          1HE2      GLN  44   4.528  -3.484  -5.736
   21   2HE2  GLN  44          2HE2      GLN  44   6.161  -2.950  -5.955
   22    H    ILE  45           H        ILE  45   1.113  -2.733   0.334
   23    HA   ILE  45           HA       ILE  45   2.206  -5.108   1.667
   24    HB   ILE  45           HB       ILE  45   1.292  -2.433   2.627
   25   1HG1  ILE  45          2HG1      ILE  45   3.372  -3.342   4.199
   26   2HG1  ILE  45          3HG1      ILE  45   3.738  -4.061   2.644
   27   1HG2  ILE  45          1HG2      ILE  45  -0.104  -3.611   4.033
   28   2HG2  ILE  45          2HG2      ILE  45   0.965  -5.033   4.088
   29   3HG2  ILE  45          3HG2      ILE  45   1.400  -3.557   4.983
   30   1HD1  ILE  45          1HD1      ILE  45   3.598  -1.867   1.537
   31   2HD1  ILE  45          2HD1      ILE  45   3.095  -1.106   3.065
   32   3HD1  ILE  45          3HD1      ILE  45   4.735  -1.779   2.905
   33    H    LYS  46           H        LYS  46  -0.550  -3.736   0.099
   34    HA   LYS  46           HA       LYS  46  -2.381  -5.480   1.543
   35   1HB   LYS  46          2HB       LYS  46  -3.027  -3.497  -0.650
   36   2HB   LYS  46          3HB       LYS  46  -4.138  -4.250   0.476
   37   1HG   LYS  46          2HG       LYS  46  -1.948  -2.889   1.889
   38   2HG   LYS  46          3HG       LYS  46  -2.797  -1.788   0.822
   39   1HD   LYS  46          2HD       LYS  46  -4.969  -2.940   1.894
   40   2HD   LYS  46          3HD       LYS  46  -3.859  -3.332   3.192
   41   1HE   LYS  46          2HE       LYS  46  -4.826  -1.216   3.788
   42   2HE   LYS  46          3HE       LYS  46  -3.201  -0.851   3.247
   43   1HZ   LYS  46          1HZ       LYS  46  -4.454  -0.645   0.973
   44   2HZ   LYS  46          2HZ       LYS  46  -5.718  -0.295   1.945
   45   3HZ   LYS  46          3HZ       LYS  46  -4.360   0.610   2.015
   46    H    ILE  47           H        ILE  47  -0.348  -5.408  -1.250
   47    HA   ILE  47           HA       ILE  47  -1.987  -7.428  -2.582
   48    HB   ILE  47           HB       ILE  47  -0.182  -7.064  -4.386
   49   1HG1  ILE  47          2HG1      ILE  47   0.948  -4.933  -4.377
   50   2HG1  ILE  47          3HG1      ILE  47   0.192  -4.471  -2.866
   51   1HG2  ILE  47          1HG2      ILE  47  -1.763  -5.897  -5.440
   52   2HG2  ILE  47          2HG2      ILE  47  -2.684  -5.990  -3.919
   53   3HG2  ILE  47          3HG2      ILE  47  -1.682  -4.560  -4.268
   54   1HD1  ILE  47          1HD1      ILE  47   2.640  -5.458  -2.850
   55   2HD1  ILE  47          2HD1      ILE  47   1.489  -5.962  -1.590
   56   3HD1  ILE  47          3HD1      ILE  47   1.809  -7.027  -2.980
   57    H    TRP  48           H        TRP  48   0.506  -7.123  -0.299
   58    HA   TRP  48           HA       TRP  48   1.858  -9.553  -1.174
   59   1HB   TRP  48          2HB       TRP  48   2.709  -7.210   0.085
   60   2HB   TRP  48          3HB       TRP  48   2.741  -8.423   1.348
   61    HD1  TRP  48           HD1      TRP  48   4.877  -7.144  -1.371
   62    HE1  TRP  48           HE1      TRP  48   6.923  -8.711  -1.944
   63    HE3  TRP  48           HE3      TRP  48   3.145 -11.206   1.150
   64    HZ2  TRP  48           HZ2      TRP  48   7.571 -11.413  -1.292
   65    HZ3  TRP  48           HZ3      TRP  48   4.547 -13.268   1.132
   66    HH2  TRP  48           HH2      TRP  48   6.689 -13.413  -0.035
   67    H    PHE  49           H        PHE  49  -0.326  -8.191   1.323
   68    HA   PHE  49           HA       PHE  49  -0.245 -10.377   3.065
   69   1HB   PHE  49          2HB       PHE  49  -2.253  -8.175   2.342
   70   2HB   PHE  49          3HB       PHE  49  -2.616  -9.324   3.614
   71    HD1  PHE  49           HD1      PHE  49  -2.803  -7.120   4.931
   72    HD2  PHE  49           HD2      PHE  49   0.868  -8.636   3.436
   73    HE1  PHE  49           HE1      PHE  49  -1.546  -5.697   6.574
   74    HE2  PHE  49           HE2      PHE  49   2.125  -7.214   5.079
   75    HZ   PHE  49           HZ       PHE  49   0.903  -5.761   6.628
   76    H    GLN  50           H        GLN  50  -2.066  -9.719   0.064
   77    HA   GLN  50           HA       GLN  50  -3.792 -11.953   0.533
   78   1HB   GLN  50          2HB       GLN  50  -4.905 -11.294  -1.487
   79   2HB   GLN  50          3HB       GLN  50  -4.487  -9.810  -0.654
   80   1HG   GLN  50          2HG       GLN  50  -3.492  -9.152  -2.591
   81   2HG   GLN  50          3HG       GLN  50  -2.213 -10.287  -2.205
   82   1HE2  GLN  50          1HE2      GLN  50  -1.895 -12.028  -3.424
   83   2HE2  GLN  50          2HE2      GLN  50  -2.879 -12.531  -4.758
   84    H    ASN  51           H        ASN  51  -0.589 -11.638  -0.353
   85    HA   ASN  51           HA       ASN  51  -0.682 -13.652  -2.409
   86   1HB   ASN  51          2HB       ASN  51   1.367 -11.751  -1.301
   87   2HB   ASN  51          3HB       ASN  51   1.994 -13.267  -1.916
   88   1HD2  ASN  51          1HD2      ASN  51   2.715 -13.064  -3.883
   89   2HD2  ASN  51          2HD2      ASN  51   2.000 -12.168  -5.183
   90    H    ARG  52           H        ARG  52   0.534 -13.055   0.951
   91    HA   ARG  52           HA       ARG  52   1.637 -15.638   1.180
   92   1HB   ARG  52          2HB       ARG  52   1.891 -15.007   3.608
   93   2HB   ARG  52          3HB       ARG  52   2.531 -13.789   2.523
   94   1HG   ARG  52          2HG       ARG  52   0.598 -12.364   2.816
   95   2HG   ARG  52          3HG       ARG  52  -0.318 -13.641   3.591
   96   1HD   ARG  52          2HD       ARG  52   2.271 -12.988   4.926
   97   2HD   ARG  52          3HD       ARG  52   1.092 -11.691   4.948
   98    HE   ARG  52           HE       ARG  52   0.984 -14.051   6.546
   99   1HH1  ARG  52          2HH2      ARG  52  -1.149 -12.069   4.568
  100   2HH1  ARG  52          1HH2      ARG  52  -2.572 -12.477   5.468
  101   1HH2  ARG  52          2HH1      ARG  52  -0.893 -14.590   7.732
  102   2HH2  ARG  52          1HH1      ARG  52  -2.425 -13.921   7.280
  103    H    ARG  53           H        ARG  53  -1.555 -14.319   1.364
  104    HA   ARG  53           HA       ARG  53  -2.459 -16.353   3.185
  105   1HB   ARG  53          2HB       ARG  53  -3.271 -13.785   2.872
  106   2HB   ARG  53          3HB       ARG  53  -4.373 -14.529   1.730
  107   1HG   ARG  53          2HG       ARG  53  -5.488 -15.763   3.382
  108   2HG   ARG  53          3HG       ARG  53  -4.093 -15.819   4.441
  109   1HD   ARG  53          2HD       ARG  53  -5.193 -14.182   5.614
  110   2HD   ARG  53          3HD       ARG  53  -4.553 -13.106   4.388
  111    HE   ARG  53           HE       ARG  53  -6.878 -14.024   3.219
  112   1HH1  ARG  53          2HH2      ARG  53  -6.164 -12.581   6.349
  113   2HH1  ARG  53          1HH2      ARG  53  -7.728 -11.855   6.514
  114   1HH2  ARG  53          2HH1      ARG  53  -8.942 -13.067   3.438
  115   2HH2  ARG  53          1HH1      ARG  53  -9.319 -12.135   4.848
  116    H    MET  54           H        MET  54  -1.370 -16.839   0.338
  117    HA   MET  54           HA       MET  54  -3.781 -18.081  -0.742
  118   1HB   MET  54          2HB       MET  54  -2.025 -16.284  -1.956
  119   2HB   MET  54          3HB       MET  54  -1.357 -17.818  -2.479
  120   1HG   MET  54          2HG       MET  54  -4.076 -18.233  -2.882
  121   2HG   MET  54          3HG       MET  54  -3.926 -16.524  -3.235
  122   1HE   MET  54          1HE       MET  54  -4.255 -19.602  -4.583
  123   2HE   MET  54          2HE       MET  54  -4.726 -18.392  -5.800
  124   3HE   MET  54          3HE       MET  54  -3.460 -19.585  -6.176
  125    H    LYS  55           H        LYS  55  -0.568 -18.557   0.561
  126    HA   LYS  55           HA       LYS  55   0.100 -20.975  -0.641
  127   1HB   LYS  55          2HB       LYS  55   1.549 -19.430   0.763
  128   2HB   LYS  55          3HB       LYS  55   0.795 -20.128   2.182
  129   1HG   LYS  55          2HG       LYS  55   2.461 -21.687   2.050
  130   2HG   LYS  55          3HG       LYS  55   1.470 -22.414   0.801
  131   1HD   LYS  55          2HD       LYS  55   2.877 -20.385  -0.558
  132   2HD   LYS  55          3HD       LYS  55   4.060 -21.033   0.558
  133   1HE   LYS  55          2HE       LYS  55   4.366 -22.778  -0.859
  134   2HE   LYS  55          3HE       LYS  55   2.740 -23.315  -0.488
  135   1HZ   LYS  55          1HZ       LYS  55   1.916 -21.968  -2.264
  136   2HZ   LYS  55          2HZ       LYS  55   3.397 -21.353  -2.574
  137   3HZ   LYS  55          3HZ       LYS  55   3.096 -22.935  -2.845
  138    H    TRP  56           H        TRP  56  -1.640 -20.310   2.477
  139    HA   TRP  56           HA       TRP  56  -2.517 -23.108   2.425
  140   1HB   TRP  56          2HB       TRP  56  -2.401 -21.090   4.672
  141   2HB   TRP  56          3HB       TRP  56  -3.120 -22.682   4.808
  142    HD1  TRP  56           HD1      TRP  56  -0.010 -21.107   5.700
  143    HE1  TRP  56           HE1      TRP  56   2.056 -22.735   5.904
  144    HE3  TRP  56           HE3      TRP  56  -2.146 -24.977   3.188
  145    HZ2  TRP  56           HZ2      TRP  56   2.554 -25.399   5.011
  146    HZ3  TRP  56           HZ3      TRP  56  -0.802 -27.056   2.898
  147    HH2  TRP  56           HH2      TRP  56   1.471 -27.303   3.761
  148    H    LYS  57           H        LYS  57  -3.969 -22.352   0.566
  149    HA   LYS  57           HA       LYS  57  -5.905 -20.426   0.840
  150   1HB   LYS  57          2HB       LYS  57  -7.171 -21.883  -0.836
  151   2HB   LYS  57          3HB       LYS  57  -5.574 -21.323  -1.294
  152   1HG   LYS  57          2HG       LYS  57  -4.807 -23.450  -1.483
  153   2HG   LYS  57          3HG       LYS  57  -5.325 -23.838   0.147
  154   1HD   LYS  57          2HD       LYS  57  -7.201 -24.915  -0.582
  155   2HD   LYS  57          3HD       LYS  57  -7.610 -23.631  -1.703
  156   1HE   LYS  57          2HE       LYS  57  -5.557 -24.594  -3.106
  157   2HE   LYS  57          3HE       LYS  57  -5.828 -26.039  -2.151
  158   1HZ   LYS  57          1HZ       LYS  57  -7.369 -25.005  -4.275
  159   2HZ   LYS  57          2HZ       LYS  57  -7.411 -26.491  -3.599
  160   3HZ   LYS  57          3HZ       LYS  57  -8.302 -25.278  -2.963
  161    H    LYS  58           H        LYS  58  -5.632 -23.607   2.349
  162    HA   LYS  58           HA       LYS  58  -6.855 -24.632   3.872
  163   1HB   LYS  58          2HB       LYS  58  -7.685 -21.785   4.271
  164   2HB   LYS  58          3HB       LYS  58  -8.597 -23.034   5.095
  165   1HG   LYS  58          2HG       LYS  58  -6.234 -23.967   5.804
  166   2HG   LYS  58          3HG       LYS  58  -5.644 -22.379   5.356
  167   1HD   LYS  58          2HD       LYS  58  -8.043 -22.617   7.193
  168   2HD   LYS  58          3HD       LYS  58  -6.433 -22.846   7.844
  169   1HE   LYS  58          2HE       LYS  58  -6.911 -20.425   6.108
  170   2HE   LYS  58          3HE       LYS  58  -7.580 -20.411   7.728
  171   1HZ   LYS  58          1HZ       LYS  58  -4.761 -20.945   7.085
  172   2HZ   LYS  58          2HZ       LYS  58  -5.346 -19.529   7.653
  173   3HZ   LYS  58          3HZ       LYS  58  -5.397 -20.867   8.587
  Start of MODEL    4
    1    H    ARG  43           H        ARG  43   1.743  -0.556  -0.141
    2    HA   ARG  43           HA       ARG  43   0.049  -0.510  -1.930
    3   1HB   ARG  43          2HB       ARG  43   2.111   0.962  -3.196
    4   2HB   ARG  43          3HB       ARG  43   2.099  -0.570  -4.045
    5   1HG   ARG  43          2HG       ARG  43  -0.201  -0.335  -4.684
    6   2HG   ARG  43          3HG       ARG  43  -0.492   0.925  -3.501
    7   1HD   ARG  43          2HD       ARG  43   1.642   1.880  -5.144
    8   2HD   ARG  43          3HD       ARG  43   0.470   1.181  -6.243
    9    HE   ARG  43           HE       ARG  43  -1.079   2.856  -5.656
   10   1HH1  ARG  43          2HH2      ARG  43   1.640   2.902  -3.422
   11   2HH1  ARG  43          1HH2      ARG  43   1.175   4.399  -2.686
   12   1HH2  ARG  43          2HH1      ARG  43  -1.692   4.832  -4.686
   13   2HH2  ARG  43          1HH1      ARG  43  -0.733   5.505  -3.411
   14    H    GLN  44           H        GLN  44   3.253  -1.766  -1.208
   15    HA   GLN  44           HA       GLN  44   2.630  -4.267  -2.529
   16   1HB   GLN  44          2HB       GLN  44   5.114  -2.901  -1.602
   17   2HB   GLN  44          3HB       GLN  44   5.108  -4.643  -1.403
   18   1HG   GLN  44          2HG       GLN  44   4.496  -4.919  -3.813
   19   2HG   GLN  44          3HG       GLN  44   4.489  -3.177  -4.014
   20   1HE2  GLN  44          1HE2      GLN  44   6.060  -4.487  -5.648
   21   2HE2  GLN  44          2HE2      GLN  44   7.739  -4.348  -5.248
   22    H    ILE  45           H        ILE  45   1.300  -3.152   0.002
   23    HA   ILE  45           HA       ILE  45   2.060  -5.343   1.805
   24    HB   ILE  45           HB       ILE  45   2.500  -3.474   3.033
   25   1HG1  ILE  45          2HG1      ILE  45   0.594  -4.976   3.983
   26   2HG1  ILE  45          3HG1      ILE  45   1.009  -3.476   4.786
   27   1HG2  ILE  45          1HG2      ILE  45   0.805  -1.473   2.990
   28   2HG2  ILE  45          2HG2      ILE  45   2.025  -1.657   1.707
   29   3HG2  ILE  45          3HG2      ILE  45   0.343  -2.164   1.416
   30   1HD1  ILE  45          1HD1      ILE  45  -0.970  -2.448   4.209
   31   2HD1  ILE  45          2HD1      ILE  45  -1.040  -3.248   2.620
   32   3HD1  ILE  45          3HD1      ILE  45  -1.538  -4.130   4.084
   33    H    LYS  46           H        LYS  46  -0.293  -4.113  -0.384
   34    HA   LYS  46           HA       LYS  46  -2.432  -5.600   0.937
   35   1HB   LYS  46          2HB       LYS  46  -3.303  -3.542   0.402
   36   2HB   LYS  46          3HB       LYS  46  -2.313  -3.356  -1.032
   37   1HG   LYS  46          2HG       LYS  46  -3.662  -5.186  -2.149
   38   2HG   LYS  46          3HG       LYS  46  -4.694  -5.248  -0.733
   39   1HD   LYS  46          2HD       LYS  46  -5.861  -3.409  -1.386
   40   2HD   LYS  46          3HD       LYS  46  -4.396  -2.487  -1.659
   41   1HE   LYS  46          2HE       LYS  46  -4.915  -2.611  -3.877
   42   2HE   LYS  46          3HE       LYS  46  -4.348  -4.268  -3.796
   43   1HZ   LYS  46          1HZ       LYS  46  -6.443  -4.548  -4.566
   44   2HZ   LYS  46          2HZ       LYS  46  -6.758  -4.667  -2.968
   45   3HZ   LYS  46          3HZ       LYS  46  -7.072  -3.274  -3.761
   46    H    ILE  47           H        ILE  47   0.053  -5.966  -1.375
   47    HA   ILE  47           HA       ILE  47  -1.492  -7.992  -2.823
   48    HB   ILE  47           HB       ILE  47   0.619  -7.870  -4.323
   49   1HG1  ILE  47          2HG1      ILE  47   1.749  -5.714  -4.347
   50   2HG1  ILE  47          3HG1      ILE  47   0.805  -5.159  -2.979
   51   1HG2  ILE  47          1HG2      ILE  47  -1.276  -7.214  -5.404
   52   2HG2  ILE  47          2HG2      ILE  47  -1.721  -6.029  -4.152
   53   3HG2  ILE  47          3HG2      ILE  47  -0.438  -5.646  -5.324
   54   1HD1  ILE  47          1HD1      ILE  47   1.960  -6.478  -1.452
   55   2HD1  ILE  47          2HD1      ILE  47   2.317  -7.741  -2.655
   56   3HD1  ILE  47          3HD1      ILE  47   3.246  -6.222  -2.656
   57    H    TRP  48           H        TRP  48   0.784  -7.510  -0.291
   58    HA   TRP  48           HA       TRP  48   2.022 -10.114  -0.691
   59   1HB   TRP  48          2HB       TRP  48   2.778  -7.645   0.546
   60   2HB   TRP  48          3HB       TRP  48   2.808  -8.911   1.758
   61    HD1  TRP  48           HD1      TRP  48   5.284  -7.383  -0.171
   62    HE1  TRP  48           HE1      TRP  48   7.263  -8.912  -1.011
   63    HE3  TRP  48           HE3      TRP  48   2.856 -11.798   0.511
   64    HZ2  TRP  48           HZ2      TRP  48   7.584 -11.735  -1.288
   65    HZ3  TRP  48           HZ3      TRP  48   4.074 -13.895  -0.068
   66    HH2  TRP  48           HH2      TRP  48   6.357 -13.910  -0.940
   67    H    PHE  49           H        PHE  49  -0.411  -8.362   1.240
   68    HA   PHE  49           HA       PHE  49  -0.653 -10.261   3.289
   69   1HB   PHE  49          2HB       PHE  49  -2.345  -8.068   2.002
   70   2HB   PHE  49          3HB       PHE  49  -3.071  -9.073   3.240
   71    HD1  PHE  49           HD1      PHE  49   0.439  -8.575   3.716
   72    HD2  PHE  49           HD2      PHE  49  -3.367  -6.827   4.399
   73    HE1  PHE  49           HE1      PHE  49   1.433  -7.105   5.491
   74    HE2  PHE  49           HE2      PHE  49  -2.373  -5.357   6.174
   75    HZ   PHE  49           HZ       PHE  49   0.014  -5.514   6.700
   76    H    GLN  50           H        GLN  50  -2.039  -9.990   0.007
   77    HA   GLN  50           HA       GLN  50  -3.934 -12.057   0.528
   78   1HB   GLN  50          2HB       GLN  50  -4.506 -10.272  -1.043
   79   2HB   GLN  50          3HB       GLN  50  -3.099 -10.621  -2.028
   80   1HG   GLN  50          2HG       GLN  50  -4.178 -13.075  -2.120
   81   2HG   GLN  50          3HG       GLN  50  -5.653 -12.208  -1.736
   82   1HE2  GLN  50          1HE2      GLN  50  -2.882 -12.272  -3.939
   83   2HE2  GLN  50          2HE2      GLN  50  -3.684 -11.632  -5.334
   84    H    ASN  51           H        ASN  51  -0.656 -11.722  -0.803
   85    HA   ASN  51           HA       ASN  51  -0.642 -14.219  -2.085
   86   1HB   ASN  51          2HB       ASN  51   1.422 -12.170  -1.256
   87   2HB   ASN  51          3HB       ASN  51   1.998 -13.770  -1.678
   88   1HD2  ASN  51          1HD2      ASN  51   2.162 -11.058  -2.962
   89   2HD2  ASN  51          2HD2      ASN  51   1.654 -11.280  -4.603
   90    H    ARG  52           H        ARG  52   0.083 -12.963   1.186
   91    HA   ARG  52           HA       ARG  52   1.404 -15.314   2.023
   92   1HB   ARG  52          2HB       ARG  52   0.939 -12.670   3.042
   93   2HB   ARG  52          3HB       ARG  52   0.308 -13.780   4.242
   94   1HG   ARG  52          2HG       ARG  52   2.466 -13.954   4.963
   95   2HG   ARG  52          3HG       ARG  52   2.700 -15.009   3.583
   96   1HD   ARG  52          2HD       ARG  52   4.321 -13.517   2.959
   97   2HD   ARG  52          3HD       ARG  52   2.989 -12.527   2.395
   98    HE   ARG  52           HE       ARG  52   3.179 -11.888   5.094
   99   1HH1  ARG  52          2HH2      ARG  52   5.431 -11.869   2.390
  100   2HH1  ARG  52          1HH2      ARG  52   6.382 -10.568   3.026
  101   1HH2  ARG  52          2HH1      ARG  52   4.433 -10.173   5.934
  102   2HH2  ARG  52          1HH1      ARG  52   5.810  -9.597   5.055
  103    H    ARG  53           H        ARG  53  -1.911 -14.267   1.673
  104    HA   ARG  53           HA       ARG  53  -2.745 -16.476   3.376
  105   1HB   ARG  53          2HB       ARG  53  -3.842 -13.735   2.905
  106   2HB   ARG  53          3HB       ARG  53  -5.049 -15.004   2.964
  107   1HG   ARG  53          2HG       ARG  53  -4.407 -15.670   5.185
  108   2HG   ARG  53          3HG       ARG  53  -2.895 -14.789   5.101
  109   1HD   ARG  53          2HD       ARG  53  -4.071 -13.199   6.285
  110   2HD   ARG  53          3HD       ARG  53  -4.616 -12.712   4.692
  111    HE   ARG  53           HE       ARG  53  -6.386 -14.746   5.489
  112   1HH1  ARG  53          2HH2      ARG  53  -5.430 -11.578   6.687
  113   2HH1  ARG  53          1HH2      ARG  53  -6.959 -11.259   7.436
  114   1HH2  ARG  53          2HH1      ARG  53  -8.403 -14.325   6.477
  115   2HH2  ARG  53          1HH1      ARG  53  -8.661 -12.831   7.315
  116    H    MET  54           H        MET  54  -2.143 -17.738   1.289
  117    HA   MET  54           HA       MET  54  -4.257 -18.777   0.103
  118   1HB   MET  54          2HB       MET  54  -3.733 -16.088  -1.001
  119   2HB   MET  54          3HB       MET  54  -3.657 -17.305  -2.260
  120   1HG   MET  54          2HG       MET  54  -5.931 -18.027  -0.740
  121   2HG   MET  54          3HG       MET  54  -6.001 -16.278  -0.814
  122   1HE   MET  54          1HE       MET  54  -5.168 -19.410  -2.776
  123   2HE   MET  54          2HE       MET  54  -6.946 -19.491  -2.806
  124   3HE   MET  54          3HE       MET  54  -6.043 -19.227  -4.316
  125    H    LYS  55           H        LYS  55  -0.942 -17.612  -0.171
  126    HA   LYS  55           HA       LYS  55  -0.200 -19.308  -2.324
  127   1HB   LYS  55          2HB       LYS  55   0.993 -17.233  -1.803
  128   2HB   LYS  55          3HB       LYS  55   1.462 -17.863  -0.238
  129   1HG   LYS  55          2HG       LYS  55   3.006 -19.371  -1.140
  130   2HG   LYS  55          3HG       LYS  55   2.129 -19.539  -2.649
  131   1HD   LYS  55          2HD       LYS  55   3.650 -18.107  -3.548
  132   2HD   LYS  55          3HD       LYS  55   2.835 -16.834  -2.661
  133   1HE   LYS  55          2HE       LYS  55   4.708 -18.334  -0.948
  134   2HE   LYS  55          3HE       LYS  55   5.515 -17.639  -2.339
  135   1HZ   LYS  55          1HZ       LYS  55   5.519 -15.970  -0.777
  136   2HZ   LYS  55          2HZ       LYS  55   4.247 -15.549  -1.711
  137   3HZ   LYS  55          3HZ       LYS  55   3.997 -16.259  -0.261
  138    H    TRP  56           H        TRP  56  -0.381 -19.592   1.230
  139    HA   TRP  56           HA       TRP  56   0.602 -22.350   0.946
  140   1HB   TRP  56          2HB       TRP  56   0.597 -20.749   3.497
  141   2HB   TRP  56          3HB       TRP  56   1.422 -22.257   3.157
  142    HD1  TRP  56           HD1      TRP  56   2.101 -18.621   3.263
  143    HE1  TRP  56           HE1      TRP  56   4.414 -17.949   2.184
  144    HE3  TRP  56           HE3      TRP  56   2.903 -23.068   0.933
  145    HZ2  TRP  56           HZ2      TRP  56   6.277 -19.322   0.514
  146    HZ3  TRP  56           HZ3      TRP  56   4.993 -23.320  -0.402
  147    HH2  TRP  56           HH2      TRP  56   6.649 -21.538  -0.631
  148    H    LYS  57           H        LYS  57  -1.790 -22.509   0.121
  149    HA   LYS  57           HA       LYS  57  -3.322 -23.523   2.311
  150   1HB   LYS  57          2HB       LYS  57  -3.981 -21.239   2.587
  151   2HB   LYS  57          3HB       LYS  57  -4.239 -21.028   0.866
  152   1HG   LYS  57          2HG       LYS  57  -6.276 -22.130   0.887
  153   2HG   LYS  57          3HG       LYS  57  -5.777 -23.264   2.126
  154   1HD   LYS  57          2HD       LYS  57  -6.090 -21.613   3.887
  155   2HD   LYS  57          3HD       LYS  57  -6.294 -20.319   2.724
  156   1HE   LYS  57          2HE       LYS  57  -8.301 -21.888   1.850
  157   2HE   LYS  57          3HE       LYS  57  -8.224 -22.509   3.487
  158   1HZ   LYS  57          1HZ       LYS  57  -9.683 -20.512   3.032
  159   2HZ   LYS  57          2HZ       LYS  57  -8.721 -20.443   4.349
  160   3HZ   LYS  57          3HZ       LYS  57  -8.309 -19.630   2.995
  161    H    LYS  58           H        LYS  58  -3.264 -25.521   1.289
  162    HA   LYS  58           HA       LYS  58  -3.621 -25.860  -1.460
  163   1HB   LYS  58          2HB       LYS  58  -3.610 -27.607   0.958
  164   2HB   LYS  58          3HB       LYS  58  -4.326 -28.263  -0.500
  165   1HG   LYS  58          2HG       LYS  58  -1.800 -26.867  -1.074
  166   2HG   LYS  58          3HG       LYS  58  -1.576 -28.139   0.110
  167   1HD   LYS  58          2HD       LYS  58  -3.069 -29.564  -1.587
  168   2HD   LYS  58          3HD       LYS  58  -2.547 -28.357  -2.747
  169   1HE   LYS  58          2HE       LYS  58  -0.243 -28.928  -2.498
  170   2HE   LYS  58          3HE       LYS  58  -0.508 -29.728  -0.962
  171   1HZ   LYS  58          1HZ       LYS  58  -1.316 -31.566  -1.983
  172   2HZ   LYS  58          2HZ       LYS  58  -1.877 -30.775  -3.296
  173   3HZ   LYS  58          3HZ       LYS  58  -0.279 -31.074  -3.144
  Start of MODEL    5
    1    H    ARG  43           H        ARG  43  -1.411   0.578   1.773
    2    HA   ARG  43           HA       ARG  43   0.715   1.769   0.293
    3   1HB   ARG  43          2HB       ARG  43   0.051   1.688   2.977
    4   2HB   ARG  43          3HB       ARG  43   1.311   0.471   2.919
    5   1HG   ARG  43          2HG       ARG  43   2.971   2.001   2.351
    6   2HG   ARG  43          3HG       ARG  43   1.870   3.037   1.463
    7   1HD   ARG  43          2HD       ARG  43   0.812   3.650   3.743
    8   2HD   ARG  43          3HD       ARG  43   2.169   2.832   4.493
    9    HE   ARG  43           HE       ARG  43   2.957   4.817   2.475
   10   1HH1  ARG  43          2HH2      ARG  43   2.204   4.271   5.869
   11   2HH1  ARG  43          1HH2      ARG  43   3.076   5.664   6.418
   12   1HH2  ARG  43          2HH1      ARG  43   4.108   6.653   3.199
   13   2HH2  ARG  43          1HH1      ARG  43   4.166   7.028   4.890
   14    H    GLN  44           H        GLN  44   0.065  -0.444  -1.144
   15    HA   GLN  44           HA       GLN  44   0.602  -2.489  -1.764
   16   1HB   GLN  44          2HB       GLN  44   3.296  -2.682  -1.774
   17   2HB   GLN  44          3HB       GLN  44   2.419  -1.660  -2.896
   18   1HG   GLN  44          2HG       GLN  44   2.679   0.268  -1.275
   19   2HG   GLN  44          3HG       GLN  44   3.649  -0.766  -0.245
   20   1HE2  GLN  44          1HE2      GLN  44   5.487  -1.908  -1.370
   21   2HE2  GLN  44          2HE2      GLN  44   6.448  -0.986  -2.477
   22    H    ILE  45           H        ILE  45  -0.155  -2.479   1.003
   23    HA   ILE  45           HA       ILE  45   1.669  -4.528   2.057
   24    HB   ILE  45           HB       ILE  45   1.878  -2.796   3.552
   25   1HG1  ILE  45          2HG1      ILE  45   0.914  -5.042   4.490
   26   2HG1  ILE  45          3HG1      ILE  45   1.109  -3.650   5.537
   27   1HG2  ILE  45          1HG2      ILE  45  -0.029  -1.413   4.374
   28   2HG2  ILE  45          2HG2      ILE  45   0.306  -1.235   2.635
   29   3HG2  ILE  45          3HG2      ILE  45  -1.072  -2.221   3.179
   30   1HD1  ILE  45          1HD1      ILE  45  -1.189  -4.990   5.481
   31   2HD1  ILE  45          2HD1      ILE  45  -1.186  -3.217   5.641
   32   3HD1  ILE  45          3HD1      ILE  45  -1.502  -3.968   4.058
   33    H    LYS  46           H        LYS  46  -1.307  -3.923   0.577
   34    HA   LYS  46           HA       LYS  46  -2.499  -6.259   1.902
   35   1HB   LYS  46          2HB       LYS  46  -4.671  -5.369   1.247
   36   2HB   LYS  46          3HB       LYS  46  -3.795  -4.215   2.232
   37   1HG   LYS  46          2HG       LYS  46  -3.100  -3.758  -0.543
   38   2HG   LYS  46          3HG       LYS  46  -4.846  -3.844  -0.419
   39   1HD   LYS  46          2HD       LYS  46  -4.573  -2.235   1.637
   40   2HD   LYS  46          3HD       LYS  46  -2.956  -1.950   1.024
   41   1HE   LYS  46          2HE       LYS  46  -4.415  -0.235   0.100
   42   2HE   LYS  46          3HE       LYS  46  -3.953  -1.305  -1.208
   43   1HZ   LYS  46          1HZ       LYS  46  -6.382  -1.896   0.273
   44   2HZ   LYS  46          2HZ       LYS  46  -6.412  -0.689  -0.827
   45   3HZ   LYS  46          3HZ       LYS  46  -6.022  -2.206  -1.290
   46    H    ILE  47           H        ILE  47  -0.513  -5.677  -0.537
   47    HA   ILE  47           HA       ILE  47  -2.047  -7.278  -2.463
   48    HB   ILE  47           HB       ILE  47  -0.033  -6.374  -3.945
   49   1HG1  ILE  47          2HG1      ILE  47   0.416  -3.993  -3.374
   50   2HG1  ILE  47          3HG1      ILE  47  -0.385  -4.226  -1.833
   51   1HG2  ILE  47          1HG2      ILE  47  -2.669  -6.056  -3.970
   52   2HG2  ILE  47          2HG2      ILE  47  -2.225  -4.400  -3.493
   53   3HG2  ILE  47          3HG2      ILE  47  -1.591  -5.091  -5.005
   54   1HD1  ILE  47          1HD1      ILE  47   2.310  -4.624  -2.271
   55   2HD1  ILE  47          2HD1      ILE  47   1.390  -5.354  -0.934
   56   3HD1  ILE  47          3HD1      ILE  47   1.675  -6.280  -2.427
   57    H    TRP  48           H        TRP  48   0.738  -7.087  -0.326
   58    HA   TRP  48           HA       TRP  48   2.042  -9.339  -1.584
   59   1HB   TRP  48          2HB       TRP  48   2.889  -7.187  -0.049
   60   2HB   TRP  48          3HB       TRP  48   3.004  -8.547   1.051
   61    HD1  TRP  48           HD1      TRP  48   4.931  -6.906  -1.669
   62    HE1  TRP  48           HE1      TRP  48   7.016  -8.312  -2.468
   63    HE3  TRP  48           HE3      TRP  48   3.563 -11.225   0.639
   64    HZ2  TRP  48           HZ2      TRP  48   7.841 -11.013  -2.056
   65    HZ3  TRP  48           HZ3      TRP  48   5.064 -13.200   0.391
   66    HH2  TRP  48           HH2      TRP  48   7.139 -13.142  -0.901
   67    H    PHE  49           H        PHE  49  -0.148  -8.535   1.111
   68    HA   PHE  49           HA       PHE  49   0.165 -10.913   2.551
   69   1HB   PHE  49          2HB       PHE  49  -1.980  -8.770   2.156
   70   2HB   PHE  49          3HB       PHE  49  -2.328 -10.146   3.184
   71    HD1  PHE  49           HD1      PHE  49  -2.638  -8.614   5.080
   72    HD2  PHE  49           HD2      PHE  49   1.088  -8.900   3.070
   73    HE1  PHE  49           HE1      PHE  49  -1.512  -7.461   7.004
   74    HE2  PHE  49           HE2      PHE  49   2.215  -7.747   4.995
   75    HZ   PHE  49           HZ       PHE  49   0.901  -7.042   6.938
   76    H    GLN  50           H        GLN  50  -1.692 -10.065  -0.363
   77    HA   GLN  50           HA       GLN  50  -3.453 -12.235  -0.204
   78   1HB   GLN  50          2HB       GLN  50  -3.969 -10.276  -1.571
   79   2HB   GLN  50          3HB       GLN  50  -2.537 -10.522  -2.552
   80   1HG   GLN  50          2HG       GLN  50  -3.757 -12.983  -2.810
   81   2HG   GLN  50          3HG       GLN  50  -5.158 -11.946  -2.632
   82   1HE2  GLN  50          1HE2      GLN  50  -2.065 -12.213  -4.353
   83   2HE2  GLN  50          2HE2      GLN  50  -2.580 -11.515  -5.852
   84    H    ASN  51           H        ASN  51  -0.173 -11.759  -1.540
   85    HA   ASN  51           HA       ASN  51  -0.197 -14.191  -2.971
   86   1HB   ASN  51          2HB       ASN  51   1.813 -12.067  -2.258
   87   2HB   ASN  51          3HB       ASN  51   2.470 -13.644  -2.650
   88   1HD2  ASN  51          1HD2      ASN  51   2.053 -10.814  -3.944
   89   2HD2  ASN  51          2HD2      ASN  51   1.638 -11.174  -5.586
   90    H    ARG  52           H        ARG  52   0.753 -13.033   0.284
   91    HA   ARG  52           HA       ARG  52   1.909 -15.607   0.882
   92   1HB   ARG  52          2HB       ARG  52   2.262 -12.882   1.846
   93   2HB   ARG  52          3HB       ARG  52   1.865 -13.916   3.204
   94   1HG   ARG  52          2HG       ARG  52   3.879 -15.005   1.267
   95   2HG   ARG  52          3HG       ARG  52   4.398 -13.633   2.225
   96   1HD   ARG  52          2HD       ARG  52   3.658 -14.870   4.313
   97   2HD   ARG  52          3HD       ARG  52   3.275 -16.259   3.315
   98    HE   ARG  52           HE       ARG  52   5.958 -15.313   4.045
   99   1HH1  ARG  52          2HH2      ARG  52   4.086 -17.274   1.801
  100   2HH1  ARG  52          1HH2      ARG  52   5.434 -18.259   1.339
  101   1HH2  ARG  52          2HH1      ARG  52   7.735 -16.612   3.436
  102   2HH2  ARG  52          1HH1      ARG  52   7.523 -17.881   2.275
  103    H    ARG  53           H        ARG  53  -1.124 -14.726   0.535
  104    HA   ARG  53           HA       ARG  53  -2.158 -15.184   3.136
  105   1HB   ARG  53          2HB       ARG  53  -3.125 -13.943   0.872
  106   2HB   ARG  53          3HB       ARG  53  -3.960 -15.481   0.763
  107   1HG   ARG  53          2HG       ARG  53  -4.256 -14.839   3.463
  108   2HG   ARG  53          3HG       ARG  53  -4.338 -13.265   2.696
  109   1HD   ARG  53          2HD       ARG  53  -5.909 -15.048   1.082
  110   2HD   ARG  53          3HD       ARG  53  -6.351 -15.357   2.749
  111    HE   ARG  53           HE       ARG  53  -6.837 -12.890   1.241
  112   1HH1  ARG  53          2HH2      ARG  53  -6.546 -14.302   4.451
  113   2HH1  ARG  53          1HH2      ARG  53  -7.474 -13.059   5.222
  114   1HH2  ARG  53          2HH1      ARG  53  -8.064 -11.251   2.258
  115   2HH2  ARG  53          1HH1      ARG  53  -8.344 -11.313   3.965
  116    H    MET  54           H        MET  54  -0.585 -17.339   2.803
  117    HA   MET  54           HA       MET  54  -0.420 -19.503   2.410
  118   1HB   MET  54          2HB       MET  54  -2.074 -19.034   4.456
  119   2HB   MET  54          3HB       MET  54  -3.294 -19.717   3.399
  120   1HG   MET  54          2HG       MET  54  -1.691 -21.734   3.090
  121   2HG   MET  54          3HG       MET  54  -0.763 -21.075   4.423
  122   1HE   MET  54          1HE       MET  54  -1.140 -23.435   4.941
  123   2HE   MET  54          2HE       MET  54  -1.586 -23.151   6.640
  124   3HE   MET  54          3HE       MET  54  -2.619 -24.168   5.606
  125    H    LYS  55           H        LYS  55  -0.764 -18.690  -0.053
  126    HA   LYS  55           HA       LYS  55  -1.657 -19.027  -2.058
  127   1HB   LYS  55          2HB       LYS  55  -0.807 -21.379  -1.068
  128   2HB   LYS  55          3HB       LYS  55  -2.488 -21.797  -1.332
  129   1HG   LYS  55          2HG       LYS  55  -1.800 -22.234  -3.474
  130   2HG   LYS  55          3HG       LYS  55  -1.961 -20.502  -3.689
  131   1HD   LYS  55          2HD       LYS  55   0.572 -20.630  -2.622
  132   2HD   LYS  55          3HD       LYS  55   0.511 -22.165  -3.466
  133   1HE   LYS  55          2HE       LYS  55  -0.591 -19.948  -5.082
  134   2HE   LYS  55          3HE       LYS  55   1.077 -19.673  -4.621
  135   1HZ   LYS  55          1HZ       LYS  55   1.681 -21.744  -5.561
  136   2HZ   LYS  55          2HZ       LYS  55   0.128 -22.174  -5.832
  137   3HZ   LYS  55          3HZ       LYS  55   0.797 -20.949  -6.679
  138    H    TRP  56           H        TRP  56  -3.401 -17.623  -0.389
  139    HA   TRP  56           HA       TRP  56  -5.509 -16.952  -0.306
  140   1HB   TRP  56          2HB       TRP  56  -5.678 -18.765  -2.693
  141   2HB   TRP  56          3HB       TRP  56  -7.124 -18.021  -2.039
  142    HD1  TRP  56           HD1      TRP  56  -3.582 -16.578  -2.926
  143    HE1  TRP  56           HE1      TRP  56  -3.826 -14.327  -4.280
  144    HE3  TRP  56           HE3      TRP  56  -8.667 -16.530  -2.947
  145    HZ2  TRP  56           HZ2      TRP  56  -6.068 -12.812  -5.187
  146    HZ3  TRP  56           HZ3      TRP  56  -9.805 -14.629  -4.088
  147    HH2  TRP  56           HH2      TRP  56  -8.590 -12.812  -5.183
  148    H    LYS  57           H        LYS  57  -4.472 -19.050   1.426
  149    HA   LYS  57           HA       LYS  57  -5.093 -20.750   2.730
  150   1HB   LYS  57          2HB       LYS  57  -6.852 -18.533   3.006
  151   2HB   LYS  57          3HB       LYS  57  -7.821 -19.980   3.196
  152   1HG   LYS  57          2HG       LYS  57  -7.056 -19.851   5.366
  153   2HG   LYS  57          3HG       LYS  57  -5.696 -20.734   4.701
  154   1HD   LYS  57          2HD       LYS  57  -4.345 -19.035   5.354
  155   2HD   LYS  57          3HD       LYS  57  -5.112 -18.017   4.153
  156   1HE   LYS  57          2HE       LYS  57  -6.952 -17.553   5.904
  157   2HE   LYS  57          3HE       LYS  57  -5.917 -18.343   7.077
  158   1HZ   LYS  57          1HZ       LYS  57  -4.780 -16.240   5.425
  159   2HZ   LYS  57          2HZ       LYS  57  -5.750 -15.815   6.669
  160   3HZ   LYS  57          3HZ       LYS  57  -4.395 -16.681   6.950
  161    H    LYS  58           H        LYS  58  -4.900 -22.144   0.687
  162    HA   LYS  58           HA       LYS  58  -7.139 -23.875   0.644
  163   1HB   LYS  58          2HB       LYS  58  -7.076 -21.753  -1.341
  164   2HB   LYS  58          3HB       LYS  58  -6.985 -23.326  -2.106
  165   1HG   LYS  58          2HG       LYS  58  -9.096 -23.961  -1.395
  166   2HG   LYS  58          3HG       LYS  58  -8.967 -23.095   0.124
  167   1HD   LYS  58          2HD       LYS  58  -9.329 -20.936  -1.033
  168   2HD   LYS  58          3HD       LYS  58  -9.345 -21.741  -2.589
  169   1HE   LYS  58          2HE       LYS  58 -11.653 -21.420  -2.001
  170   2HE   LYS  58          3HE       LYS  58 -11.334 -23.125  -1.747
  171   1HZ   LYS  58          1HZ       LYS  58 -11.754 -22.888   0.391
  172   2HZ   LYS  58          2HZ       LYS  58 -10.745 -21.615   0.563
  173   3HZ   LYS  58          3HZ       LYS  58 -12.291 -21.375   0.092
  Start of MODEL    6
    1    H    ARG  43           H        ARG  43   2.881   0.611   0.041
    2    HA   ARG  43           HA       ARG  43   0.572   0.516  -1.596
    3   1HB   ARG  43          2HB       ARG  43   3.520   0.916  -1.969
    4   2HB   ARG  43          3HB       ARG  43   2.672   0.259  -3.355
    5   1HG   ARG  43          2HG       ARG  43   1.382   2.595  -1.971
    6   2HG   ARG  43          3HG       ARG  43   2.852   2.928  -2.865
    7   1HD   ARG  43          2HD       ARG  43   1.702   2.868  -4.820
    8   2HD   ARG  43          3HD       ARG  43   1.224   1.212  -4.511
    9    HE   ARG  43           HE       ARG  43  -0.478   2.728  -2.898
   10   1HH1  ARG  43          2HH2      ARG  43   0.270   2.620  -6.335
   11   2HH1  ARG  43          1HH2      ARG  43  -1.302   3.157  -6.824
   12   1HH2  ARG  43          2HH1      ARG  43  -2.553   3.435  -3.543
   13   2HH2  ARG  43          1HH1      ARG  43  -2.919   3.623  -5.225
   14    H    GLN  44           H        GLN  44   3.559  -1.545  -1.242
   15    HA   GLN  44           HA       GLN  44   2.080  -3.686  -2.531
   16   1HB   GLN  44          2HB       GLN  44   4.925  -2.880  -2.401
   17   2HB   GLN  44          3HB       GLN  44   4.685  -4.601  -2.178
   18   1HG   GLN  44          2HG       GLN  44   3.072  -4.377  -4.274
   19   2HG   GLN  44          3HG       GLN  44   3.939  -2.882  -4.560
   20   1HE2  GLN  44          1HE2      GLN  44   6.238  -2.935  -4.795
   21   2HE2  GLN  44          2HE2      GLN  44   7.040  -4.338  -5.421
   22    H    ILE  45           H        ILE  45   1.411  -2.909   0.184
   23    HA   ILE  45           HA       ILE  45   2.492  -5.197   1.674
   24    HB   ILE  45           HB       ILE  45   1.618  -2.454   2.499
   25   1HG1  ILE  45          2HG1      ILE  45   3.922  -3.859   3.729
   26   2HG1  ILE  45          3HG1      ILE  45   4.075  -3.503   2.020
   27   1HG2  ILE  45          1HG2      ILE  45   1.829  -4.825   4.372
   28   2HG2  ILE  45          2HG2      ILE  45   1.512  -3.133   4.819
   29   3HG2  ILE  45          3HG2      ILE  45   0.313  -4.042   3.867
   30   1HD1  ILE  45          1HD1      ILE  45   3.418  -1.105   2.515
   31   2HD1  ILE  45          2HD1      ILE  45   3.465  -1.510   4.247
   32   3HD1  ILE  45          3HD1      ILE  45   4.950  -1.607   3.269
   33    H    LYS  46           H        LYS  46  -0.311  -3.680   0.223
   34    HA   LYS  46           HA       LYS  46  -2.130  -5.358   1.742
   35   1HB   LYS  46          2HB       LYS  46  -3.877  -4.077   0.760
   36   2HB   LYS  46          3HB       LYS  46  -2.629  -2.952   1.256
   37   1HG   LYS  46          2HG       LYS  46  -1.759  -3.398  -1.269
   38   2HG   LYS  46          3HG       LYS  46  -3.452  -3.777  -1.520
   39   1HD   LYS  46          2HD       LYS  46  -4.001  -1.534  -0.374
   40   2HD   LYS  46          3HD       LYS  46  -2.290  -1.164  -0.459
   41   1HE   LYS  46          2HE       LYS  46  -2.372  -1.511  -2.961
   42   2HE   LYS  46          3HE       LYS  46  -4.099  -1.790  -2.843
   43   1HZ   LYS  46          1HZ       LYS  46  -4.390   0.376  -2.849
   44   2HZ   LYS  46          2HZ       LYS  46  -3.490   0.565  -1.500
   45   3HZ   LYS  46          3HZ       LYS  46  -2.783   0.634  -2.970
   46    H    ILE  47           H        ILE  47  -0.269  -5.365  -1.198
   47    HA   ILE  47           HA       ILE  47  -2.019  -7.362  -2.399
   48    HB   ILE  47           HB       ILE  47  -0.252  -7.136  -4.261
   49   1HG1  ILE  47          2HG1      ILE  47   1.016  -5.097  -4.330
   50   2HG1  ILE  47          3HG1      ILE  47   0.310  -4.526  -2.832
   51   1HG2  ILE  47          1HG2      ILE  47  -1.493  -5.394  -5.274
   52   2HG2  ILE  47          2HG2      ILE  47  -2.627  -6.264  -4.214
   53   3HG2  ILE  47          3HG2      ILE  47  -1.951  -4.700  -3.701
   54   1HD1  ILE  47          1HD1      ILE  47   1.508  -6.074  -1.510
   55   2HD1  ILE  47          2HD1      ILE  47   1.791  -7.170  -2.885
   56   3HD1  ILE  47          3HD1      ILE  47   2.687  -5.636  -2.770
   57    H    TRP  48           H        TRP  48   0.499  -7.177  -0.154
   58    HA   TRP  48           HA       TRP  48   1.797  -9.619  -1.040
   59   1HB   TRP  48          2HB       TRP  48   2.627  -7.352   0.361
   60   2HB   TRP  48          3HB       TRP  48   2.571  -8.617   1.572
   61    HD1  TRP  48           HD1      TRP  48   4.953  -7.228  -0.802
   62    HE1  TRP  48           HE1      TRP  48   6.963  -8.830  -1.400
   63    HE3  TRP  48           HE3      TRP  48   2.814 -11.459   1.035
   64    HZ2  TRP  48           HZ2      TRP  48   7.422 -11.624  -1.047
   65    HZ3  TRP  48           HZ3      TRP  48   4.111 -13.582   0.869
   66    HH2  TRP  48           HH2      TRP  48   6.338 -13.708  -0.128
   67    H    PHE  49           H        PHE  49  -0.226  -8.301   1.662
   68    HA   PHE  49           HA       PHE  49  -0.347 -10.585   3.193
   69   1HB   PHE  49          2HB       PHE  49  -2.438  -8.421   2.546
   70   2HB   PHE  49          3HB       PHE  49  -2.564  -9.502   3.920
   71    HD1  PHE  49           HD1      PHE  49  -2.368  -6.383   3.768
   72    HD2  PHE  49           HD2      PHE  49   0.436  -9.453   4.619
   73    HE1  PHE  49           HE1      PHE  49  -1.027  -4.776   5.155
   74    HE2  PHE  49           HE2      PHE  49   1.775  -7.846   6.006
   75    HZ   PHE  49           HZ       PHE  49   1.027  -5.527   6.257
   76    H    GLN  50           H        GLN  50  -2.210  -9.646   0.269
   77    HA   GLN  50           HA       GLN  50  -3.935 -11.903   0.565
   78   1HB   GLN  50          2HB       GLN  50  -5.029 -11.086  -1.435
   79   2HB   GLN  50          3HB       GLN  50  -4.674  -9.704  -0.418
   80   1HG   GLN  50          2HG       GLN  50  -3.643  -8.782  -2.219
   81   2HG   GLN  50          3HG       GLN  50  -2.354  -9.941  -1.967
   82   1HE2  GLN  50          1HE2      GLN  50  -2.115 -11.678  -3.281
   83   2HE2  GLN  50          2HE2      GLN  50  -3.028 -11.951  -4.728
   84    H    ASN  51           H        ASN  51  -0.759 -11.373  -0.561
   85    HA   ASN  51           HA       ASN  51  -0.902 -13.266  -2.694
   86   1HB   ASN  51          2HB       ASN  51   1.168 -11.466  -1.478
   87   2HB   ASN  51          3HB       ASN  51   1.791 -12.933  -2.206
   88   1HD2  ASN  51          1HD2      ASN  51   2.625 -10.761  -3.349
   89   2HD2  ASN  51          2HD2      ASN  51   1.847 -10.414  -4.856
   90    H    ARG  52           H        ARG  52   0.172 -13.020   0.730
   91    HA   ARG  52           HA       ARG  52   1.388 -15.575   0.708
   92   1HB   ARG  52          2HB       ARG  52   1.635 -13.382   2.319
   93   2HB   ARG  52          3HB       ARG  52   0.523 -14.316   3.299
   94   1HG   ARG  52          2HG       ARG  52   2.883 -15.791   2.166
   95   2HG   ARG  52          3HG       ARG  52   3.219 -14.628   3.433
   96   1HD   ARG  52          2HD       ARG  52   1.815 -15.765   5.014
   97   2HD   ARG  52          3HD       ARG  52   1.004 -16.687   3.764
   98    HE   ARG  52           HE       ARG  52   2.734 -18.254   3.848
   99   1HH1  ARG  52          2HH2      ARG  52   3.876 -15.227   5.233
  100   2HH1  ARG  52          1HH2      ARG  52   5.395 -15.886   5.744
  101   1HH2  ARG  52          2HH1      ARG  52   4.738 -19.123   4.521
  102   2HH2  ARG  52          1HH1      ARG  52   5.888 -18.116   5.335
  103    H    ARG  53           H        ARG  53  -1.841 -14.289   1.121
  104    HA   ARG  53           HA       ARG  53  -2.869 -16.201   2.833
  105   1HB   ARG  53          2HB       ARG  53  -3.913 -14.144   0.962
  106   2HB   ARG  53          3HB       ARG  53  -5.002 -15.503   1.163
  107   1HG   ARG  53          2HG       ARG  53  -4.810 -15.228   3.674
  108   2HG   ARG  53          3HG       ARG  53  -3.821 -13.805   3.413
  109   1HD   ARG  53          2HD       ARG  53  -5.742 -12.809   2.056
  110   2HD   ARG  53          3HD       ARG  53  -6.722 -14.184   2.526
  111    HE   ARG  53           HE       ARG  53  -5.949 -11.930   4.223
  112   1HH1  ARG  53          2HH2      ARG  53  -6.969 -15.298   4.217
  113   2HH1  ARG  53          1HH2      ARG  53  -7.601 -15.242   5.829
  114   1HH2  ARG  53          2HH1      ARG  53  -6.783 -11.856   6.350
  115   2HH2  ARG  53          1HH1      ARG  53  -7.494 -13.272   7.050
  116    H    MET  54           H        MET  54  -1.874 -16.337  -0.514
  117    HA   MET  54           HA       MET  54  -3.623 -18.389  -1.319
  118   1HB   MET  54          2HB       MET  54  -2.298 -16.753  -2.802
  119   2HB   MET  54          3HB       MET  54  -0.851 -17.664  -2.415
  120   1HG   MET  54          2HG       MET  54  -2.418 -19.732  -3.223
  121   2HG   MET  54          3HG       MET  54  -3.188 -18.451  -4.139
  122   1HE   MET  54          1HE       MET  54  -0.753 -16.861  -6.222
  123   2HE   MET  54          2HE       MET  54  -1.792 -18.113  -6.946
  124   3HE   MET  54          3HE       MET  54  -2.412 -17.100  -5.621
  125    H    LYS  55           H        LYS  55  -0.690 -18.278   0.588
  126    HA   LYS  55           HA       LYS  55   0.008 -21.021   0.049
  127   1HB   LYS  55          2HB       LYS  55   1.666 -19.165   0.486
  128   2HB   LYS  55          3HB       LYS  55   1.127 -19.153   2.153
  129   1HG   LYS  55          2HG       LYS  55   2.477 -20.911   2.619
  130   2HG   LYS  55          3HG       LYS  55   1.616 -21.896   1.454
  131   1HD   LYS  55          2HD       LYS  55   3.584 -21.953   0.302
  132   2HD   LYS  55          3HD       LYS  55   3.178 -20.329  -0.214
  133   1HE   LYS  55          2HE       LYS  55   4.899 -19.441   0.976
  134   2HE   LYS  55          3HE       LYS  55   4.368 -20.235   2.446
  135   1HZ   LYS  55          1HZ       LYS  55   5.913 -21.560   0.326
  136   2HZ   LYS  55          2HZ       LYS  55   6.557 -20.951   1.698
  137   3HZ   LYS  55          3HZ       LYS  55   5.509 -22.201   1.773
  138    H    TRP  56           H        TRP  56  -1.823 -19.106   2.426
  139    HA   TRP  56           HA       TRP  56  -1.922 -20.808   4.549
  140   1HB   TRP  56          2HB       TRP  56  -3.445 -18.598   3.532
  141   2HB   TRP  56          3HB       TRP  56  -4.542 -19.808   4.168
  142    HD1  TRP  56           HD1      TRP  56  -1.136 -19.451   5.891
  143    HE1  TRP  56           HE1      TRP  56  -1.376 -18.431   8.312
  144    HE3  TRP  56           HE3      TRP  56  -6.057 -18.245   5.463
  145    HZ2  TRP  56           HZ2      TRP  56  -3.549 -17.260   9.745
  146    HZ3  TRP  56           HZ3      TRP  56  -7.162 -17.167   7.420
  147    HH2  TRP  56           HH2      TRP  56  -5.990 -16.673   9.506
  148    H    LYS  57           H        LYS  57  -4.154 -20.761   1.670
  149    HA   LYS  57           HA       LYS  57  -5.358 -23.219   2.418
  150   1HB   LYS  57          2HB       LYS  57  -6.555 -23.016   0.321
  151   2HB   LYS  57          3HB       LYS  57  -6.534 -21.473   1.150
  152   1HG   LYS  57          2HG       LYS  57  -4.309 -21.104  -0.316
  153   2HG   LYS  57          3HG       LYS  57  -5.054 -22.311  -1.344
  154   1HD   LYS  57          2HD       LYS  57  -6.772 -20.019  -0.394
  155   2HD   LYS  57          3HD       LYS  57  -5.580 -19.687  -1.635
  156   1HE   LYS  57          2HE       LYS  57  -6.649 -21.008  -3.227
  157   2HE   LYS  57          3HE       LYS  57  -7.268 -22.137  -2.039
  158   1HZ   LYS  57          1HZ       LYS  57  -8.534 -19.891  -1.379
  159   2HZ   LYS  57          2HZ       LYS  57  -8.431 -19.712  -3.000
  160   3HZ   LYS  57          3HZ       LYS  57  -9.152 -21.035  -2.368
  161    H    LYS  58           H        LYS  58  -2.566 -22.236   0.449
  162    HA   LYS  58           HA       LYS  58  -0.981 -23.399  -0.552
  163   1HB   LYS  58          2HB       LYS  58  -1.551 -24.802   1.808
  164   2HB   LYS  58          3HB       LYS  58  -1.460 -26.040   0.571
  165   1HG   LYS  58          2HG       LYS  58   0.763 -25.345  -0.099
  166   2HG   LYS  58          3HG       LYS  58   0.655 -23.860   0.823
  167   1HD   LYS  58          2HD       LYS  58   1.854 -25.093   2.361
  168   2HD   LYS  58          3HD       LYS  58   0.249 -25.593   2.858
  169   1HE   LYS  58          2HE       LYS  58   1.756 -27.128   0.708
  170   2HE   LYS  58          3HE       LYS  58   2.051 -27.444   2.406
  171   1HZ   LYS  58          1HZ       LYS  58  -0.414 -27.720   2.589
  172   2HZ   LYS  58          2HZ       LYS  58  -0.476 -27.734   0.957
  173   3HZ   LYS  58          3HZ       LYS  58   0.366 -28.885   1.752
  Start of MODEL    7
    1    H    ARG  43           H        ARG  43   1.211   1.366  -1.835
    2    HA   ARG  43           HA       ARG  43   2.237   0.859   0.729
    3   1HB   ARG  43          2HB       ARG  43  -0.297   0.442  -0.750
    4   2HB   ARG  43          3HB       ARG  43   0.029  -0.845   0.394
    5   1HG   ARG  43          2HG       ARG  43   0.663   1.356   1.926
    6   2HG   ARG  43          3HG       ARG  43  -0.587   2.033   0.899
    7   1HD   ARG  43          2HD       ARG  43  -1.840  -0.280   1.539
    8   2HD   ARG  43          3HD       ARG  43  -0.792  -0.176   2.940
    9    HE   ARG  43           HE       ARG  43  -1.821   2.361   2.839
   10   1HH1  ARG  43          2HH2      ARG  43  -3.351  -0.804   2.682
   11   2HH1  ARG  43          1HH2      ARG  43  -4.834  -0.263   3.396
   12   1HH2  ARG  43          2HH1      ARG  43  -3.777   3.074   3.781
   13   2HH2  ARG  43          1HH1      ARG  43  -5.078   1.957   4.024
   14    H    GLN  44           H        GLN  44   1.149  -1.380  -1.941
   15    HA   GLN  44           HA       GLN  44   1.680  -3.434  -2.424
   16   1HB   GLN  44          2HB       GLN  44   4.215  -2.013  -2.042
   17   2HB   GLN  44          3HB       GLN  44   4.406  -3.733  -1.760
   18   1HG   GLN  44          2HG       GLN  44   4.001  -4.283  -3.959
   19   2HG   GLN  44          3HG       GLN  44   2.756  -3.063  -4.147
   20   1HE2  GLN  44          1HE2      GLN  44   6.029  -3.900  -4.596
   21   2HE2  GLN  44          2HE2      GLN  44   6.608  -2.422  -5.288
   22    H    ILE  45           H        ILE  45   0.930  -2.721   0.469
   23    HA   ILE  45           HA       ILE  45   2.123  -5.068   1.766
   24    HB   ILE  45           HB       ILE  45   2.035  -2.469   2.621
   25   1HG1  ILE  45          2HG1      ILE  45   2.796  -3.357   4.762
   26   2HG1  ILE  45          3HG1      ILE  45   2.164  -4.944   4.367
   27   1HG2  ILE  45          1HG2      ILE  45  -0.184  -3.950   4.057
   28   2HG2  ILE  45          2HG2      ILE  45   0.474  -2.354   4.486
   29   3HG2  ILE  45          3HG2      ILE  45  -0.395  -2.573   2.949
   30   1HD1  ILE  45          1HD1      ILE  45   4.088  -5.454   3.295
   31   2HD1  ILE  45          2HD1      ILE  45   3.828  -4.098   2.172
   32   3HD1  ILE  45          3HD1      ILE  45   4.725  -3.839   3.687
   33    H    LYS  46           H        LYS  46  -0.668  -3.834   0.201
   34    HA   LYS  46           HA       LYS  46  -2.417  -5.639   1.694
   35   1HB   LYS  46          2HB       LYS  46  -4.246  -4.450   0.537
   36   2HB   LYS  46          3HB       LYS  46  -3.243  -3.382   1.498
   37   1HG   LYS  46          2HG       LYS  46  -2.601  -2.181  -0.326
   38   2HG   LYS  46          3HG       LYS  46  -2.187  -3.625  -1.227
   39   1HD   LYS  46          2HD       LYS  46  -4.158  -3.606  -2.375
   40   2HD   LYS  46          3HD       LYS  46  -5.100  -3.352  -0.920
   41   1HE   LYS  46          2HE       LYS  46  -5.482  -1.245  -1.696
   42   2HE   LYS  46          3HE       LYS  46  -3.829  -0.886  -1.236
   43   1HZ   LYS  46          1HZ       LYS  46  -3.415  -0.584  -3.360
   44   2HZ   LYS  46          2HZ       LYS  46  -3.711  -2.160  -3.668
   45   3HZ   LYS  46          3HZ       LYS  46  -4.913  -1.063  -3.801
   46    H    ILE  47           H        ILE  47  -0.450  -5.442  -1.120
   47    HA   ILE  47           HA       ILE  47  -2.083  -7.451  -2.486
   48    HB   ILE  47           HB       ILE  47  -0.342  -6.959  -4.331
   49   1HG1  ILE  47          2HG1      ILE  47   0.667  -4.758  -4.282
   50   2HG1  ILE  47          3HG1      ILE  47  -0.041  -4.412  -2.717
   51   1HG2  ILE  47          1HG2      ILE  47  -2.211  -4.677  -3.732
   52   2HG2  ILE  47          2HG2      ILE  47  -1.798  -5.421  -5.295
   53   3HG2  ILE  47          3HG2      ILE  47  -2.829  -6.296  -4.137
   54   1HD1  ILE  47          1HD1      ILE  47   1.410  -5.850  -1.575
   55   2HD1  ILE  47          2HD1      ILE  47   1.670  -6.883  -3.001
   56   3HD1  ILE  47          3HD1      ILE  47   2.461  -5.292  -2.898
   57    H    TRP  48           H        TRP  48   0.556  -7.086  -0.339
   58    HA   TRP  48           HA       TRP  48   1.934  -9.446  -1.328
   59   1HB   TRP  48          2HB       TRP  48   2.756  -7.122  -0.047
   60   2HB   TRP  48          3HB       TRP  48   2.840  -8.340   1.211
   61    HD1  TRP  48           HD1      TRP  48   4.899  -6.998  -1.536
   62    HE1  TRP  48           HE1      TRP  48   6.971  -8.513  -2.151
   63    HE3  TRP  48           HE3      TRP  48   3.306 -11.113   0.990
   64    HZ2  TRP  48           HZ2      TRP  48   7.694 -11.202  -1.527
   65    HZ3  TRP  48           HZ3      TRP  48   4.753 -13.142   0.936
   66    HH2  TRP  48           HH2      TRP  48   6.880 -13.229  -0.266
   67    H    PHE  49           H        PHE  49  -0.131  -8.252   1.367
   68    HA   PHE  49           HA       PHE  49   0.077 -10.487   3.002
   69   1HB   PHE  49          2HB       PHE  49  -2.152  -8.455   2.405
   70   2HB   PHE  49          3HB       PHE  49  -2.255  -9.581   3.743
   71    HD1  PHE  49           HD1      PHE  49  -2.553  -7.063   4.693
   72    HD2  PHE  49           HD2      PHE  49   1.109  -8.833   3.484
   73    HE1  PHE  49           HE1      PHE  49  -1.294  -5.451   6.147
   74    HE2  PHE  49           HE2      PHE  49   2.369  -7.221   4.938
   75    HZ   PHE  49           HZ       PHE  49   1.153  -5.549   6.252
   76    H    GLN  50           H        GLN  50  -1.913  -9.830   0.102
   77    HA   GLN  50           HA       GLN  50  -3.607 -12.044   0.536
   78   1HB   GLN  50          2HB       GLN  50  -4.545 -10.344  -0.802
   79   2HB   GLN  50          3HB       GLN  50  -3.087 -10.139  -1.752
   80   1HG   GLN  50          2HG       GLN  50  -4.323 -12.856  -1.899
   81   2HG   GLN  50          3HG       GLN  50  -5.285 -11.564  -2.589
   82   1HE2  GLN  50          1HE2      GLN  50  -3.526  -9.844  -3.628
   83   2HE2  GLN  50          2HE2      GLN  50  -2.575 -10.558  -4.887
   84    H    ASN  51           H        ASN  51  -0.506 -11.466  -1.131
   85    HA   ASN  51           HA       ASN  51  -0.492 -13.713  -2.717
   86   1HB   ASN  51          2HB       ASN  51   1.548 -11.847  -1.557
   87   2HB   ASN  51          3HB       ASN  51   2.174 -13.406  -2.054
   88   1HD2  ASN  51          1HD2      ASN  51  -0.055 -10.864  -3.174
   89   2HD2  ASN  51          2HD2      ASN  51   0.419 -10.872  -4.839
   90    H    ARG  52           H        ARG  52   0.375 -13.133   0.729
   91    HA   ARG  52           HA       ARG  52   1.433 -15.752   1.038
   92   1HB   ARG  52          2HB       ARG  52   0.716 -13.581   3.074
   93   2HB   ARG  52          3HB       ARG  52   1.522 -15.079   3.494
   94   1HG   ARG  52          2HG       ARG  52   2.819 -13.683   1.230
   95   2HG   ARG  52          3HG       ARG  52   2.780 -12.712   2.688
   96   1HD   ARG  52          2HD       ARG  52   4.674 -13.884   3.244
   97   2HD   ARG  52          3HD       ARG  52   3.547 -15.126   3.752
   98    HE   ARG  52           HE       ARG  52   4.120 -15.336   0.914
   99   1HH1  ARG  52          2HH2      ARG  52   5.415 -16.074   4.101
  100   2HH1  ARG  52          1HH2      ARG  52   6.392 -17.389   3.540
  101   1HH2  ARG  52          2HH1      ARG  52   5.408 -17.071   0.173
  102   2HH2  ARG  52          1HH1      ARG  52   6.389 -17.961   1.290
  103    H    ARG  53           H        ARG  53  -1.692 -14.182   1.201
  104    HA   ARG  53           HA       ARG  53  -2.843 -15.963   3.048
  105   1HB   ARG  53          2HB       ARG  53  -3.582 -13.548   1.880
  106   2HB   ARG  53          3HB       ARG  53  -4.654 -14.669   1.068
  107   1HG   ARG  53          2HG       ARG  53  -5.789 -15.236   3.021
  108   2HG   ARG  53          3HG       ARG  53  -4.383 -14.996   4.041
  109   1HD   ARG  53          2HD       ARG  53  -5.021 -12.868   4.524
  110   2HD   ARG  53          3HD       ARG  53  -5.110 -12.456   2.824
  111    HE   ARG  53           HE       ARG  53  -7.433 -12.855   2.847
  112   1HH1  ARG  53          2HH2      ARG  53  -5.977 -14.046   5.822
  113   2HH1  ARG  53          1HH2      ARG  53  -7.496 -14.320   6.606
  114   1HH2  ARG  53          2HH1      ARG  53  -9.437 -13.216   3.883
  115   2HH2  ARG  53          1HH1      ARG  53  -9.478 -13.845   5.496
  116    H    MET  54           H        MET  54  -1.915 -16.181  -0.274
  117    HA   MET  54           HA       MET  54  -3.971 -18.037  -0.988
  118   1HB   MET  54          2HB       MET  54  -2.042 -16.369  -2.320
  119   2HB   MET  54          3HB       MET  54  -1.644 -18.017  -2.768
  120   1HG   MET  54          2HG       MET  54  -3.233 -17.389  -4.410
  121   2HG   MET  54          3HG       MET  54  -4.195 -18.304  -3.266
  122   1HE   MET  54          1HE       MET  54  -6.046 -15.010  -4.804
  123   2HE   MET  54          2HE       MET  54  -4.955 -16.248  -5.469
  124   3HE   MET  54          3HE       MET  54  -6.398 -16.735  -4.550
  125    H    LYS  55           H        LYS  55  -0.851 -18.110   0.556
  126    HA   LYS  55           HA       LYS  55   0.022 -20.633  -0.296
  127   1HB   LYS  55          2HB       LYS  55   0.714 -18.669   1.801
  128   2HB   LYS  55          3HB       LYS  55   1.095 -20.330   2.206
  129   1HG   LYS  55          2HG       LYS  55   1.818 -19.358  -0.556
  130   2HG   LYS  55          3HG       LYS  55   2.790 -18.792   0.788
  131   1HD   LYS  55          2HD       LYS  55   2.325 -21.661   1.049
  132   2HD   LYS  55          3HD       LYS  55   2.968 -21.309  -0.544
  133   1HE   LYS  55          2HE       LYS  55   5.019 -21.251   0.443
  134   2HE   LYS  55          3HE       LYS  55   4.547 -19.697   1.103
  135   1HZ   LYS  55          1HZ       LYS  55   3.725 -22.115   2.495
  136   2HZ   LYS  55          2HZ       LYS  55   5.266 -21.598   2.655
  137   3HZ   LYS  55          3HZ       LYS  55   4.030 -20.628   3.099
  138    H    TRP  56           H        TRP  56  -2.029 -19.551   2.474
  139    HA   TRP  56           HA       TRP  56  -2.274 -21.922   3.803
  140   1HB   TRP  56          2HB       TRP  56  -3.946 -19.499   3.463
  141   2HB   TRP  56          3HB       TRP  56  -4.765 -20.922   4.077
  142    HD1  TRP  56           HD1      TRP  56  -1.106 -20.082   5.052
  143    HE1  TRP  56           HE1      TRP  56  -0.904 -19.612   7.642
  144    HE3  TRP  56           HE3      TRP  56  -6.098 -20.242   6.004
  145    HZ2  TRP  56           HZ2      TRP  56  -2.812 -19.367   9.749
  146    HZ3  TRP  56           HZ3      TRP  56  -6.846 -19.879   8.354
  147    HH2  TRP  56           HH2      TRP  56  -5.293 -19.453  10.194
  148    H    LYS  57           H        LYS  57  -4.203 -20.688   0.982
  149    HA   LYS  57           HA       LYS  57  -4.910 -23.486   0.439
  150   1HB   LYS  57          2HB       LYS  57  -7.112 -22.775  -0.287
  151   2HB   LYS  57          3HB       LYS  57  -6.843 -22.300   1.378
  152   1HG   LYS  57          2HG       LYS  57  -7.335 -20.163   0.806
  153   2HG   LYS  57          3HG       LYS  57  -5.879 -20.121  -0.169
  154   1HD   LYS  57          2HD       LYS  57  -7.246 -21.213  -2.056
  155   2HD   LYS  57          3HD       LYS  57  -8.674 -20.938  -1.079
  156   1HE   LYS  57          2HE       LYS  57  -8.536 -19.045  -2.544
  157   2HE   LYS  57          3HE       LYS  57  -8.003 -18.459  -0.981
  158   1HZ   LYS  57          1HZ       LYS  57  -5.715 -18.896  -1.739
  159   2HZ   LYS  57          2HZ       LYS  57  -6.286 -19.252  -3.227
  160   3HZ   LYS  57          3HZ       LYS  57  -6.478 -17.749  -2.616
  161    H    LYS  58           H        LYS  58  -3.569 -24.016  -1.225
  162    HA   LYS  58           HA       LYS  58  -2.862 -22.027  -3.173
  163   1HB   LYS  58          2HB       LYS  58  -1.436 -23.756  -4.093
  164   2HB   LYS  58          3HB       LYS  58  -1.229 -23.673  -2.355
  165   1HG   LYS  58          2HG       LYS  58  -3.379 -25.539  -3.070
  166   2HG   LYS  58          3HG       LYS  58  -1.883 -25.966  -3.876
  167   1HD   LYS  58          2HD       LYS  58  -0.698 -25.808  -1.632
  168   2HD   LYS  58          3HD       LYS  58  -2.256 -25.542  -0.874
  169   1HE   LYS  58          2HE       LYS  58  -2.967 -27.767  -2.113
  170   2HE   LYS  58          3HE       LYS  58  -1.244 -28.039  -2.272
  171   1HZ   LYS  58          1HZ       LYS  58  -1.517 -27.324   0.301
  172   2HZ   LYS  58          2HZ       LYS  58  -2.877 -28.192   0.048
  173   3HZ   LYS  58          3HZ       LYS  58  -1.415 -28.861  -0.240
  Start of MODEL    8
    1    H    ARG  43           H        ARG  43   3.568   1.555  -0.568
    2    HA   ARG  43           HA       ARG  43   1.246  -0.110  -0.311
    3   1HB   ARG  43          2HB       ARG  43   1.402  -0.291  -2.789
    4   2HB   ARG  43          3HB       ARG  43   1.470   1.385  -2.282
    5   1HG   ARG  43          2HG       ARG  43   4.141   0.114  -2.392
    6   2HG   ARG  43          3HG       ARG  43   3.321   0.102  -3.942
    7   1HD   ARG  43          2HD       ARG  43   2.841   2.698  -2.910
    8   2HD   ARG  43          3HD       ARG  43   4.511   2.363  -2.492
    9    HE   ARG  43           HE       ARG  43   4.445   1.552  -5.101
   10   1HH1  ARG  43          2HH2      ARG  43   3.296   4.490  -3.541
   11   2HH1  ARG  43          1HH2      ARG  43   3.534   5.480  -4.942
   12   1HH2  ARG  43          2HH1      ARG  43   4.759   2.857  -6.951
   13   2HH2  ARG  43          1HH1      ARG  43   4.371   4.545  -6.895
   14    H    GLN  44           H        GLN  44   1.730  -2.134  -2.209
   15    HA   GLN  44           HA       GLN  44   2.616  -4.098  -2.476
   16   1HB   GLN  44          2HB       GLN  44   4.827  -2.405  -2.427
   17   2HB   GLN  44          3HB       GLN  44   5.269  -3.631  -1.255
   18   1HG   GLN  44          2HG       GLN  44   5.205  -5.375  -2.839
   19   2HG   GLN  44          3HG       GLN  44   4.095  -4.523  -3.894
   20   1HE2  GLN  44          1HE2      GLN  44   6.041  -5.562  -5.191
   21   2HE2  GLN  44          2HE2      GLN  44   7.286  -4.447  -5.647
   22    H    ILE  45           H        ILE  45   1.654  -2.935   0.316
   23    HA   ILE  45           HA       ILE  45   2.714  -5.137   1.938
   24    HB   ILE  45           HB       ILE  45   1.733  -2.384   2.577
   25   1HG1  ILE  45          2HG1      ILE  45   3.993  -3.703   3.989
   26   2HG1  ILE  45          3HG1      ILE  45   4.227  -3.382   2.283
   27   1HG2  ILE  45          1HG2      ILE  45   1.940  -3.318   5.050
   28   2HG2  ILE  45          2HG2      ILE  45   0.404  -3.362   4.151
   29   3HG2  ILE  45          3HG2      ILE  45   1.412  -4.825   4.262
   30   1HD1  ILE  45          1HD1      ILE  45   4.196  -1.087   2.557
   31   2HD1  ILE  45          2HD1      ILE  45   3.020  -1.159   3.892
   32   3HD1  ILE  45          3HD1      ILE  45   4.735  -1.534   4.194
   33    H    LYS  46           H        LYS  46  -0.042  -3.888   0.222
   34    HA   LYS  46           HA       LYS  46  -1.831  -5.629   1.745
   35   1HB   LYS  46          2HB       LYS  46  -2.565  -3.587  -0.367
   36   2HB   LYS  46          3HB       LYS  46  -3.639  -4.393   0.758
   37   1HG   LYS  46          2HG       LYS  46  -1.424  -3.046   2.153
   38   2HG   LYS  46          3HG       LYS  46  -2.337  -1.926   1.162
   39   1HD   LYS  46          2HD       LYS  46  -4.367  -3.411   2.349
   40   2HD   LYS  46          3HD       LYS  46  -3.161  -3.376   3.621
   41   1HE   LYS  46          2HE       LYS  46  -3.407  -1.115   3.979
   42   2HE   LYS  46          3HE       LYS  46  -3.561  -0.754   2.270
   43   1HZ   LYS  46          1HZ       LYS  46  -5.815  -1.679   2.392
   44   2HZ   LYS  46          2HZ       LYS  46  -5.658  -1.852   4.008
   45   3HZ   LYS  46          3HZ       LYS  46  -5.620  -0.363   3.339
   46    H    ILE  47           H        ILE  47   0.029  -5.378  -1.190
   47    HA   ILE  47           HA       ILE  47  -1.636  -7.268  -2.605
   48    HB   ILE  47           HB       ILE  47  -0.577  -6.591  -4.442
   49   1HG1  ILE  47          2HG1      ILE  47   1.452  -7.818  -4.028
   50   2HG1  ILE  47          3HG1      ILE  47   1.862  -6.228  -4.638
   51   1HG2  ILE  47          1HG2      ILE  47   0.017  -4.324  -4.422
   52   2HG2  ILE  47          2HG2      ILE  47  -1.092  -4.511  -3.043
   53   3HG2  ILE  47          3HG2      ILE  47   0.663  -4.411  -2.766
   54   1HD1  ILE  47          1HD1      ILE  47   3.247  -6.064  -2.841
   55   2HD1  ILE  47          2HD1      ILE  47   1.772  -5.809  -1.878
   56   3HD1  ILE  47          3HD1      ILE  47   2.470  -7.440  -2.022
   57    H    TRP  48           H        TRP  48   0.700  -7.364  -0.140
   58    HA   TRP  48           HA       TRP  48   1.818  -9.901  -1.029
   59   1HB   TRP  48          2HB       TRP  48   2.820  -7.740   0.425
   60   2HB   TRP  48          3HB       TRP  48   2.590  -9.000   1.622
   61    HD1  TRP  48           HD1      TRP  48   5.126  -7.874  -0.790
   62    HE1  TRP  48           HE1      TRP  48   7.007  -9.660  -1.277
   63    HE3  TRP  48           HE3      TRP  48   2.651 -11.814   1.261
   64    HZ2  TRP  48           HZ2      TRP  48   7.244 -12.457  -0.761
   65    HZ3  TRP  48           HZ3      TRP  48   3.777 -14.037   1.229
   66    HH2  TRP  48           HH2      TRP  48   5.994 -14.393   0.263
   67    H    PHE  49           H        PHE  49  -0.342  -8.402   1.428
   68    HA   PHE  49           HA       PHE  49  -0.693 -10.664   3.010
   69   1HB   PHE  49          2HB       PHE  49  -2.484  -8.283   2.247
   70   2HB   PHE  49          3HB       PHE  49  -2.886  -9.381   3.552
   71    HD1  PHE  49           HD1      PHE  49  -2.846  -6.802   4.454
   72    HD2  PHE  49           HD2      PHE  49   0.545  -9.228   3.665
   73    HE1  PHE  49           HE1      PHE  49  -1.484  -5.415   6.041
   74    HE2  PHE  49           HE2      PHE  49   1.906  -7.841   5.254
   75    HZ   PHE  49           HZ       PHE  49   0.876  -5.951   6.422
   76    H    GLN  50           H        GLN  50  -2.061  -9.720  -0.129
   77    HA   GLN  50           HA       GLN  50  -4.192 -11.594   0.063
   78   1HB   GLN  50          2HB       GLN  50  -4.874 -10.780  -2.041
   79   2HB   GLN  50          3HB       GLN  50  -4.104  -9.386  -1.307
   80   1HG   GLN  50          2HG       GLN  50  -1.919 -10.457  -2.505
   81   2HG   GLN  50          3HG       GLN  50  -3.142 -11.119  -3.571
   82   1HE2  GLN  50          1HE2      GLN  50  -1.274  -9.359  -4.487
   83   2HE2  GLN  50          2HE2      GLN  50  -1.998  -7.842  -4.907
   84    H    ASN  51           H        ASN  51  -0.820 -11.610  -0.909
   85    HA   ASN  51           HA       ASN  51  -1.109 -13.907  -2.568
   86   1HB   ASN  51          2HB       ASN  51   1.131 -12.132  -1.626
   87   2HB   ASN  51          3HB       ASN  51   1.583 -13.768  -2.060
   88   1HD2  ASN  51          1HD2      ASN  51   2.118 -11.144  -3.314
   89   2HD2  ASN  51          2HD2      ASN  51   1.605 -11.268  -4.965
   90    H    ARG  52           H        ARG  52  -0.040 -13.037   0.765
   91    HA   ARG  52           HA       ARG  52   0.921 -15.602   1.368
   92   1HB   ARG  52          2HB       ARG  52   1.497 -13.379   2.541
   93   2HB   ARG  52          3HB       ARG  52  -0.057 -13.486   3.345
   94   1HG   ARG  52          2HG       ARG  52   0.653 -15.816   4.171
   95   2HG   ARG  52          3HG       ARG  52   2.255 -15.465   3.553
   96   1HD   ARG  52          2HD       ARG  52   2.739 -14.324   5.453
   97   2HD   ARG  52          3HD       ARG  52   1.460 -13.181   5.096
   98    HE   ARG  52           HE       ARG  52   0.541 -15.716   6.287
   99   1HH1  ARG  52          2HH2      ARG  52   1.566 -12.402   6.883
  100   2HH1  ARG  52          1HH2      ARG  52   0.805 -12.311   8.436
  101   1HH2  ARG  52          2HH1      ARG  52  -0.464 -15.595   8.336
  102   2HH2  ARG  52          1HH1      ARG  52  -0.357 -14.139   9.268
  103    H    ARG  53           H        ARG  53  -2.226 -14.346   0.924
  104    HA   ARG  53           HA       ARG  53  -3.411 -16.060   2.904
  105   1HB   ARG  53          2HB       ARG  53  -4.152 -13.605   1.964
  106   2HB   ARG  53          3HB       ARG  53  -5.103 -14.607   0.887
  107   1HG   ARG  53          2HG       ARG  53  -5.621 -15.856   3.276
  108   2HG   ARG  53          3HG       ARG  53  -5.360 -14.219   3.842
  109   1HD   ARG  53          2HD       ARG  53  -7.064 -14.368   1.413
  110   2HD   ARG  53          3HD       ARG  53  -7.751 -15.195   2.797
  111    HE   ARG  53           HE       ARG  53  -7.983 -13.130   3.917
  112   1HH1  ARG  53          2HH2      ARG  53  -6.033 -12.722   1.016
  113   2HH1  ARG  53          1HH2      ARG  53  -6.070 -10.992   1.081
  114   1HH2  ARG  53          2HH1      ARG  53  -8.033 -10.847   4.001
  115   2HH2  ARG  53          1HH1      ARG  53  -7.215  -9.919   2.790
  116    H    MET  54           H        MET  54  -2.160 -17.815   1.391
  117    HA   MET  54           HA       MET  54  -3.913 -19.541   0.441
  118   1HB   MET  54          2HB       MET  54  -3.571 -17.307  -1.478
  119   2HB   MET  54          3HB       MET  54  -3.215 -18.856  -2.217
  120   1HG   MET  54          2HG       MET  54  -5.402 -19.675  -1.900
  121   2HG   MET  54          3HG       MET  54  -5.713 -18.626  -0.530
  122   1HE   MET  54          1HE       MET  54  -4.670 -16.975  -4.503
  123   2HE   MET  54          2HE       MET  54  -4.440 -18.650  -3.949
  124   3HE   MET  54          3HE       MET  54  -5.902 -18.208  -4.863
  125    H    LYS  55           H        LYS  55  -0.787 -17.949   0.090
  126    HA   LYS  55           HA       LYS  55   0.450 -20.196  -1.197
  127   1HB   LYS  55          2HB       LYS  55   1.025 -17.478  -0.907
  128   2HB   LYS  55          3HB       LYS  55   2.246 -18.274   0.066
  129   1HG   LYS  55          2HG       LYS  55   2.176 -19.888  -2.202
  130   2HG   LYS  55          3HG       LYS  55   1.865 -18.302  -2.878
  131   1HD   LYS  55          2HD       LYS  55   3.901 -17.563  -1.324
  132   2HD   LYS  55          3HD       LYS  55   4.297 -19.269  -1.359
  133   1HE   LYS  55          2HE       LYS  55   5.436 -18.683  -3.273
  134   2HE   LYS  55          3HE       LYS  55   3.864 -18.890  -4.020
  135   1HZ   LYS  55          1HZ       LYS  55   4.574 -16.803  -4.662
  136   2HZ   LYS  55          2HZ       LYS  55   3.528 -16.470  -3.453
  137   3HZ   LYS  55          3HZ       LYS  55   5.137 -16.395  -3.184
  138    H    TRP  56           H        TRP  56  -0.220 -19.068   2.085
  139    HA   TRP  56           HA       TRP  56   1.741 -20.368   3.503
  140   1HB   TRP  56          2HB       TRP  56  -0.946 -19.317   4.017
  141   2HB   TRP  56          3HB       TRP  56  -0.503 -20.644   5.072
  142    HD1  TRP  56           HD1      TRP  56   1.793 -17.732   3.826
  143    HE1  TRP  56           HE1      TRP  56   2.877 -16.471   5.876
  144    HE3  TRP  56           HE3      TRP  56  -0.622 -20.401   7.417
  145    HZ2  TRP  56           HZ2      TRP  56   2.607 -16.726   8.706
  146    HZ3  TRP  56           HZ3      TRP  56  -0.155 -19.832   9.799
  147    HH2  TRP  56           HH2      TRP  56   1.396 -18.065  10.467
  148    H    LYS  57           H        LYS  57  -1.562 -21.592   2.571
  149    HA   LYS  57           HA       LYS  57  -0.911 -24.239   3.396
  150   1HB   LYS  57          2HB       LYS  57  -3.126 -24.787   2.454
  151   2HB   LYS  57          3HB       LYS  57  -3.181 -23.440   3.572
  152   1HG   LYS  57          2HG       LYS  57  -3.901 -21.996   1.963
  153   2HG   LYS  57          3HG       LYS  57  -2.674 -22.521   0.827
  154   1HD   LYS  57          2HD       LYS  57  -4.701 -24.607   1.214
  155   2HD   LYS  57          3HD       LYS  57  -5.445 -23.098   0.724
  156   1HE   LYS  57          2HE       LYS  57  -4.064 -22.959  -1.272
  157   2HE   LYS  57          3HE       LYS  57  -3.026 -24.260  -0.724
  158   1HZ   LYS  57          1HZ       LYS  57  -4.789 -24.852  -2.367
  159   2HZ   LYS  57          2HZ       LYS  57  -4.730 -25.799  -1.039
  160   3HZ   LYS  57          3HZ       LYS  57  -5.892 -24.661  -1.179
  161    H    LYS  58           H        LYS  58  -0.077 -25.925   2.232
  162    HA   LYS  58           HA       LYS  58   1.018 -26.940   0.603
  163   1HB   LYS  58          2HB       LYS  58  -1.195 -25.659  -1.017
  164   2HB   LYS  58          3HB       LYS  58  -0.059 -26.809  -1.695
  165   1HG   LYS  58          2HG       LYS  58  -1.719 -28.285  -1.023
  166   2HG   LYS  58          3HG       LYS  58  -0.755 -28.269   0.441
  167   1HD   LYS  58          2HD       LYS  58  -2.319 -26.183   1.062
  168   2HD   LYS  58          3HD       LYS  58  -3.402 -26.918  -0.104
  169   1HE   LYS  58          2HE       LYS  58  -3.825 -28.762   1.232
  170   2HE   LYS  58          3HE       LYS  58  -2.200 -28.801   1.886
  171   1HZ   LYS  58          1HZ       LYS  58  -4.163 -26.738   2.598
  172   2HZ   LYS  58          2HZ       LYS  58  -3.935 -28.102   3.466
  173   3HZ   LYS  58          3HZ       LYS  58  -2.723 -27.017   3.316
  Start of MODEL    9
    1    H    ARG  43           H        ARG  43   2.241   0.495   0.609
    2    HA   ARG  43           HA       ARG  43   0.516   0.417  -0.772
    3   1HB   ARG  43          2HB       ARG  43   2.601   1.216  -2.758
    4   2HB   ARG  43          3HB       ARG  43   1.278   0.285  -3.430
    5   1HG   ARG  43          2HG       ARG  43   0.096   2.223  -3.503
    6   2HG   ARG  43          3HG       ARG  43  -0.035   2.108  -1.759
    7   1HD   ARG  43          2HD       ARG  43   1.472   3.803  -1.406
    8   2HD   ARG  43          3HD       ARG  43   2.564   3.223  -2.649
    9    HE   ARG  43           HE       ARG  43   0.118   4.364  -3.765
   10   1HH1  ARG  43          2HH2      ARG  43   3.320   5.134  -2.526
   11   2HH1  ARG  43          1HH2      ARG  43   3.439   6.626  -3.399
   12   1HH2  ARG  43          2HH1      ARG  43   0.274   6.331  -4.916
   13   2HH2  ARG  43          1HH1      ARG  43   1.695   7.311  -4.768
   14    H    GLN  44           H        GLN  44   3.522  -1.390  -1.211
   15    HA   GLN  44           HA       GLN  44   2.059  -3.621  -2.338
   16   1HB   GLN  44          2HB       GLN  44   4.961  -2.845  -2.150
   17   2HB   GLN  44          3HB       GLN  44   4.581  -4.552  -2.258
   18   1HG   GLN  44          2HG       GLN  44   3.497  -4.304  -4.377
   19   2HG   GLN  44          3HG       GLN  44   3.322  -2.571  -4.188
   20   1HE2  GLN  44          1HE2      GLN  44   4.957  -4.886  -5.773
   21   2HE2  GLN  44          2HE2      GLN  44   6.444  -4.080  -6.148
   22    H    ILE  45           H        ILE  45   1.487  -2.809   0.396
   23    HA   ILE  45           HA       ILE  45   2.735  -5.004   1.891
   24    HB   ILE  45           HB       ILE  45   1.589  -2.355   2.739
   25   1HG1  ILE  45          2HG1      ILE  45   3.874  -2.201   2.085
   26   2HG1  ILE  45          3HG1      ILE  45   3.827  -2.156   3.836
   27   1HG2  ILE  45          1HG2      ILE  45   2.409  -3.448   5.077
   28   2HG2  ILE  45          2HG2      ILE  45   0.724  -3.448   4.507
   29   3HG2  ILE  45          3HG2      ILE  45   1.745  -4.884   4.263
   30   1HD1  ILE  45          1HD1      ILE  45   5.582  -3.679   3.353
   31   2HD1  ILE  45          2HD1      ILE  45   4.201  -4.736   3.733
   32   3HD1  ILE  45          3HD1      ILE  45   4.665  -4.454   2.038
   33    H    LYS  46           H        LYS  46  -0.216  -3.702   0.507
   34    HA   LYS  46           HA       LYS  46  -1.813  -5.603   2.044
   35   1HB   LYS  46          2HB       LYS  46  -3.716  -4.363   1.354
   36   2HB   LYS  46          3HB       LYS  46  -2.508  -3.198   1.858
   37   1HG   LYS  46          2HG       LYS  46  -2.880  -2.193  -0.154
   38   2HG   LYS  46          3HG       LYS  46  -1.902  -3.477  -0.833
   39   1HD   LYS  46          2HD       LYS  46  -3.735  -3.962  -2.102
   40   2HD   LYS  46          3HD       LYS  46  -4.364  -4.727  -0.656
   41   1HE   LYS  46          2HE       LYS  46  -5.664  -2.800  -0.058
   42   2HE   LYS  46          3HE       LYS  46  -4.770  -1.751  -1.140
   43   1HZ   LYS  46          1HZ       LYS  46  -5.913  -3.900  -2.551
   44   2HZ   LYS  46          2HZ       LYS  46  -7.063  -3.098  -1.713
   45   3HZ   LYS  46          3HZ       LYS  46  -6.119  -2.296  -2.775
   46    H    ILE  47           H        ILE  47  -0.265  -5.090  -1.054
   47    HA   ILE  47           HA       ILE  47  -1.968  -6.999  -2.394
   48    HB   ILE  47           HB       ILE  47  -1.144  -6.171  -4.289
   49   1HG1  ILE  47          2HG1      ILE  47   0.973  -7.273  -4.204
   50   2HG1  ILE  47          3HG1      ILE  47   1.255  -5.611  -4.677
   51   1HG2  ILE  47          1HG2      ILE  47   0.133  -4.008  -2.617
   52   2HG2  ILE  47          2HG2      ILE  47  -0.667  -3.873  -4.201
   53   3HG2  ILE  47          3HG2      ILE  47  -1.632  -4.199  -2.740
   54   1HD1  ILE  47          1HD1      ILE  47   2.801  -5.579  -3.006
   55   2HD1  ILE  47          2HD1      ILE  47   1.410  -5.455  -1.903
   56   3HD1  ILE  47          3HD1      ILE  47   2.131  -7.044  -2.248
   57    H    TRP  48           H        TRP  48   0.532  -7.139  -0.140
   58    HA   TRP  48           HA       TRP  48   1.712  -9.539  -1.305
   59   1HB   TRP  48          2HB       TRP  48   2.729  -7.409   0.207
   60   2HB   TRP  48          3HB       TRP  48   2.718  -8.780   1.299
   61    HD1  TRP  48           HD1      TRP  48   4.898  -7.263  -1.235
   62    HE1  TRP  48           HE1      TRP  48   6.818  -8.857  -2.093
   63    HE3  TRP  48           HE3      TRP  48   2.900 -11.545   0.642
   64    HZ2  TRP  48           HZ2      TRP  48   7.275 -11.667  -1.896
   65    HZ3  TRP  48           HZ3      TRP  48   4.147 -13.671   0.265
   66    HH2  TRP  48           HH2      TRP  48   6.261 -13.776  -0.955
   67    H    PHE  49           H        PHE  49  -0.297  -8.299   1.403
   68    HA   PHE  49           HA       PHE  49  -0.368 -10.666   2.880
   69   1HB   PHE  49          2HB       PHE  49  -2.346  -8.347   2.455
   70   2HB   PHE  49          3HB       PHE  49  -2.531  -9.528   3.736
   71    HD1  PHE  49           HD1      PHE  49  -2.537  -7.081   4.859
   72    HD2  PHE  49           HD2      PHE  49   0.890  -9.092   3.370
   73    HE1  PHE  49           HE1      PHE  49  -1.074  -5.691   6.351
   74    HE2  PHE  49           HE2      PHE  49   2.353  -7.703   4.863
   75    HZ   PHE  49           HZ       PHE  49   1.354  -6.019   6.336
   76    H    GLN  50           H        GLN  50  -2.103  -9.589  -0.030
   77    HA   GLN  50           HA       GLN  50  -4.089 -11.616   0.249
   78   1HB   GLN  50          2HB       GLN  50  -5.074 -10.688  -1.692
   79   2HB   GLN  50          3HB       GLN  50  -4.354  -9.307  -0.888
   80   1HG   GLN  50          2HG       GLN  50  -3.280  -8.874  -2.843
   81   2HG   GLN  50          3HG       GLN  50  -2.255 -10.248  -2.480
   82   1HE2  GLN  50          1HE2      GLN  50  -2.454 -12.125  -3.575
   83   2HE2  GLN  50          2HE2      GLN  50  -3.510 -12.379  -4.925
   84    H    ASN  51           H        ASN  51  -0.826 -11.495  -0.772
   85    HA   ASN  51           HA       ASN  51  -1.124 -13.480  -2.807
   86   1HB   ASN  51          2HB       ASN  51   1.158 -11.921  -1.580
   87   2HB   ASN  51          3HB       ASN  51   1.554 -13.418  -2.399
   88   1HD2  ASN  51          1HD2      ASN  51   2.107 -13.190  -4.415
   89   2HD2  ASN  51          2HD2      ASN  51   1.523 -12.013  -5.546
   90    H    ARG  52           H        ARG  52   0.194 -13.129   0.554
   91    HA   ARG  52           HA       ARG  52   1.109 -15.740   0.752
   92   1HB   ARG  52          2HB       ARG  52   0.468 -13.510   2.682
   93   2HB   ARG  52          3HB       ARG  52   0.678 -15.115   3.355
   94   1HG   ARG  52          2HG       ARG  52   2.901 -15.269   2.121
   95   2HG   ARG  52          3HG       ARG  52   2.696 -13.596   1.639
   96   1HD   ARG  52          2HD       ARG  52   3.426 -12.851   3.661
   97   2HD   ARG  52          3HD       ARG  52   2.250 -13.835   4.509
   98    HE   ARG  52           HE       ARG  52   3.869 -15.536   4.793
   99   1HH1  ARG  52          2HH2      ARG  52   5.077 -13.032   2.636
  100   2HH1  ARG  52          1HH2      ARG  52   6.708 -13.613   2.670
  101   1HH2  ARG  52          2HH1      ARG  52   6.022 -16.302   4.838
  102   2HH2  ARG  52          1HH1      ARG  52   7.250 -15.484   3.930
  103    H    ARG  53           H        ARG  53  -2.084 -14.319   0.889
  104    HA   ARG  53           HA       ARG  53  -3.357 -15.986   2.627
  105   1HB   ARG  53          2HB       ARG  53  -4.079 -13.998   0.751
  106   2HB   ARG  53          3HB       ARG  53  -4.977 -15.408   0.230
  107   1HG   ARG  53          2HG       ARG  53  -6.461 -15.110   1.916
  108   2HG   ARG  53          3HG       ARG  53  -5.178 -15.297   3.096
  109   1HD   ARG  53          2HD       ARG  53  -4.605 -12.851   2.815
  110   2HD   ARG  53          3HD       ARG  53  -5.951 -12.685   1.706
  111    HE   ARG  53           HE       ARG  53  -7.464 -12.837   3.516
  112   1HH1  ARG  53          2HH2      ARG  53  -4.202 -13.620   4.581
  113   2HH1  ARG  53          1HH2      ARG  53  -4.603 -13.571   6.265
  114   1HH2  ARG  53          2HH1      ARG  53  -7.993 -12.772   5.738
  115   2HH2  ARG  53          1HH1      ARG  53  -6.774 -13.086   6.928
  116    H    MET  54           H        MET  54  -1.905 -16.681  -0.458
  117    HA   MET  54           HA       MET  54  -3.572 -18.986  -0.905
  118   1HB   MET  54          2HB       MET  54  -2.591 -17.365  -2.712
  119   2HB   MET  54          3HB       MET  54  -1.050 -18.147  -2.423
  120   1HG   MET  54          2HG       MET  54  -2.874 -20.290  -2.747
  121   2HG   MET  54          3HG       MET  54  -3.358 -19.117  -3.957
  122   1HE   MET  54          1HE       MET  54  -1.791 -21.695  -5.763
  123   2HE   MET  54          2HE       MET  54  -3.064 -20.459  -5.619
  124   3HE   MET  54          3HE       MET  54  -1.645 -20.158  -6.650
  125    H    LYS  55           H        LYS  55  -0.637 -18.136   0.736
  126    HA   LYS  55           HA       LYS  55   0.819 -20.499   0.384
  127   1HB   LYS  55          2HB       LYS  55   1.374 -18.117   1.454
  128   2HB   LYS  55          3HB       LYS  55   0.991 -18.960   2.941
  129   1HG   LYS  55          2HG       LYS  55   2.897 -20.219   2.861
  130   2HG   LYS  55          3HG       LYS  55   2.699 -20.577   1.157
  131   1HD   LYS  55          2HD       LYS  55   4.551 -19.231   0.938
  132   2HD   LYS  55          3HD       LYS  55   3.361 -17.945   0.955
  133   1HE   LYS  55          2HE       LYS  55   4.293 -17.102   2.841
  134   2HE   LYS  55          3HE       LYS  55   3.908 -18.582   3.697
  135   1HZ   LYS  55          1HZ       LYS  55   6.063 -19.224   2.193
  136   2HZ   LYS  55          2HZ       LYS  55   6.401 -17.706   2.693
  137   3HZ   LYS  55          3HZ       LYS  55   6.080 -18.874   3.789
  138    H    TRP  56           H        TRP  56  -1.777 -19.534   2.676
  139    HA   TRP  56           HA       TRP  56  -1.628 -21.585   4.468
  140   1HB   TRP  56          2HB       TRP  56  -3.222 -20.156   5.121
  141   2HB   TRP  56          3HB       TRP  56  -3.703 -19.755   3.485
  142    HD1  TRP  56           HD1      TRP  56  -5.787 -21.121   2.470
  143    HE1  TRP  56           HE1      TRP  56  -7.599 -22.789   3.417
  144    HE3  TRP  56           HE3      TRP  56  -3.403 -22.039   6.865
  145    HZ2  TRP  56           HZ2      TRP  56  -7.827 -24.273   5.844
  146    HZ3  TRP  56           HZ3      TRP  56  -4.487 -23.610   8.468
  147    HH2  TRP  56           HH2      TRP  56  -6.622 -24.711   8.016
  148    H    LYS  57           H        LYS  57  -3.417 -21.494   1.301
  149    HA   LYS  57           HA       LYS  57  -3.870 -24.345   1.496
  150   1HB   LYS  57          2HB       LYS  57  -5.303 -24.063  -0.399
  151   2HB   LYS  57          3HB       LYS  57  -5.645 -22.773   0.736
  152   1HG   LYS  57          2HG       LYS  57  -4.002 -21.314  -0.614
  153   2HG   LYS  57          3HG       LYS  57  -3.992 -22.584  -1.820
  154   1HD   LYS  57          2HD       LYS  57  -6.704 -21.704  -0.918
  155   2HD   LYS  57          3HD       LYS  57  -5.783 -20.501  -1.799
  156   1HE   LYS  57          2HE       LYS  57  -5.316 -22.612  -3.432
  157   2HE   LYS  57          3HE       LYS  57  -6.832 -23.160  -2.746
  158   1HZ   LYS  57          1HZ       LYS  57  -7.945 -21.400  -3.633
  159   2HZ   LYS  57          2HZ       LYS  57  -6.639 -20.422  -3.709
  160   3HZ   LYS  57          3HZ       LYS  57  -6.820 -21.631  -4.793
  161    H    LYS  58           H        LYS  58  -3.525 -25.521  -0.800
  162    HA   LYS  58           HA       LYS  58  -0.705 -25.546  -1.130
  163   1HB   LYS  58          2HB       LYS  58  -3.033 -27.065  -2.263
  164   2HB   LYS  58          3HB       LYS  58  -1.474 -27.184  -3.052
  165   1HG   LYS  58          2HG       LYS  58  -1.295 -28.919  -1.498
  166   2HG   LYS  58          3HG       LYS  58  -0.562 -27.607  -0.595
  167   1HD   LYS  58          2HD       LYS  58  -2.067 -28.239   1.025
  168   2HD   LYS  58          3HD       LYS  58  -3.161 -27.211   0.120
  169   1HE   LYS  58          2HE       LYS  58  -4.483 -28.989  -0.360
  170   2HE   LYS  58          3HE       LYS  58  -3.149 -29.800  -1.154
  171   1HZ   LYS  58          1HZ       LYS  58  -4.229 -30.255   1.419
  172   2HZ   LYS  58          2HZ       LYS  58  -3.260 -31.214   0.519
  173   3HZ   LYS  58          3HZ       LYS  58  -2.608 -30.065   1.480
  Start of MODEL   10
    1    H    ARG  43           H        ARG  43  -2.047   0.098  -1.544
    2    HA   ARG  43           HA       ARG  43   0.220   1.195  -0.224
    3   1HB   ARG  43          2HB       ARG  43  -1.930  -0.322   1.287
    4   2HB   ARG  43          3HB       ARG  43  -0.258  -0.499   1.782
    5   1HG   ARG  43          2HG       ARG  43  -0.035   1.839   2.279
    6   2HG   ARG  43          3HG       ARG  43  -1.483   2.257   1.384
    7   1HD   ARG  43          2HD       ARG  43  -2.788   0.808   3.091
    8   2HD   ARG  43          3HD       ARG  43  -1.318   0.773   4.044
    9    HE   ARG  43           HE       ARG  43  -1.963   3.491   3.298
   10   1HH1  ARG  43          2HH2      ARG  43  -2.906   0.921   5.508
   11   2HH1  ARG  43          1HH2      ARG  43  -3.529   2.006   6.705
   12   1HH2  ARG  43          2HH1      ARG  43  -2.785   4.923   4.877
   13   2HH2  ARG  43          1HH1      ARG  43  -3.460   4.298   6.345
   14    H    GLN  44           H        GLN  44   1.970  -0.377  -0.090
   15    HA   GLN  44           HA       GLN  44   1.492  -2.623  -1.836
   16   1HB   GLN  44          2HB       GLN  44   3.939  -2.772  -1.976
   17   2HB   GLN  44          3HB       GLN  44   3.422  -1.125  -2.276
   18   1HG   GLN  44          2HG       GLN  44   4.066  -0.412  -0.054
   19   2HG   GLN  44          3HG       GLN  44   4.256  -2.064   0.501
   20   1HE2  GLN  44          1HE2      GLN  44   6.104  -3.157   0.156
   21   2HE2  GLN  44          2HE2      GLN  44   7.520  -2.510  -0.603
   22    H    ILE  45           H        ILE  45   1.067  -2.083   1.372
   23    HA   ILE  45           HA       ILE  45   2.302  -4.593   2.221
   24    HB   ILE  45           HB       ILE  45   2.314  -2.142   3.385
   25   1HG1  ILE  45          2HG1      ILE  45   3.139  -3.287   5.385
   26   2HG1  ILE  45          3HG1      ILE  45   2.451  -4.802   4.836
   27   1HG2  ILE  45          1HG2      ILE  45   0.282  -3.658   5.017
   28   2HG2  ILE  45          2HG2      ILE  45   0.799  -1.960   5.155
   29   3HG2  ILE  45          3HG2      ILE  45  -0.203  -2.477   3.777
   30   1HD1  ILE  45          1HD1      ILE  45   4.104  -5.154   3.278
   31   2HD1  ILE  45          2HD1      ILE  45   4.226  -3.427   2.866
   32   3HD1  ILE  45          3HD1      ILE  45   5.024  -4.051   4.329
   33    H    LYS  46           H        LYS  46  -0.222  -4.073   0.468
   34    HA   LYS  46           HA       LYS  46  -1.881  -5.927   1.993
   35   1HB   LYS  46          2HB       LYS  46  -3.893  -4.692   1.600
   36   2HB   LYS  46          3HB       LYS  46  -2.748  -3.628   2.391
   37   1HG   LYS  46          2HG       LYS  46  -2.619  -2.222   0.592
   38   2HG   LYS  46          3HG       LYS  46  -2.516  -3.543  -0.555
   39   1HD   LYS  46          2HD       LYS  46  -4.916  -3.839  -0.588
   40   2HD   LYS  46          3HD       LYS  46  -5.134  -2.827   0.826
   41   1HE   LYS  46          2HE       LYS  46  -5.599  -1.189  -0.713
   42   2HE   LYS  46          3HE       LYS  46  -3.855  -1.047  -0.819
   43   1HZ   LYS  46          1HZ       LYS  46  -3.925  -1.806  -2.871
   44   2HZ   LYS  46          2HZ       LYS  46  -4.783  -3.132  -2.460
   45   3HZ   LYS  46          3HZ       LYS  46  -5.556  -1.742  -2.828
   46    H    ILE  47           H        ILE  47   0.083  -5.698  -0.467
   47    HA   ILE  47           HA       ILE  47  -1.786  -6.897  -2.390
   48    HB   ILE  47           HB       ILE  47  -0.813  -5.791  -4.048
   49   1HG1  ILE  47          2HG1      ILE  47   1.212  -7.208  -3.882
   50   2HG1  ILE  47          3HG1      ILE  47   1.548  -5.581  -4.436
   51   1HG2  ILE  47          1HG2      ILE  47   0.291  -3.644  -3.398
   52   2HG2  ILE  47          2HG2      ILE  47  -1.256  -3.957  -2.577
   53   3HG2  ILE  47          3HG2      ILE  47   0.278  -4.207  -1.710
   54   1HD1  ILE  47          1HD1      ILE  47   2.978  -5.252  -2.714
   55   2HD1  ILE  47          2HD1      ILE  47   1.686  -5.612  -1.543
   56   3HD1  ILE  47          3HD1      ILE  47   2.689  -6.931  -2.193
   57    H    TRP  48           H        TRP  48   1.226  -7.208  -0.521
   58    HA   TRP  48           HA       TRP  48   1.921  -9.685  -1.819
   59   1HB   TRP  48          2HB       TRP  48   3.327  -7.733  -0.476
   60   2HB   TRP  48          3HB       TRP  48   3.254  -9.026   0.704
   61    HD1  TRP  48           HD1      TRP  48   5.238  -7.976  -2.256
   62    HE1  TRP  48           HE1      TRP  48   6.908  -9.832  -3.108
   63    HE3  TRP  48           HE3      TRP  48   3.206 -11.782   0.436
   64    HZ2  TRP  48           HZ2      TRP  48   7.187 -12.622  -2.573
   65    HZ3  TRP  48           HZ3      TRP  48   4.237 -14.040   0.214
   66    HH2  TRP  48           HH2      TRP  48   6.159 -14.491  -1.226
   67    H    PHE  49           H        PHE  49   0.289  -8.468   1.126
   68    HA   PHE  49           HA       PHE  49   0.252 -10.904   2.510
   69   1HB   PHE  49          2HB       PHE  49  -1.338  -8.299   2.433
   70   2HB   PHE  49          3HB       PHE  49  -1.910  -9.597   3.462
   71    HD1  PHE  49           HD1      PHE  49   1.566  -8.448   2.746
   72    HD2  PHE  49           HD2      PHE  49  -1.498  -8.931   5.641
   73    HE1  PHE  49           HE1      PHE  49   3.153  -7.717   4.548
   74    HE2  PHE  49           HE2      PHE  49   0.088  -8.202   7.443
   75    HZ   PHE  49           HZ       PHE  49   2.395  -7.604   6.876
   76    H    GLN  50           H        GLN  50  -1.716  -9.575  -0.132
   77    HA   GLN  50           HA       GLN  50  -3.861 -11.367   0.290
   78   1HB   GLN  50          2HB       GLN  50  -4.840 -10.370  -1.611
   79   2HB   GLN  50          3HB       GLN  50  -3.865  -9.078  -0.938
   80   1HG   GLN  50          2HG       GLN  50  -2.968  -8.904  -3.029
   81   2HG   GLN  50          3HG       GLN  50  -2.030 -10.320  -2.598
   82   1HE2  GLN  50          1HE2      GLN  50  -2.695  -9.679  -5.203
   83   2HE2  GLN  50          2HE2      GLN  50  -3.771 -10.867  -5.860
   84    H    ASN  51           H        ASN  51  -0.709 -11.545  -1.212
   85    HA   ASN  51           HA       ASN  51  -1.423 -13.651  -2.983
   86   1HB   ASN  51          2HB       ASN  51   1.086 -12.178  -2.203
   87   2HB   ASN  51          3HB       ASN  51   1.306 -13.791  -2.853
   88   1HD2  ASN  51          1HD2      ASN  51   1.405 -10.721  -3.688
   89   2HD2  ASN  51          2HD2      ASN  51   0.853 -10.749  -5.330
   90    H    ARG  52           H        ARG  52   0.328 -13.213   0.162
   91    HA   ARG  52           HA       ARG  52   1.130 -15.827   0.456
   92   1HB   ARG  52          2HB       ARG  52   1.760 -13.694   1.825
   93   2HB   ARG  52          3HB       ARG  52   0.322 -14.016   2.773
   94   1HG   ARG  52          2HG       ARG  52   1.241 -16.390   3.154
   95   2HG   ARG  52          3HG       ARG  52   2.739 -15.844   2.426
   96   1HD   ARG  52          2HD       ARG  52   1.773 -13.979   4.503
   97   2HD   ARG  52          3HD       ARG  52   2.028 -15.593   5.134
   98    HE   ARG  52           HE       ARG  52   4.232 -14.668   3.443
   99   1HH1  ARG  52          2HH2      ARG  52   2.913 -14.665   6.704
  100   2HH1  ARG  52          1HH2      ARG  52   4.445 -14.374   7.461
  101   1HH2  ARG  52          2HH1      ARG  52   6.252 -14.284   4.438
  102   2HH2  ARG  52          1HH1      ARG  52   6.356 -14.156   6.163
  103    H    ARG  53           H        ARG  53  -2.019 -14.324   0.731
  104    HA   ARG  53           HA       ARG  53  -3.228 -15.847   2.620
  105   1HB   ARG  53          2HB       ARG  53  -4.018 -13.986   0.659
  106   2HB   ARG  53          3HB       ARG  53  -4.938 -15.418   0.247
  107   1HG   ARG  53          2HG       ARG  53  -5.853 -15.554   2.530
  108   2HG   ARG  53          3HG       ARG  53  -4.827 -14.236   3.060
  109   1HD   ARG  53          2HD       ARG  53  -6.287 -12.671   2.280
  110   2HD   ARG  53          3HD       ARG  53  -6.369 -13.433   0.705
  111    HE   ARG  53           HE       ARG  53  -8.273 -13.752   2.882
  112   1HH1  ARG  53          2HH2      ARG  53  -6.892 -15.364   0.076
  113   2HH1  ARG  53          1HH2      ARG  53  -8.262 -16.394  -0.167
  114   1HH2  ARG  53          2HH1      ARG  53 -10.082 -15.112   2.562
  115   2HH2  ARG  53          1HH1      ARG  53 -10.089 -16.250   1.256
  116    H    MET  54           H        MET  54  -1.973 -16.783  -0.498
  117    HA   MET  54           HA       MET  54  -3.693 -19.061  -0.737
  118   1HB   MET  54          2HB       MET  54  -2.685 -17.681  -2.677
  119   2HB   MET  54          3HB       MET  54  -1.128 -18.377  -2.274
  120   1HG   MET  54          2HG       MET  54  -2.569 -20.677  -2.435
  121   2HG   MET  54          3HG       MET  54  -3.534 -19.689  -3.515
  122   1HE   MET  54          1HE       MET  54  -1.966 -20.292  -6.642
  123   2HE   MET  54          2HE       MET  54  -3.369 -19.992  -5.588
  124   3HE   MET  54          3HE       MET  54  -2.299 -18.646  -6.050
  125    H    LYS  55           H        LYS  55  -0.688 -18.232   0.819
  126    HA   LYS  55           HA       LYS  55   0.737 -20.574   0.675
  127   1HB   LYS  55          2HB       LYS  55   1.636 -18.540   1.630
  128   2HB   LYS  55          3HB       LYS  55   0.471 -18.575   2.937
  129   1HG   LYS  55          2HG       LYS  55   1.530 -21.047   3.287
  130   2HG   LYS  55          3HG       LYS  55   2.906 -20.287   2.514
  131   1HD   LYS  55          2HD       LYS  55   2.703 -18.388   4.222
  132   2HD   LYS  55          3HD       LYS  55   1.491 -19.346   5.050
  133   1HE   LYS  55          2HE       LYS  55   3.555 -21.189   4.720
  134   2HE   LYS  55          3HE       LYS  55   4.439 -19.697   4.964
  135   1HZ   LYS  55          1HZ       LYS  55   4.054 -20.396   7.081
  136   2HZ   LYS  55          2HZ       LYS  55   2.773 -19.402   6.884
  137   3HZ   LYS  55          3HZ       LYS  55   2.578 -21.019   6.765
  138    H    TRP  56           H        TRP  56  -1.929 -19.663   2.947
  139    HA   TRP  56           HA       TRP  56  -1.901 -21.857   4.564
  140   1HB   TRP  56          2HB       TRP  56  -3.910 -19.889   3.683
  141   2HB   TRP  56          3HB       TRP  56  -4.573 -21.397   4.279
  142    HD1  TRP  56           HD1      TRP  56  -3.619 -18.138   5.589
  143    HE1  TRP  56           HE1      TRP  56  -3.193 -18.087   8.193
  144    HE3  TRP  56           HE3      TRP  56  -3.266 -23.178   6.159
  145    HZ2  TRP  56           HZ2      TRP  56  -2.766 -20.117  10.154
  146    HZ3  TRP  56           HZ3      TRP  56  -2.844 -24.062   8.451
  147    HH2  TRP  56           HH2      TRP  56  -2.596 -22.620  10.409
  148    H    LYS  57           H        LYS  57  -3.508 -21.434   1.336
  149    HA   LYS  57           HA       LYS  57  -4.762 -23.831   1.124
  150   1HB   LYS  57          2HB       LYS  57  -4.030 -21.700  -0.587
  151   2HB   LYS  57          3HB       LYS  57  -3.504 -23.165  -1.389
  152   1HG   LYS  57          2HG       LYS  57  -6.238 -23.190  -0.127
  153   2HG   LYS  57          3HG       LYS  57  -6.037 -22.244  -1.589
  154   1HD   LYS  57          2HD       LYS  57  -6.592 -24.321  -2.503
  155   2HD   LYS  57          3HD       LYS  57  -4.843 -24.424  -2.518
  156   1HE   LYS  57          2HE       LYS  57  -5.134 -25.460  -0.097
  157   2HE   LYS  57          3HE       LYS  57  -6.791 -25.734  -0.597
  158   1HZ   LYS  57          1HZ       LYS  57  -5.082 -26.538  -2.645
  159   2HZ   LYS  57          2HZ       LYS  57  -4.575 -27.227  -1.254
  160   3HZ   LYS  57          3HZ       LYS  57  -6.110 -27.451  -1.763
  161    H    LYS  58           H        LYS  58  -4.021 -25.821   1.630
  162    HA   LYS  58           HA       LYS  58  -1.248 -26.423   0.888
  163   1HB   LYS  58          2HB       LYS  58  -2.968 -27.132   3.197
  164   2HB   LYS  58          3HB       LYS  58  -1.974 -28.433   2.573
  165   1HG   LYS  58          2HG       LYS  58  -0.057 -27.495   3.373
  166   2HG   LYS  58          3HG       LYS  58  -0.458 -25.920   2.718
  167   1HD   LYS  58          2HD       LYS  58  -0.472 -25.513   5.039
  168   2HD   LYS  58          3HD       LYS  58  -2.173 -25.757   4.695
  169   1HE   LYS  58          2HE       LYS  58  -1.579 -28.320   5.212
  170   2HE   LYS  58          3HE       LYS  58  -0.230 -27.615   6.080
  171   1HZ   LYS  58          1HZ       LYS  58  -1.611 -27.123   7.699
  172   2HZ   LYS  58          2HZ       LYS  58  -2.518 -26.183   6.721
  173   3HZ   LYS  58          3HZ       LYS  58  -2.871 -27.769   6.885
  Start of MODEL   11
    1    H    ARG  43           H        ARG  43  -3.384  -1.468  -2.081
    2    HA   ARG  43           HA       ARG  43  -1.841  -0.118  -3.179
    3   1HB   ARG  43          2HB       ARG  43  -1.910  -0.162  -0.206
    4   2HB   ARG  43          3HB       ARG  43  -0.524   0.691  -0.855
    5   1HG   ARG  43          2HG       ARG  43  -3.052   1.342  -2.259
    6   2HG   ARG  43          3HG       ARG  43  -3.085   1.754  -0.556
    7   1HD   ARG  43          2HD       ARG  43  -0.521   2.535  -1.724
    8   2HD   ARG  43          3HD       ARG  43  -1.838   3.217  -2.657
    9    HE   ARG  43           HE       ARG  43  -1.151   3.851   0.134
   10   1HH1  ARG  43          2HH2      ARG  43  -3.606   4.032  -2.380
   11   2HH1  ARG  43          1HH2      ARG  43  -4.452   5.348  -1.637
   12   1HH2  ARG  43          2HH1      ARG  43  -2.267   5.588   1.114
   13   2HH2  ARG  43          1HH1      ARG  43  -3.686   6.239   0.364
   14    H    GLN  44           H        GLN  44  -0.281  -2.388  -0.824
   15    HA   GLN  44           HA       GLN  44   1.664  -3.223  -2.521
   16   1HB   GLN  44          2HB       GLN  44   2.247  -0.583  -1.857
   17   2HB   GLN  44          3HB       GLN  44   3.218  -1.478  -0.705
   18   1HG   GLN  44          2HG       GLN  44   4.720  -1.989  -2.322
   19   2HG   GLN  44          3HG       GLN  44   3.475  -2.794  -3.256
   20   1HE2  GLN  44          1HE2      GLN  44   4.267  -2.100  -5.204
   21   2HE2  GLN  44          2HE2      GLN  44   4.145  -0.469  -5.773
   22    H    ILE  45           H        ILE  45   0.694  -2.332   0.792
   23    HA   ILE  45           HA       ILE  45   2.254  -4.562   1.848
   24    HB   ILE  45           HB       ILE  45   1.907  -2.032   2.764
   25   1HG1  ILE  45          2HG1      ILE  45   2.740  -2.982   4.969
   26   2HG1  ILE  45          3HG1      ILE  45   2.554  -4.578   4.270
   27   1HG2  ILE  45          1HG2      ILE  45  -0.546  -2.823   3.243
   28   2HG2  ILE  45          2HG2      ILE  45   0.196  -3.590   4.668
   29   3HG2  ILE  45          3HG2      ILE  45   0.336  -1.831   4.430
   30   1HD1  ILE  45          1HD1      ILE  45   4.870  -3.781   3.975
   31   2HD1  ILE  45          2HD1      ILE  45   4.072  -3.933   2.391
   32   3HD1  ILE  45          3HD1      ILE  45   4.279  -2.328   3.132
   33    H    LYS  46           H        LYS  46  -0.723  -4.011   0.416
   34    HA   LYS  46           HA       LYS  46  -1.982  -6.085   2.074
   35   1HB   LYS  46          2HB       LYS  46  -3.399  -4.293   2.343
   36   2HB   LYS  46          3HB       LYS  46  -3.055  -3.622   0.761
   37   1HG   LYS  46          2HG       LYS  46  -4.333  -5.462  -0.322
   38   2HG   LYS  46          3HG       LYS  46  -4.634  -6.195   1.241
   39   1HD   LYS  46          2HD       LYS  46  -5.698  -3.888   1.891
   40   2HD   LYS  46          3HD       LYS  46  -5.705  -3.558   0.170
   41   1HE   LYS  46          2HE       LYS  46  -7.606  -4.773  -0.053
   42   2HE   LYS  46          3HE       LYS  46  -6.755  -6.205   0.486
   43   1HZ   LYS  46          1HZ       LYS  46  -7.288  -5.694   2.715
   44   2HZ   LYS  46          2HZ       LYS  46  -7.888  -4.224   2.331
   45   3HZ   LYS  46          3HZ       LYS  46  -8.675  -5.575   1.860
   46    H    ILE  47           H        ILE  47  -0.459  -5.355  -0.894
   47    HA   ILE  47           HA       ILE  47  -2.029  -7.266  -2.407
   48    HB   ILE  47           HB       ILE  47  -1.249  -6.251  -4.220
   49   1HG1  ILE  47          2HG1      ILE  47   0.934  -7.311  -4.086
   50   2HG1  ILE  47          3HG1      ILE  47   1.089  -5.656  -4.637
   51   1HG2  ILE  47          1HG2      ILE  47  -0.080  -4.163  -2.376
   52   2HG2  ILE  47          2HG2      ILE  47  -0.829  -3.942  -3.975
   53   3HG2  ILE  47          3HG2      ILE  47  -1.831  -4.402  -2.578
   54   1HD1  ILE  47          1HD1      ILE  47   2.482  -6.811  -2.504
   55   2HD1  ILE  47          2HD1      ILE  47   2.352  -5.069  -2.841
   56   3HD1  ILE  47          3HD1      ILE  47   1.223  -5.841  -1.702
   57    H    TRP  48           H        TRP  48   0.755  -7.141  -0.329
   58    HA   TRP  48           HA       TRP  48   1.920  -9.528  -1.502
   59   1HB   TRP  48          2HB       TRP  48   2.965  -7.325  -0.197
   60   2HB   TRP  48          3HB       TRP  48   3.022  -8.576   1.030
   61    HD1  TRP  48           HD1      TRP  48   4.971  -7.352  -1.886
   62    HE1  TRP  48           HE1      TRP  48   6.927  -8.977  -2.591
   63    HE3  TRP  48           HE3      TRP  48   3.378 -11.316   0.872
   64    HZ2  TRP  48           HZ2      TRP  48   7.573 -11.678  -1.933
   65    HZ3  TRP  48           HZ3      TRP  48   4.728 -13.410   0.785
   66    HH2  TRP  48           HH2      TRP  48   6.761 -13.628  -0.555
   67    H    PHE  49           H        PHE  49  -0.059  -8.381   1.243
   68    HA   PHE  49           HA       PHE  49   0.158 -10.703   2.801
   69   1HB   PHE  49          2HB       PHE  49  -1.798  -8.382   2.441
   70   2HB   PHE  49          3HB       PHE  49  -2.207  -9.671   3.556
   71    HD1  PHE  49           HD1      PHE  49  -2.014  -8.774   5.682
   72    HD2  PHE  49           HD2      PHE  49   1.078  -8.040   2.870
   73    HE1  PHE  49           HE1      PHE  49  -0.652  -7.658   7.470
   74    HE2  PHE  49           HE2      PHE  49   2.440  -6.924   4.658
   75    HZ   PHE  49           HZ       PHE  49   1.559  -6.747   6.937
   76    H    GLN  50           H        GLN  50  -1.762  -9.861  -0.058
   77    HA   GLN  50           HA       GLN  50  -3.658 -11.926   0.377
   78   1HB   GLN  50          2HB       GLN  50  -4.284  -9.931  -0.889
   79   2HB   GLN  50          3HB       GLN  50  -3.006 -10.209  -2.054
   80   1HG   GLN  50          2HG       GLN  50  -4.319 -12.622  -2.187
   81   2HG   GLN  50          3HG       GLN  50  -5.655 -11.563  -1.784
   82   1HE2  GLN  50          1HE2      GLN  50  -3.043 -12.185  -4.046
   83   2HE2  GLN  50          2HE2      GLN  50  -3.687 -11.324  -5.403
   84    H    ASN  51           H        ASN  51  -0.565 -11.530  -1.367
   85    HA   ASN  51           HA       ASN  51  -0.772 -13.770  -2.969
   86   1HB   ASN  51          2HB       ASN  51   1.438 -12.028  -1.920
   87   2HB   ASN  51          3HB       ASN  51   1.934 -13.611  -2.486
   88   1HD2  ASN  51          1HD2      ASN  51   2.464 -13.745  -4.519
   89   2HD2  ASN  51          2HD2      ASN  51   1.894 -12.761  -5.826
   90    H    ARG  52           H        ARG  52   0.340 -13.226   0.416
   91    HA   ARG  52           HA       ARG  52   1.327 -15.856   0.701
   92   1HB   ARG  52          2HB       ARG  52   1.795 -13.560   2.051
   93   2HB   ARG  52          3HB       ARG  52   0.530 -14.187   3.089
   94   1HG   ARG  52          2HG       ARG  52   1.884 -15.811   3.955
   95   2HG   ARG  52          3HG       ARG  52   2.505 -16.260   2.380
   96   1HD   ARG  52          2HD       ARG  52   3.895 -14.051   2.493
   97   2HD   ARG  52          3HD       ARG  52   3.475 -14.014   4.195
   98    HE   ARG  52           HE       ARG  52   4.511 -16.617   3.424
   99   1HH1  ARG  52          2HH2      ARG  52   5.477 -13.338   4.260
  100   2HH1  ARG  52          1HH2      ARG  52   7.051 -13.807   4.814
  101   1HH2  ARG  52          2HH1      ARG  52   6.586 -17.236   4.155
  102   2HH2  ARG  52          1HH1      ARG  52   7.685 -16.039   4.753
  103    H    ARG  53           H        ARG  53  -1.794 -14.283   0.918
  104    HA   ARG  53           HA       ARG  53  -2.948 -16.017   2.781
  105   1HB   ARG  53          2HB       ARG  53  -3.728 -13.728   1.244
  106   2HB   ARG  53          3HB       ARG  53  -4.890 -14.983   0.864
  107   1HG   ARG  53          2HG       ARG  53  -4.528 -15.171   3.669
  108   2HG   ARG  53          3HG       ARG  53  -4.564 -13.450   3.344
  109   1HD   ARG  53          2HD       ARG  53  -6.636 -14.944   1.840
  110   2HD   ARG  53          3HD       ARG  53  -6.804 -15.111   3.576
  111    HE   ARG  53           HE       ARG  53  -7.291 -12.806   3.755
  112   1HH1  ARG  53          2HH2      ARG  53  -6.189 -13.573   0.502
  113   2HH1  ARG  53          1HH2      ARG  53  -6.652 -12.039  -0.154
  114   1HH2  ARG  53          2HH1      ARG  53  -7.902 -10.781   2.889
  115   2HH2  ARG  53          1HH1      ARG  53  -7.632 -10.440   1.212
  116    H    MET  54           H        MET  54  -2.086 -16.295  -0.592
  117    HA   MET  54           HA       MET  54  -4.071 -18.177  -1.287
  118   1HB   MET  54          2HB       MET  54  -1.662 -16.898  -2.477
  119   2HB   MET  54          3HB       MET  54  -1.884 -18.550  -3.022
  120   1HG   MET  54          2HG       MET  54  -3.752 -18.028  -4.251
  121   2HG   MET  54          3HG       MET  54  -4.405 -16.987  -3.001
  122   1HE   MET  54          1HE       MET  54  -4.101 -15.178  -6.458
  123   2HE   MET  54          2HE       MET  54  -5.012 -16.371  -5.502
  124   3HE   MET  54          3HE       MET  54  -4.978 -14.664  -4.997
  125    H    LYS  55           H        LYS  55  -1.067 -18.311   0.487
  126    HA   LYS  55           HA       LYS  55  -1.134 -21.242   0.285
  127   1HB   LYS  55          2HB       LYS  55   1.130 -19.313   0.144
  128   2HB   LYS  55          3HB       LYS  55   1.404 -20.778   1.061
  129   1HG   LYS  55          2HG       LYS  55   1.401 -22.102  -0.808
  130   2HG   LYS  55          3HG       LYS  55   0.016 -21.283  -1.503
  131   1HD   LYS  55          2HD       LYS  55   2.233 -19.433  -1.523
  132   2HD   LYS  55          3HD       LYS  55   2.804 -20.958  -2.169
  133   1HE   LYS  55          2HE       LYS  55   0.727 -20.975  -3.685
  134   2HE   LYS  55          3HE       LYS  55   0.412 -19.336  -3.149
  135   1HZ   LYS  55          1HZ       LYS  55   2.916 -19.088  -3.836
  136   2HZ   LYS  55          2HZ       LYS  55   2.535 -20.319  -4.838
  137   3HZ   LYS  55          3HZ       LYS  55   1.706 -18.915  -4.919
  138    H    TRP  56           H        TRP  56  -2.922 -20.367   2.004
  139    HA   TRP  56           HA       TRP  56  -1.819 -21.119   4.525
  140   1HB   TRP  56          2HB       TRP  56  -1.837 -18.349   3.925
  141   2HB   TRP  56          3HB       TRP  56  -3.137 -18.631   5.065
  142    HD1  TRP  56           HD1      TRP  56   0.060 -20.765   5.312
  143    HE1  TRP  56           HE1      TRP  56   1.395 -20.238   7.527
  144    HE3  TRP  56           HE3      TRP  56  -2.778 -16.779   6.697
  145    HZ2  TRP  56           HZ2      TRP  56   1.120 -18.257   9.564
  146    HZ3  TRP  56           HZ3      TRP  56  -2.177 -15.605   8.812
  147    HH2  TRP  56           HH2      TRP  56  -0.303 -16.284  10.228
  148    H    LYS  57           H        LYS  57  -4.513 -19.523   2.700
  149    HA   LYS  57           HA       LYS  57  -6.579 -20.285   4.363
  150   1HB   LYS  57          2HB       LYS  57  -6.443 -18.730   2.235
  151   2HB   LYS  57          3HB       LYS  57  -6.944 -20.179   1.385
  152   1HG   LYS  57          2HG       LYS  57  -8.515 -19.759   3.843
  153   2HG   LYS  57          3HG       LYS  57  -8.624 -18.385   2.760
  154   1HD   LYS  57          2HD       LYS  57  -8.878 -20.537   1.005
  155   2HD   LYS  57          3HD       LYS  57  -9.696 -21.131   2.436
  156   1HE   LYS  57          2HE       LYS  57 -10.527 -18.406   2.081
  157   2HE   LYS  57          3HE       LYS  57 -10.617 -19.168   0.506
  158   1HZ   LYS  57          1HZ       LYS  57 -12.092 -20.733   1.287
  159   2HZ   LYS  57          2HZ       LYS  57 -11.701 -20.517   2.858
  160   3HZ   LYS  57          3HZ       LYS  57 -12.580 -19.387   2.072
  161    H    LYS  58           H        LYS  58  -8.257 -21.986   4.004
  162    HA   LYS  58           HA       LYS  58  -6.923 -24.504   3.609
  163   1HB   LYS  58          2HB       LYS  58  -8.854 -25.477   4.590
  164   2HB   LYS  58          3HB       LYS  58  -8.503 -24.021   5.499
  165   1HG   LYS  58          2HG       LYS  58 -10.188 -23.068   3.491
  166   2HG   LYS  58          3HG       LYS  58 -10.847 -24.661   3.803
  167   1HD   LYS  58          2HD       LYS  58 -10.224 -23.435   6.348
  168   2HD   LYS  58          3HD       LYS  58 -11.130 -22.278   5.394
  169   1HE   LYS  58          2HE       LYS  58 -12.774 -24.233   4.885
  170   2HE   LYS  58          3HE       LYS  58 -11.963 -25.102   6.172
  171   1HZ   LYS  58          1HZ       LYS  58 -13.947 -23.271   6.462
  172   2HZ   LYS  58          2HZ       LYS  58 -13.031 -23.900   7.659
  173   3HZ   LYS  58          3HZ       LYS  58 -12.613 -22.479   6.972
  Start of MODEL   12
    1    H    ARG  43           H        ARG  43   2.995   0.614   0.077
    2    HA   ARG  43           HA       ARG  43   0.866   0.477  -0.753
    3   1HB   ARG  43          2HB       ARG  43   1.696   2.354  -2.568
    4   2HB   ARG  43          3HB       ARG  43   1.652   0.948  -3.613
    5   1HG   ARG  43          2HG       ARG  43  -0.727   1.180  -1.855
    6   2HG   ARG  43          3HG       ARG  43  -0.540   2.533  -2.953
    7   1HD   ARG  43          2HD       ARG  43  -0.026  -0.020  -4.319
    8   2HD   ARG  43          3HD       ARG  43  -1.614  -0.007  -3.578
    9    HE   ARG  43           HE       ARG  43  -0.756   1.589  -5.855
   10   1HH1  ARG  43          2HH2      ARG  43  -2.961   1.532  -3.113
   11   2HH1  ARG  43          1HH2      ARG  43  -4.101   2.612  -3.845
   12   1HH2  ARG  43          2HH1      ARG  43  -2.259   3.014  -6.820
   13   2HH2  ARG  43          1HH1      ARG  43  -3.699   3.460  -5.966
   14    H    GLN  44           H        GLN  44   2.626  -1.516  -0.168
   15    HA   GLN  44           HA       GLN  44   2.029  -3.419  -2.241
   16   1HB   GLN  44          2HB       GLN  44   4.804  -2.535  -1.523
   17   2HB   GLN  44          3HB       GLN  44   4.565  -4.255  -1.757
   18   1HG   GLN  44          2HG       GLN  44   3.178  -3.170  -3.920
   19   2HG   GLN  44          3HG       GLN  44   4.521  -2.059  -3.749
   20   1HE2  GLN  44          1HE2      GLN  44   6.663  -3.276  -3.175
   21   2HE2  GLN  44          2HE2      GLN  44   7.071  -4.597  -4.219
   22    H    ILE  45           H        ILE  45   1.348  -2.644   0.671
   23    HA   ILE  45           HA       ILE  45   2.230  -5.101   1.992
   24    HB   ILE  45           HB       ILE  45   2.251  -2.529   2.864
   25   1HG1  ILE  45          2HG1      ILE  45   2.661  -3.470   5.085
   26   2HG1  ILE  45          3HG1      ILE  45   1.951  -4.997   4.601
   27   1HG2  ILE  45          1HG2      ILE  45  -0.350  -2.771   2.870
   28   2HG2  ILE  45          2HG2      ILE  45  -0.072  -3.672   4.380
   29   3HG2  ILE  45          3HG2      ILE  45   0.480  -1.986   4.236
   30   1HD1  ILE  45          1HD1      ILE  45   3.920  -5.673   3.716
   31   2HD1  ILE  45          2HD1      ILE  45   3.956  -4.251   2.645
   32   3HD1  ILE  45          3HD1      ILE  45   4.660  -4.154   4.278
   33    H    LYS  46           H        LYS  46  -0.388  -3.691   0.254
   34    HA   LYS  46           HA       LYS  46  -2.295  -5.496   1.550
   35   1HB   LYS  46          2HB       LYS  46  -4.028  -4.140   0.589
   36   2HB   LYS  46          3HB       LYS  46  -2.890  -3.094   1.416
   37   1HG   LYS  46          2HG       LYS  46  -1.772  -3.127  -1.092
   38   2HG   LYS  46          3HG       LYS  46  -3.460  -3.345  -1.510
   39   1HD   LYS  46          2HD       LYS  46  -3.283  -1.294   0.529
   40   2HD   LYS  46          3HD       LYS  46  -2.126  -0.919  -0.732
   41   1HE   LYS  46          2HE       LYS  46  -3.975  -1.241  -2.447
   42   2HE   LYS  46          3HE       LYS  46  -5.108  -1.460  -1.129
   43   1HZ   LYS  46          1HZ       LYS  46  -3.410   0.913  -1.223
   44   2HZ   LYS  46          2HZ       LYS  46  -4.791   0.851  -2.094
   45   3HZ   LYS  46          3HZ       LYS  46  -4.843   0.712  -0.468
   46    H    ILE  47           H        ILE  47  -0.001  -5.618  -0.804
   47    HA   ILE  47           HA       ILE  47  -1.716  -7.199  -2.589
   48    HB   ILE  47           HB       ILE  47  -0.659  -6.360  -4.348
   49   1HG1  ILE  47          2HG1      ILE  47   1.377  -7.671  -3.820
   50   2HG1  ILE  47          3HG1      ILE  47   1.717  -6.151  -4.626
   51   1HG2  ILE  47          1HG2      ILE  47   0.338  -4.102  -4.023
   52   2HG2  ILE  47          2HG2      ILE  47  -1.231  -4.321  -3.212
   53   3HG2  ILE  47          3HG2      ILE  47   0.276  -4.371  -2.265
   54   1HD1  ILE  47          1HD1      ILE  47   3.037  -6.932  -2.402
   55   2HD1  ILE  47          2HD1      ILE  47   2.727  -5.217  -2.765
   56   3HD1  ILE  47          3HD1      ILE  47   1.675  -6.091  -1.625
   57    H    TRP  48           H        TRP  48   0.865  -7.208  -0.248
   58    HA   TRP  48           HA       TRP  48   1.854  -9.785  -1.156
   59   1HB   TRP  48          2HB       TRP  48   2.902  -7.580   0.339
   60   2HB   TRP  48          3HB       TRP  48   2.973  -9.018   1.337
   61    HD1  TRP  48           HD1      TRP  48   5.352  -7.348  -0.571
   62    HE1  TRP  48           HE1      TRP  48   7.115  -8.825  -1.865
   63    HE3  TRP  48           HE3      TRP  48   2.665 -11.661  -0.380
   64    HZ2  TRP  48           HZ2      TRP  48   7.187 -11.570  -2.645
   65    HZ3  TRP  48           HZ3      TRP  48   3.653 -13.693  -1.432
   66    HH2  TRP  48           HH2      TRP  48   5.834 -13.694  -2.536
   67    H    PHE  49           H        PHE  49  -0.238  -8.236   1.281
   68    HA   PHE  49           HA       PHE  49  -0.397 -10.481   2.987
   69   1HB   PHE  49          2HB       PHE  49  -1.958  -7.917   2.420
   70   2HB   PHE  49          3HB       PHE  49  -2.631  -9.083   3.542
   71    HD1  PHE  49           HD1      PHE  49   0.990  -8.545   3.265
   72    HD2  PHE  49           HD2      PHE  49  -2.535  -7.588   5.424
   73    HE1  PHE  49           HE1      PHE  49   2.385  -7.574   5.111
   74    HE2  PHE  49           HE2      PHE  49  -1.141  -6.617   7.272
   75    HZ   PHE  49           HZ       PHE  49   1.304  -6.622   7.093
   76    H    GLN  50           H        GLN  50  -1.833  -9.662  -0.098
   77    HA   GLN  50           HA       GLN  50  -3.953 -11.588   0.348
   78   1HB   GLN  50          2HB       GLN  50  -4.992 -10.683  -1.647
   79   2HB   GLN  50          3HB       GLN  50  -4.492  -9.338  -0.641
   80   1HG   GLN  50          2HG       GLN  50  -3.229  -8.523  -2.335
   81   2HG   GLN  50          3HG       GLN  50  -2.262  -9.984  -2.332
   82   1HE2  GLN  50          1HE2      GLN  50  -2.010 -10.001  -4.534
   83   2HE2  GLN  50          2HE2      GLN  50  -3.274 -10.412  -5.646
   84    H    ASN  51           H        ASN  51  -0.773 -11.697  -0.465
   85    HA   ASN  51           HA       ASN  51  -1.211 -13.644  -2.585
   86   1HB   ASN  51          2HB       ASN  51   1.115 -11.846  -1.829
   87   2HB   ASN  51          3HB       ASN  51   1.455 -13.337  -2.685
   88   1HD2  ASN  51          1HD2      ASN  51   2.075 -12.486  -4.587
   89   2HD2  ASN  51          2HD2      ASN  51   1.049 -11.608  -5.670
   90    H    ARG  52           H        ARG  52   0.328 -12.927   0.590
   91    HA   ARG  52           HA       ARG  52   1.594 -15.428   0.789
   92   1HB   ARG  52          2HB       ARG  52   1.770 -13.017   2.137
   93   2HB   ARG  52          3HB       ARG  52   0.907 -13.986   3.315
   94   1HG   ARG  52          2HG       ARG  52   3.304 -15.232   1.983
   95   2HG   ARG  52          3HG       ARG  52   3.603 -13.974   3.166
   96   1HD   ARG  52          2HD       ARG  52   2.591 -15.210   4.933
   97   2HD   ARG  52          3HD       ARG  52   1.700 -16.244   3.832
   98    HE   ARG  52           HE       ARG  52   4.630 -16.452   3.600
   99   1HH1  ARG  52          2HH2      ARG  52   1.719 -17.717   5.118
  100   2HH1  ARG  52          1HH2      ARG  52   2.432 -19.247   5.506
  101   1HH2  ARG  52          2HH1      ARG  52   5.572 -18.470   4.113
  102   2HH2  ARG  52          1HH1      ARG  52   4.639 -19.678   4.931
  103    H    ARG  53           H        ARG  53  -1.653 -14.231   1.326
  104    HA   ARG  53           HA       ARG  53  -2.294 -16.357   3.138
  105   1HB   ARG  53          2HB       ARG  53  -3.750 -13.965   1.992
  106   2HB   ARG  53          3HB       ARG  53  -4.709 -15.280   2.644
  107   1HG   ARG  53          2HG       ARG  53  -3.655 -15.080   4.829
  108   2HG   ARG  53          3HG       ARG  53  -2.435 -13.984   4.210
  109   1HD   ARG  53          2HD       ARG  53  -3.785 -12.230   4.712
  110   2HD   ARG  53          3HD       ARG  53  -4.951 -12.807   3.538
  111    HE   ARG  53           HE       ARG  53  -5.233 -14.351   5.935
  112   1HH1  ARG  53          2HH2      ARG  53  -5.816 -11.097   4.729
  113   2HH1  ARG  53          1HH2      ARG  53  -7.119 -10.785   5.828
  114   1HH2  ARG  53          2HH1      ARG  53  -6.952 -13.941   7.384
  115   2HH2  ARG  53          1HH1      ARG  53  -7.770 -12.414   7.348
  116    H    MET  54           H        MET  54  -1.376 -17.624   0.945
  117    HA   MET  54           HA       MET  54  -3.807 -18.686  -0.202
  118   1HB   MET  54          2HB       MET  54  -1.912 -16.998  -1.618
  119   2HB   MET  54          3HB       MET  54  -1.779 -18.617  -2.276
  120   1HG   MET  54          2HG       MET  54  -4.286 -18.663  -2.588
  121   2HG   MET  54          3HG       MET  54  -4.369 -17.014  -2.001
  122   1HE   MET  54          1HE       MET  54  -3.589 -19.065  -5.517
  123   2HE   MET  54          2HE       MET  54  -5.037 -18.762  -4.526
  124   3HE   MET  54          3HE       MET  54  -4.731 -17.780  -5.979
  125    H    LYS  55           H        LYS  55  -0.214 -18.874   0.133
  126    HA   LYS  55           HA       LYS  55   0.318 -21.348  -0.752
  127   1HB   LYS  55          2HB       LYS  55   1.648 -19.462   0.717
  128   2HB   LYS  55          3HB       LYS  55   1.516 -20.762   1.885
  129   1HG   LYS  55          2HG       LYS  55   3.262 -21.776   0.854
  130   2HG   LYS  55          3HG       LYS  55   2.214 -22.070  -0.519
  131   1HD   LYS  55          2HD       LYS  55   2.822 -19.609  -1.229
  132   2HD   LYS  55          3HD       LYS  55   4.147 -19.766  -0.092
  133   1HE   LYS  55          2HE       LYS  55   5.044 -21.702  -1.292
  134   2HE   LYS  55          3HE       LYS  55   3.629 -21.787  -2.322
  135   1HZ   LYS  55          1HZ       LYS  55   5.003 -20.602  -3.629
  136   2HZ   LYS  55          2HZ       LYS  55   4.353 -19.340  -2.822
  137   3HZ   LYS  55          3HZ       LYS  55   5.824 -19.909  -2.398
  138    H    TRP  56           H        TRP  56  -0.933 -20.580   2.572
  139    HA   TRP  56           HA       TRP  56  -1.089 -23.069   3.599
  140   1HB   TRP  56          2HB       TRP  56  -1.780 -21.597   5.138
  141   2HB   TRP  56          3HB       TRP  56  -2.542 -20.544   3.962
  142    HD1  TRP  56           HD1      TRP  56  -5.179 -20.703   3.796
  143    HE1  TRP  56           HE1      TRP  56  -7.109 -22.136   4.884
  144    HE3  TRP  56           HE3      TRP  56  -2.117 -24.107   6.007
  145    HZ2  TRP  56           HZ2      TRP  56  -7.137 -24.481   6.510
  146    HZ3  TRP  56           HZ3      TRP  56  -3.177 -25.936   7.328
  147    HH2  TRP  56           HH2      TRP  56  -5.596 -26.156   7.597
  148    H    LYS  57           H        LYS  57  -3.480 -21.445   1.403
  149    HA   LYS  57           HA       LYS  57  -5.213 -22.252   0.273
  150   1HB   LYS  57          2HB       LYS  57  -4.678 -23.939  -1.319
  151   2HB   LYS  57          3HB       LYS  57  -3.219 -23.009  -1.039
  152   1HG   LYS  57          2HG       LYS  57  -2.170 -24.739   0.158
  153   2HG   LYS  57          3HG       LYS  57  -3.686 -25.458   0.664
  154   1HD   LYS  57          2HD       LYS  57  -3.352 -26.969  -1.007
  155   2HD   LYS  57          3HD       LYS  57  -3.848 -25.693  -2.101
  156   1HE   LYS  57          2HE       LYS  57  -1.047 -25.319  -1.406
  157   2HE   LYS  57          3HE       LYS  57  -1.289 -26.968  -1.948
  158   1HZ   LYS  57          1HZ       LYS  57  -0.858 -25.253  -3.697
  159   2HZ   LYS  57          2HZ       LYS  57  -2.148 -26.220  -3.962
  160   3HZ   LYS  57          3HZ       LYS  57  -2.369 -24.688  -3.438
  161    H    LYS  58           H        LYS  58  -6.108 -24.948  -0.218
  162    HA   LYS  58           HA       LYS  58  -6.627 -25.948   2.475
  163   1HB   LYS  58          2HB       LYS  58  -8.440 -24.293   1.344
  164   2HB   LYS  58          3HB       LYS  58  -8.975 -25.812   0.657
  165   1HG   LYS  58          2HG       LYS  58  -9.209 -26.821   2.871
  166   2HG   LYS  58          3HG       LYS  58  -8.439 -25.445   3.638
  167   1HD   LYS  58          2HD       LYS  58 -10.645 -24.844   3.997
  168   2HD   LYS  58          3HD       LYS  58 -10.426 -24.094   2.428
  169   1HE   LYS  58          2HE       LYS  58 -11.845 -25.563   1.386
  170   2HE   LYS  58          3HE       LYS  58 -11.199 -26.948   2.241
  171   1HZ   LYS  58          1HZ       LYS  58 -12.620 -25.219   3.968
  172   2HZ   LYS  58          2HZ       LYS  58 -13.561 -25.732   2.737
  173   3HZ   LYS  58          3HZ       LYS  58 -12.823 -26.817   3.709
  Start of MODEL   13
    1    H    ARG  43           H        ARG  43  -1.948   1.382  -3.274
    2    HA   ARG  43           HA       ARG  43  -0.266   1.621  -1.048
    3   1HB   ARG  43          2HB       ARG  43  -1.449  -0.099   0.396
    4   2HB   ARG  43          3HB       ARG  43  -2.299   1.430   0.285
    5   1HG   ARG  43          2HG       ARG  43  -3.455   0.191  -1.829
    6   2HG   ARG  43          3HG       ARG  43  -3.017  -1.236  -0.911
    7   1HD   ARG  43          2HD       ARG  43  -5.113  -0.798   0.015
    8   2HD   ARG  43          3HD       ARG  43  -4.105   0.105   1.128
    9    HE   ARG  43           HE       ARG  43  -5.006   1.644  -1.216
   10   1HH1  ARG  43          2HH2      ARG  43  -5.682   0.725   2.113
   11   2HH1  ARG  43          1HH2      ARG  43  -6.719   2.080   2.411
   12   1HH2  ARG  43          2HH1      ARG  43  -6.375   3.431  -0.822
   13   2HH2  ARG  43          1HH1      ARG  43  -7.116   3.630   0.730
   14    H    GLN  44           H        GLN  44   0.713  -0.654  -0.501
   15    HA   GLN  44           HA       GLN  44   0.266  -2.595  -2.566
   16   1HB   GLN  44          2HB       GLN  44   2.346  -0.698  -2.875
   17   2HB   GLN  44          3HB       GLN  44   3.148  -2.157  -2.331
   18   1HG   GLN  44          2HG       GLN  44   2.097  -3.466  -4.143
   19   2HG   GLN  44          3HG       GLN  44   1.154  -2.076  -4.644
   20   1HE2  GLN  44          1HE2      GLN  44   2.405  -2.955  -6.631
   21   2HE2  GLN  44          2HE2      GLN  44   3.876  -2.132  -7.025
   22    H    ILE  45           H        ILE  45   0.073  -2.158   0.468
   23    HA   ILE  45           HA       ILE  45   1.981  -4.198   1.337
   24    HB   ILE  45           HB       ILE  45   2.205  -2.369   2.718
   25   1HG1  ILE  45          2HG1      ILE  45   1.554  -4.632   3.849
   26   2HG1  ILE  45          3HG1      ILE  45   1.715  -3.177   4.813
   27   1HG2  ILE  45          1HG2      ILE  45   0.583  -0.843   2.132
   28   2HG2  ILE  45          2HG2      ILE  45  -0.749  -2.002   2.351
   29   3HG2  ILE  45          3HG2      ILE  45   0.062  -1.300   3.771
   30   1HD1  ILE  45          1HD1      ILE  45  -0.545  -3.035   5.244
   31   2HD1  ILE  45          2HD1      ILE  45  -0.996  -3.661   3.641
   32   3HD1  ILE  45          3HD1      ILE  45  -0.473  -4.783   4.919
   33    H    LYS  46           H        LYS  46  -0.998  -4.059  -0.058
   34    HA   LYS  46           HA       LYS  46  -2.040  -6.220   1.636
   35   1HB   LYS  46          2HB       LYS  46  -4.223  -5.568   1.090
   36   2HB   LYS  46          3HB       LYS  46  -3.382  -4.064   1.411
   37   1HG   LYS  46          2HG       LYS  46  -3.077  -3.657  -0.998
   38   2HG   LYS  46          3HG       LYS  46  -3.744  -5.229  -1.389
   39   1HD   LYS  46          2HD       LYS  46  -5.823  -4.281   0.067
   40   2HD   LYS  46          3HD       LYS  46  -5.157  -2.744  -0.446
   41   1HE   LYS  46          2HE       LYS  46  -5.149  -4.426  -2.762
   42   2HE   LYS  46          3HE       LYS  46  -6.704  -4.665  -1.992
   43   1HZ   LYS  46          1HZ       LYS  46  -6.426  -2.732  -3.587
   44   2HZ   LYS  46          2HZ       LYS  46  -7.200  -2.439  -2.179
   45   3HZ   LYS  46          3HZ       LYS  46  -5.648  -1.968  -2.371
   46    H    ILE  47           H        ILE  47  -0.236  -5.663  -1.091
   47    HA   ILE  47           HA       ILE  47  -1.584  -7.608  -2.762
   48    HB   ILE  47           HB       ILE  47  -0.473  -6.700  -4.458
   49   1HG1  ILE  47          2HG1      ILE  47   1.633  -7.814  -3.770
   50   2HG1  ILE  47          3HG1      ILE  47   1.887  -6.273  -4.566
   51   1HG2  ILE  47          1HG2      ILE  47   0.423  -4.547  -2.539
   52   2HG2  ILE  47          2HG2      ILE  47  -0.052  -4.393  -4.248
   53   3HG2  ILE  47          3HG2      ILE  47  -1.278  -4.766  -3.012
   54   1HD1  ILE  47          1HD1      ILE  47   2.889  -7.053  -2.048
   55   2HD1  ILE  47          2HD1      ILE  47   2.926  -5.415  -2.743
   56   3HD1  ILE  47          3HD1      ILE  47   1.585  -5.900  -1.679
   57    H    TRP  48           H        TRP  48   1.107  -7.329  -0.469
   58    HA   TRP  48           HA       TRP  48   2.185  -9.895  -1.251
   59   1HB   TRP  48          2HB       TRP  48   3.237  -7.614  -0.096
   60   2HB   TRP  48          3HB       TRP  48   3.132  -8.726   1.254
   61    HD1  TRP  48           HD1      TRP  48   5.404  -7.879  -1.537
   62    HE1  TRP  48           HE1      TRP  48   7.309  -9.662  -1.929
   63    HE3  TRP  48           HE3      TRP  48   3.306 -11.520   1.324
   64    HZ2  TRP  48           HZ2      TRP  48   7.715 -12.335  -1.019
   65    HZ3  TRP  48           HZ3      TRP  48   4.522 -13.688   1.521
   66    HH2  TRP  48           HH2      TRP  48   6.652 -14.124   0.407
   67    H    PHE  49           H        PHE  49   0.176  -8.361   1.304
   68    HA   PHE  49           HA       PHE  49   0.118 -10.554   3.034
   69   1HB   PHE  49          2HB       PHE  49  -1.616  -8.128   2.380
   70   2HB   PHE  49          3HB       PHE  49  -2.212  -9.292   3.545
   71    HD1  PHE  49           HD1      PHE  49   1.318  -8.244   3.096
   72    HD2  PHE  49           HD2      PHE  49  -2.161  -8.016   5.515
   73    HE1  PHE  49           HE1      PHE  49   2.648  -7.118   4.901
   74    HE2  PHE  49           HE2      PHE  49  -0.830  -6.889   7.322
   75    HZ   PHE  49           HZ       PHE  49   1.558  -6.454   6.993
   76    H    GLN  50           H        GLN  50  -1.529  -9.876  -0.015
   77    HA   GLN  50           HA       GLN  50  -3.620 -11.734   0.487
   78   1HB   GLN  50          2HB       GLN  50  -4.227 -10.003  -0.994
   79   2HB   GLN  50          3HB       GLN  50  -2.717 -10.084  -1.878
   80   1HG   GLN  50          2HG       GLN  50  -4.268 -12.615  -1.955
   81   2HG   GLN  50          3HG       GLN  50  -5.109 -11.258  -2.677
   82   1HE2  GLN  50          1HE2      GLN  50  -2.814 -13.658  -3.098
   83   2HE2  GLN  50          2HE2      GLN  50  -2.080 -13.132  -4.577
   84    H    ASN  51           H        ASN  51  -0.386 -11.747  -1.003
   85    HA   ASN  51           HA       ASN  51  -0.672 -14.095  -2.442
   86   1HB   ASN  51          2HB       ASN  51   1.640 -12.513  -1.304
   87   2HB   ASN  51          3HB       ASN  51   1.980 -14.137  -1.870
   88   1HD2  ASN  51          1HD2      ASN  51   2.896 -14.011  -3.769
   89   2HD2  ASN  51          2HD2      ASN  51   2.376 -13.065  -5.124
   90    H    ARG  52           H        ARG  52   0.395 -13.341   0.934
   91    HA   ARG  52           HA       ARG  52   1.096 -15.988   1.526
   92   1HB   ARG  52          2HB       ARG  52   0.925 -13.392   2.932
   93   2HB   ARG  52          3HB       ARG  52   0.494 -14.733   3.975
   94   1HG   ARG  52          2HG       ARG  52   2.772 -15.643   2.560
   95   2HG   ARG  52          3HG       ARG  52   3.129 -13.967   2.928
   96   1HD   ARG  52          2HD       ARG  52   2.061 -14.821   5.338
   97   2HD   ARG  52          3HD       ARG  52   2.838 -16.288   4.776
   98    HE   ARG  52           HE       ARG  52   4.778 -14.373   4.333
   99   1HH1  ARG  52          2HH2      ARG  52   2.853 -15.255   7.144
  100   2HH1  ARG  52          1HH2      ARG  52   4.062 -14.770   8.284
  101   1HH2  ARG  52          2HH1      ARG  52   6.375 -13.734   5.838
  102   2HH2  ARG  52          1HH1      ARG  52   6.079 -13.899   7.537
  103    H    ARG  53           H        ARG  53  -1.917 -14.208   1.372
  104    HA   ARG  53           HA       ARG  53  -3.293 -15.808   3.242
  105   1HB   ARG  53          2HB       ARG  53  -3.820 -13.385   2.223
  106   2HB   ARG  53          3HB       ARG  53  -4.698 -14.306   1.019
  107   1HG   ARG  53          2HG       ARG  53  -5.525 -15.496   3.408
  108   2HG   ARG  53          3HG       ARG  53  -5.362 -13.811   3.863
  109   1HD   ARG  53          2HD       ARG  53  -6.670 -14.050   1.249
  110   2HD   ARG  53          3HD       ARG  53  -7.522 -14.997   2.452
  111    HE   ARG  53           HE       ARG  53  -6.802 -12.301   3.368
  112   1HH1  ARG  53          2HH2      ARG  53  -9.230 -14.255   1.734
  113   2HH1  ARG  53          1HH2      ARG  53 -10.523 -13.151   2.062
  114   1HH2  ARG  53          2HH1      ARG  53  -8.508 -10.844   3.801
  115   2HH2  ARG  53          1HH1      ARG  53 -10.110 -11.198   3.246
  116    H    MET  54           H        MET  54  -2.346 -16.100  -0.114
  117    HA   MET  54           HA       MET  54  -4.117 -18.410  -0.341
  118   1HB   MET  54          2HB       MET  54  -4.302 -16.150  -1.887
  119   2HB   MET  54          3HB       MET  54  -3.101 -17.022  -2.819
  120   1HG   MET  54          2HG       MET  54  -5.406 -18.699  -1.963
  121   2HG   MET  54          3HG       MET  54  -5.846 -17.384  -3.034
  122   1HE   MET  54          1HE       MET  54  -6.356 -19.961  -4.915
  123   2HE   MET  54          2HE       MET  54  -5.096 -21.156  -4.525
  124   3HE   MET  54          3HE       MET  54  -6.031 -20.389  -3.219
  125    H    LYS  55           H        LYS  55  -1.803 -18.972   0.864
  126    HA   LYS  55           HA       LYS  55  -0.427 -20.528  -1.109
  127   1HB   LYS  55          2HB       LYS  55   0.707 -18.351  -1.360
  128   2HB   LYS  55          3HB       LYS  55   1.090 -18.343   0.349
  129   1HG   LYS  55          2HG       LYS  55   2.353 -20.503   0.052
  130   2HG   LYS  55          3HG       LYS  55   2.009 -20.449  -1.666
  131   1HD   LYS  55          2HD       LYS  55   3.488 -18.239  -0.162
  132   2HD   LYS  55          3HD       LYS  55   4.293 -19.537  -1.020
  133   1HE   LYS  55          2HE       LYS  55   2.381 -18.469  -2.852
  134   2HE   LYS  55          3HE       LYS  55   3.131 -17.083  -2.087
  135   1HZ   LYS  55          1HZ       LYS  55   4.198 -18.541  -4.079
  136   2HZ   LYS  55          2HZ       LYS  55   5.021 -17.498  -3.130
  137   3HZ   LYS  55          3HZ       LYS  55   5.012 -19.093  -2.777
  138    H    TRP  56           H        TRP  56  -0.537 -19.225   2.260
  139    HA   TRP  56           HA       TRP  56   0.887 -21.092   3.588
  140   1HB   TRP  56          2HB       TRP  56   0.133 -19.576   5.050
  141   2HB   TRP  56          3HB       TRP  56  -1.384 -19.339   4.205
  142    HD1  TRP  56           HD1      TRP  56  -3.485 -20.824   5.039
  143    HE1  TRP  56           HE1      TRP  56  -4.004 -22.323   7.147
  144    HE3  TRP  56           HE3      TRP  56   1.332 -21.175   6.632
  145    HZ2  TRP  56           HZ2      TRP  56  -2.379 -23.462   9.199
  146    HZ3  TRP  56           HZ3      TRP  56   1.779 -22.498   8.695
  147    HH2  TRP  56           HH2      TRP  56   0.017 -23.619   9.967
  148    H    LYS  57           H        LYS  57  -2.613 -21.317   2.623
  149    HA   LYS  57           HA       LYS  57  -3.245 -23.737   3.615
  150   1HB   LYS  57          2HB       LYS  57  -4.732 -22.181   2.352
  151   2HB   LYS  57          3HB       LYS  57  -4.003 -22.730   0.857
  152   1HG   LYS  57          2HG       LYS  57  -4.770 -25.048   2.427
  153   2HG   LYS  57          3HG       LYS  57  -6.138 -23.955   2.330
  154   1HD   LYS  57          2HD       LYS  57  -4.518 -24.781  -0.119
  155   2HD   LYS  57          3HD       LYS  57  -5.924 -25.672   0.426
  156   1HE   LYS  57          2HE       LYS  57  -6.290 -22.711   0.141
  157   2HE   LYS  57          3HE       LYS  57  -6.049 -23.596  -1.353
  158   1HZ   LYS  57          1HZ       LYS  57  -7.832 -25.096  -0.606
  159   2HZ   LYS  57          2HZ       LYS  57  -8.111 -24.118   0.671
  160   3HZ   LYS  57          3HZ       LYS  57  -8.341 -23.564  -0.849
  161    H    LYS  58           H        LYS  58  -2.707 -25.859   3.316
  162    HA   LYS  58           HA       LYS  58  -0.534 -26.351   1.458
  163   1HB   LYS  58          2HB       LYS  58  -0.244 -27.097   3.746
  164   2HB   LYS  58          3HB       LYS  58  -1.741 -28.007   3.692
  165   1HG   LYS  58          2HG       LYS  58  -0.246 -29.717   3.205
  166   2HG   LYS  58          3HG       LYS  58  -0.594 -29.173   1.576
  167   1HD   LYS  58          2HD       LYS  58   1.442 -27.844   1.489
  168   2HD   LYS  58          3HD       LYS  58   1.729 -28.054   3.204
  169   1HE   LYS  58          2HE       LYS  58   1.555 -30.486   1.397
  170   2HE   LYS  58          3HE       LYS  58   3.041 -29.560   1.471
  171   1HZ   LYS  58          1HZ       LYS  58   1.732 -31.059   3.595
  172   2HZ   LYS  58          2HZ       LYS  58   3.299 -31.080   3.134
  173   3HZ   LYS  58          3HZ       LYS  58   2.716 -29.815   3.986
  Start of MODEL   14
    1    H    ARG  43           H        ARG  43  -1.892  -0.437  -1.087
    2    HA   ARG  43           HA       ARG  43  -0.559   0.525  -2.581
    3   1HB   ARG  43          2HB       ARG  43   1.016   1.201  -0.132
    4   2HB   ARG  43          3HB       ARG  43   1.978   1.008  -1.584
    5   1HG   ARG  43          2HG       ARG  43   0.427   2.620  -2.772
    6   2HG   ARG  43          3HG       ARG  43  -0.427   2.866  -1.262
    7   1HD   ARG  43          2HD       ARG  43   2.518   3.194  -1.026
    8   2HD   ARG  43          3HD       ARG  43   1.771   4.344  -2.115
    9    HE   ARG  43           HE       ARG  43   0.094   4.401   0.085
   10   1HH1  ARG  43          2HH2      ARG  43   3.567   4.789  -0.333
   11   2HH1  ARG  43          1HH2      ARG  43   3.742   5.848   1.028
   12   1HH2  ARG  43          2HH1      ARG  43   0.323   5.799   1.878
   13   2HH2  ARG  43          1HH1      ARG  43   1.884   6.426   2.293
   14    H    GLN  44           H        GLN  44   1.378  -1.350  -0.125
   15    HA   GLN  44           HA       GLN  44   1.731  -3.408  -2.106
   16   1HB   GLN  44          2HB       GLN  44   3.675  -1.671  -2.222
   17   2HB   GLN  44          3HB       GLN  44   4.188  -2.333  -0.683
   18   1HG   GLN  44          2HG       GLN  44   4.116  -4.658  -1.793
   19   2HG   GLN  44          3HG       GLN  44   3.895  -3.833  -3.323
   20   1HE2  GLN  44          1HE2      GLN  44   5.692  -3.801  -4.422
   21   2HE2  GLN  44          2HE2      GLN  44   7.287  -3.475  -3.827
   22    H    ILE  45           H        ILE  45   0.397  -2.831   0.615
   23    HA   ILE  45           HA       ILE  45   1.682  -5.042   2.064
   24    HB   ILE  45           HB       ILE  45   0.687  -2.397   2.949
   25   1HG1  ILE  45          2HG1      ILE  45   2.508  -3.557   4.765
   26   2HG1  ILE  45          3HG1      ILE  45   3.057  -4.044   3.174
   27   1HG2  ILE  45          1HG2      ILE  45   0.184  -3.223   5.219
   28   2HG2  ILE  45          2HG2      ILE  45  -0.971  -3.815   4.002
   29   3HG2  ILE  45          3HG2      ILE  45   0.301  -4.895   4.620
   30   1HD1  ILE  45          1HD1      ILE  45   3.758  -1.683   4.237
   31   2HD1  ILE  45          2HD1      ILE  45   3.484  -1.865   2.488
   32   3HD1  ILE  45          3HD1      ILE  45   2.207  -1.178   3.521
   33    H    LYS  46           H        LYS  46  -0.919  -4.107   0.147
   34    HA   LYS  46           HA       LYS  46  -2.692  -6.010   1.514
   35   1HB   LYS  46          2HB       LYS  46  -4.561  -4.816   0.663
   36   2HB   LYS  46          3HB       LYS  46  -3.486  -3.632   1.379
   37   1HG   LYS  46          2HG       LYS  46  -3.360  -2.526  -0.593
   38   2HG   LYS  46          3HG       LYS  46  -2.679  -3.946  -1.363
   39   1HD   LYS  46          2HD       LYS  46  -5.212  -4.779  -1.402
   40   2HD   LYS  46          3HD       LYS  46  -5.575  -3.074  -1.218
   41   1HE   LYS  46          2HE       LYS  46  -3.550  -3.818  -3.317
   42   2HE   LYS  46          3HE       LYS  46  -5.221  -4.230  -3.644
   43   1HZ   LYS  46          1HZ       LYS  46  -4.845  -2.071  -4.439
   44   2HZ   LYS  46          2HZ       LYS  46  -5.751  -1.888  -3.092
   45   3HZ   LYS  46          3HZ       LYS  46  -4.151  -1.565  -3.049
   46    H    ILE  47           H        ILE  47  -0.440  -5.771  -0.911
   47    HA   ILE  47           HA       ILE  47  -1.968  -7.573  -2.655
   48    HB   ILE  47           HB       ILE  47  -0.026  -6.890  -4.268
   49   1HG1  ILE  47          2HG1      ILE  47   0.653  -4.522  -3.947
   50   2HG1  ILE  47          3HG1      ILE  47  -0.086  -4.535  -2.359
   51   1HG2  ILE  47          1HG2      ILE  47  -1.756  -4.596  -4.241
   52   2HG2  ILE  47          2HG2      ILE  47  -1.734  -5.985  -5.353
   53   3HG2  ILE  47          3HG2      ILE  47  -2.692  -6.060  -3.855
   54   1HD1  ILE  47          1HD1      ILE  47   2.543  -5.249  -2.917
   55   2HD1  ILE  47          2HD1      ILE  47   1.658  -5.668  -1.431
   56   3HD1  ILE  47          3HD1      ILE  47   1.731  -6.826  -2.780
   57    H    TRP  48           H        TRP  48   0.796  -7.136  -0.527
   58    HA   TRP  48           HA       TRP  48   2.069  -9.558  -1.481
   59   1HB   TRP  48          2HB       TRP  48   3.007  -7.228  -0.363
   60   2HB   TRP  48          3HB       TRP  48   3.049  -8.332   0.998
   61    HD1  TRP  48           HD1      TRP  48   5.034  -7.416  -2.029
   62    HE1  TRP  48           HE1      TRP  48   7.078  -9.030  -2.452
   63    HE3  TRP  48           HE3      TRP  48   3.552 -11.006   1.252
   64    HZ2  TRP  48           HZ2      TRP  48   7.830 -11.570  -1.391
   65    HZ3  TRP  48           HZ3      TRP  48   4.999 -13.022   1.499
   66    HH2  TRP  48           HH2      TRP  48   7.072 -13.335   0.243
   67    H    PHE  49           H        PHE  49  -0.104  -8.343   1.058
   68    HA   PHE  49           HA       PHE  49   0.215 -10.505   2.829
   69   1HB   PHE  49          2HB       PHE  49  -1.260  -9.149   4.006
   70   2HB   PHE  49          3HB       PHE  49  -1.103  -8.024   2.672
   71    HD1  PHE  49           HD1      PHE  49  -2.759  -8.256   0.727
   72    HD2  PHE  49           HD2      PHE  49  -3.329 -10.128   4.492
   73    HE1  PHE  49           HE1      PHE  49  -5.208  -8.494   0.238
   74    HE2  PHE  49           HE2      PHE  49  -5.779 -10.366   4.003
   75    HZ   PHE  49           HZ       PHE  49  -6.690  -9.546   1.881
   76    H    GLN  50           H        GLN  50  -1.945  -9.872   0.023
   77    HA   GLN  50           HA       GLN  50  -3.525 -12.155   0.533
   78   1HB   GLN  50          2HB       GLN  50  -4.625 -11.620  -1.550
   79   2HB   GLN  50          3HB       GLN  50  -4.279 -10.107  -0.738
   80   1HG   GLN  50          2HG       GLN  50  -2.995  -9.398  -2.469
   81   2HG   GLN  50          3HG       GLN  50  -1.996 -10.834  -2.379
   82   1HE2  GLN  50          1HE2      GLN  50  -2.073 -12.252  -3.961
   83   2HE2  GLN  50          2HE2      GLN  50  -3.268 -12.347  -5.213
   84    H    ASN  51           H        ASN  51  -0.337 -11.774  -0.532
   85    HA   ASN  51           HA       ASN  51  -0.439 -13.938  -2.416
   86   1HB   ASN  51          2HB       ASN  51   1.689 -12.027  -1.405
   87   2HB   ASN  51          3HB       ASN  51   2.203 -13.509  -2.188
   88   1HD2  ASN  51          1HD2      ASN  51   2.457 -10.715  -3.010
   89   2HD2  ASN  51          2HD2      ASN  51   1.729 -10.568  -4.575
   90    H    ARG  52           H        ARG  52   0.786 -13.113   0.883
   91    HA   ARG  52           HA       ARG  52   1.996 -15.640   1.236
   92   1HB   ARG  52          2HB       ARG  52   2.322 -13.222   2.442
   93   2HB   ARG  52          3HB       ARG  52   1.233 -13.948   3.607
   94   1HG   ARG  52          2HG       ARG  52   2.791 -15.494   4.318
   95   2HG   ARG  52          3HG       ARG  52   3.460 -15.721   2.714
   96   1HD   ARG  52          2HD       ARG  52   5.125 -14.215   3.103
   97   2HD   ARG  52          3HD       ARG  52   3.990 -12.999   3.655
   98    HE   ARG  52           HE       ARG  52   4.068 -14.720   5.797
   99   1HH1  ARG  52          2HH2      ARG  52   6.591 -13.143   3.919
  100   2HH1  ARG  52          1HH2      ARG  52   7.709 -13.074   5.240
  101   1HH2  ARG  52          2HH1      ARG  52   5.543 -14.630   7.540
  102   2HH2  ARG  52          1HH1      ARG  52   7.109 -13.926   7.314
  103    H    ARG  53           H        ARG  53  -1.221 -14.314   1.552
  104    HA   ARG  53           HA       ARG  53  -1.980 -16.594   3.189
  105   1HB   ARG  53          2HB       ARG  53  -3.018 -13.784   2.922
  106   2HB   ARG  53          3HB       ARG  53  -4.220 -15.028   3.209
  107   1HG   ARG  53          2HG       ARG  53  -2.606 -15.827   5.131
  108   2HG   ARG  53          3HG       ARG  53  -1.866 -14.247   4.963
  109   1HD   ARG  53          2HD       ARG  53  -4.102 -13.168   5.337
  110   2HD   ARG  53          3HD       ARG  53  -4.831 -14.751   5.522
  111    HE   ARG  53           HE       ARG  53  -3.892 -14.925   7.670
  112   1HH1  ARG  53          2HH2      ARG  53  -2.393 -12.253   5.937
  113   2HH1  ARG  53          1HH2      ARG  53  -1.558 -11.651   7.331
  114   1HH2  ARG  53          2HH1      ARG  53  -2.791 -14.130   9.509
  115   2HH2  ARG  53          1HH1      ARG  53  -1.786 -12.726   9.375
  116    H    MET  54           H        MET  54  -1.425 -16.815   0.332
  117    HA   MET  54           HA       MET  54  -4.139 -17.177  -0.680
  118   1HB   MET  54          2HB       MET  54  -1.875 -15.829  -1.779
  119   2HB   MET  54          3HB       MET  54  -1.985 -17.323  -2.688
  120   1HG   MET  54          2HG       MET  54  -4.643 -16.134  -2.328
  121   2HG   MET  54          3HG       MET  54  -3.545 -14.985  -3.067
  122   1HE   MET  54          1HE       MET  54  -5.040 -18.916  -3.949
  123   2HE   MET  54          2HE       MET  54  -5.834 -17.485  -3.250
  124   3HE   MET  54          3HE       MET  54  -5.986 -17.827  -4.990
  125    H    LYS  55           H        LYS  55  -1.132 -18.696   0.241
  126    HA   LYS  55           HA       LYS  55  -2.043 -21.194  -1.008
  127   1HB   LYS  55          2HB       LYS  55   0.420 -19.882  -1.263
  128   2HB   LYS  55          3HB       LYS  55   0.735 -21.187  -0.138
  129   1HG   LYS  55          2HG       LYS  55  -0.153 -22.848  -1.697
  130   2HG   LYS  55          3HG       LYS  55  -0.746 -21.600  -2.774
  131   1HD   LYS  55          2HD       LYS  55   1.936 -20.919  -2.572
  132   2HD   LYS  55          3HD       LYS  55   2.013 -22.666  -2.453
  133   1HE   LYS  55          2HE       LYS  55   2.165 -22.099  -4.806
  134   2HE   LYS  55          3HE       LYS  55   0.589 -22.821  -4.549
  135   1HZ   LYS  55          1HZ       LYS  55   0.624 -20.720  -5.846
  136   2HZ   LYS  55          2HZ       LYS  55  -0.409 -20.718  -4.581
  137   3HZ   LYS  55          3HZ       LYS  55   1.012 -19.921  -4.476
  138    H    TRP  56           H        TRP  56  -3.367 -20.416   1.276
  139    HA   TRP  56           HA       TRP  56  -2.222 -22.282   3.228
  140   1HB   TRP  56          2HB       TRP  56  -2.416 -19.480   3.562
  141   2HB   TRP  56          3HB       TRP  56  -3.679 -20.189   4.548
  142    HD1  TRP  56           HD1      TRP  56   0.162 -20.770   4.035
  143    HE1  TRP  56           HE1      TRP  56   1.311 -21.395   6.326
  144    HE3  TRP  56           HE3      TRP  56  -4.118 -20.780   6.780
  145    HZ2  TRP  56           HZ2      TRP  56   0.323 -21.813   8.971
  146    HZ3  TRP  56           HZ3      TRP  56  -3.938 -21.307   9.210
  147    HH2  TRP  56           HH2      TRP  56  -1.814 -21.812  10.309
  148    H    LYS  57           H        LYS  57  -5.081 -20.345   2.110
  149    HA   LYS  57           HA       LYS  57  -6.767 -22.592   2.968
  150   1HB   LYS  57          2HB       LYS  57  -7.256 -20.518   4.152
  151   2HB   LYS  57          3HB       LYS  57  -7.435 -19.652   2.638
  152   1HG   LYS  57          2HG       LYS  57  -9.573 -20.381   2.370
  153   2HG   LYS  57          3HG       LYS  57  -9.113 -22.049   2.640
  154   1HD   LYS  57          2HD       LYS  57  -9.102 -20.334   5.084
  155   2HD   LYS  57          3HD       LYS  57 -10.680 -20.576   4.360
  156   1HE   LYS  57          2HE       LYS  57 -10.711 -22.533   5.540
  157   2HE   LYS  57          3HE       LYS  57  -9.671 -23.147   4.272
  158   1HZ   LYS  57          1HZ       LYS  57  -8.383 -21.689   6.404
  159   2HZ   LYS  57          2HZ       LYS  57  -8.977 -23.161   6.784
  160   3HZ   LYS  57          3HZ       LYS  57  -7.874 -23.010   5.590
  161    H    LYS  58           H        LYS  58  -7.121 -23.945   1.285
  162    HA   LYS  58           HA       LYS  58  -6.841 -23.166  -1.386
  163   1HB   LYS  58          2HB       LYS  58  -7.822 -25.575   0.080
  164   2HB   LYS  58          3HB       LYS  58  -8.261 -25.425  -1.609
  165   1HG   LYS  58          2HG       LYS  58  -5.701 -24.853  -1.963
  166   2HG   LYS  58          3HG       LYS  58  -5.490 -25.589  -0.387
  167   1HD   LYS  58          2HD       LYS  58  -6.932 -27.566  -1.407
  168   2HD   LYS  58          3HD       LYS  58  -6.485 -26.866  -2.950
  169   1HE   LYS  58          2HE       LYS  58  -4.059 -26.923  -1.513
  170   2HE   LYS  58          3HE       LYS  58  -4.844 -28.424  -1.065
  171   1HZ   LYS  58          1HZ       LYS  58  -5.037 -27.842  -3.846
  172   2HZ   LYS  58          2HZ       LYS  58  -3.495 -28.011  -3.338
  173   3HZ   LYS  58          3HZ       LYS  58  -4.569 -29.218  -3.102
  Start of MODEL   15
    1    H    ARG  43           H        ARG  43   2.384   1.602  -2.886
    2    HA   ARG  43           HA       ARG  43   2.153   0.658  -0.921
    3   1HB   ARG  43          2HB       ARG  43  -0.611  -0.048  -1.959
    4   2HB   ARG  43          3HB       ARG  43  -0.019  -0.827  -0.506
    5   1HG   ARG  43          2HG       ARG  43  -0.206   1.083   0.755
    6   2HG   ARG  43          3HG       ARG  43   0.413   2.109  -0.523
    7   1HD   ARG  43          2HD       ARG  43  -1.794   2.017  -1.686
    8   2HD   ARG  43          3HD       ARG  43  -2.418   0.953  -0.441
    9    HE   ARG  43           HE       ARG  43  -1.317   3.488   0.574
   10   1HH1  ARG  43          2HH2      ARG  43  -4.186   1.801  -0.569
   11   2HH1  ARG  43          1HH2      ARG  43  -5.289   2.887   0.207
   12   1HH2  ARG  43          2HH1      ARG  43  -2.773   4.922   1.597
   13   2HH2  ARG  43          1HH1      ARG  43  -4.480   4.674   1.448
   14    H    GLN  44           H        GLN  44   2.229  -1.679   0.021
   15    HA   GLN  44           HA       GLN  44   2.279  -3.753  -1.931
   16   1HB   GLN  44          2HB       GLN  44   4.762  -2.385  -1.108
   17   2HB   GLN  44          3HB       GLN  44   4.824  -4.115  -0.838
   18   1HG   GLN  44          2HG       GLN  44   4.744  -4.618  -3.093
   19   2HG   GLN  44          3HG       GLN  44   3.662  -3.291  -3.464
   20   1HE2  GLN  44          1HE2      GLN  44   5.185  -3.160  -5.302
   21   2HE2  GLN  44          2HE2      GLN  44   6.593  -2.163  -5.152
   22    H    ILE  45           H        ILE  45   0.882  -3.021   0.598
   23    HA   ILE  45           HA       ILE  45   1.804  -5.273   2.244
   24    HB   ILE  45           HB       ILE  45   0.965  -2.517   2.930
   25   1HG1  ILE  45          2HG1      ILE  45   2.500  -3.662   4.965
   26   2HG1  ILE  45          3HG1      ILE  45   3.132  -4.384   3.498
   27   1HG2  ILE  45          1HG2      ILE  45  -0.898  -3.749   3.869
   28   2HG2  ILE  45          2HG2      ILE  45   0.215  -4.903   4.642
   29   3HG2  ILE  45          3HG2      ILE  45   0.187  -3.203   5.170
   30   1HD1  ILE  45          1HD1      ILE  45   2.584  -1.430   3.425
   31   2HD1  ILE  45          2HD1      ILE  45   3.977  -1.984   4.386
   32   3HD1  ILE  45          3HD1      ILE  45   3.886  -2.363   2.649
   33    H    LYS  46           H        LYS  46  -0.507  -4.179   0.050
   34    HA   LYS  46           HA       LYS  46  -2.566  -5.871   1.287
   35   1HB   LYS  46          2HB       LYS  46  -4.214  -4.568   0.065
   36   2HB   LYS  46          3HB       LYS  46  -3.242  -3.527   1.085
   37   1HG   LYS  46          2HG       LYS  46  -2.814  -2.270  -0.756
   38   2HG   LYS  46          3HG       LYS  46  -1.811  -3.584  -1.335
   39   1HD   LYS  46          2HD       LYS  46  -3.774  -4.613  -2.469
   40   2HD   LYS  46          3HD       LYS  46  -4.812  -3.342  -1.853
   41   1HE   LYS  46          2HE       LYS  46  -3.093  -1.711  -3.038
   42   2HE   LYS  46          3HE       LYS  46  -2.617  -3.138  -3.936
   43   1HZ   LYS  46          1HZ       LYS  46  -5.352  -3.119  -3.958
   44   2HZ   LYS  46          2HZ       LYS  46  -4.920  -1.570  -4.240
   45   3HZ   LYS  46          3HZ       LYS  46  -4.359  -2.762  -5.205
   46    H    ILE  47           H        ILE  47  -0.084  -5.911  -0.917
   47    HA   ILE  47           HA       ILE  47  -1.596  -7.639  -2.751
   48    HB   ILE  47           HB       ILE  47   0.529  -7.178  -4.196
   49   1HG1  ILE  47          2HG1      ILE  47   1.391  -4.868  -3.873
   50   2HG1  ILE  47          3HG1      ILE  47   0.524  -4.770  -2.352
   51   1HG2  ILE  47          1HG2      ILE  47  -2.023  -5.773  -3.858
   52   2HG2  ILE  47          2HG2      ILE  47  -0.775  -4.811  -4.687
   53   3HG2  ILE  47          3HG2      ILE  47  -1.238  -6.408  -5.325
   54   1HD1  ILE  47          1HD1      ILE  47   2.077  -6.023  -1.255
   55   2HD1  ILE  47          2HD1      ILE  47   2.152  -7.225  -2.566
   56   3HD1  ILE  47          3HD1      ILE  47   3.116  -5.732  -2.671
   57    H    TRP  48           H        TRP  48   0.993  -7.357  -0.387
   58    HA   TRP  48           HA       TRP  48   2.138  -9.906  -1.151
   59   1HB   TRP  48          2HB       TRP  48   3.000  -7.585   0.280
   60   2HB   TRP  48          3HB       TRP  48   3.134  -8.973   1.341
   61    HD1  TRP  48           HD1      TRP  48   5.501  -7.254  -0.477
   62    HE1  TRP  48           HE1      TRP  48   7.375  -8.657  -1.697
   63    HE3  TRP  48           HE3      TRP  48   2.978 -11.668  -0.404
   64    HZ2  TRP  48           HZ2      TRP  48   7.586 -11.394  -2.477
   65    HZ3  TRP  48           HZ3      TRP  48   4.090 -13.657  -1.417
   66    HH2  TRP  48           HH2      TRP  48   6.313 -13.570  -2.427
   67    H    PHE  49           H        PHE  49  -0.149  -8.434   1.143
   68    HA   PHE  49           HA       PHE  49  -0.185 -10.549   2.992
   69   1HB   PHE  49          2HB       PHE  49  -1.663  -9.049   3.973
   70   2HB   PHE  49          3HB       PHE  49  -1.276  -7.984   2.638
   71    HD1  PHE  49           HD1      PHE  49  -2.730  -8.162   0.526
   72    HD2  PHE  49           HD2      PHE  49  -3.848  -9.827   4.266
   73    HE1  PHE  49           HE1      PHE  49  -5.127  -8.220  -0.216
   74    HE2  PHE  49           HE2      PHE  49  -6.245  -9.885   3.524
   75    HZ   PHE  49           HZ       PHE  49  -6.856  -9.081   1.292
   76    H    GLN  50           H        GLN  50  -1.991  -9.866  -0.042
   77    HA   GLN  50           HA       GLN  50  -3.771 -12.027   0.383
   78   1HB   GLN  50          2HB       GLN  50  -4.453 -11.539  -2.001
   79   2HB   GLN  50          3HB       GLN  50  -4.539 -10.153  -0.932
   80   1HG   GLN  50          2HG       GLN  50  -2.642  -9.122  -1.878
   81   2HG   GLN  50          3HG       GLN  50  -1.973 -10.635  -2.454
   82   1HE2  GLN  50          1HE2      GLN  50  -1.723 -10.120  -4.548
   83   2HE2  GLN  50          2HE2      GLN  50  -3.010  -9.779  -5.656
   84    H    ASN  51           H        ASN  51  -0.546 -11.616  -0.930
   85    HA   ASN  51           HA       ASN  51  -0.661 -13.934  -2.559
   86   1HB   ASN  51          2HB       ASN  51   1.465 -11.975  -1.672
   87   2HB   ASN  51          3HB       ASN  51   2.003 -13.522  -2.294
   88   1HD2  ASN  51          1HD2      ASN  51   2.221 -10.779  -3.354
   89   2HD2  ASN  51          2HD2      ASN  51   1.553 -10.804  -4.952
   90    H    ARG  52           H        ARG  52   0.182 -13.042   0.784
   91    HA   ARG  52           HA       ARG  52   1.405 -15.611   1.226
   92   1HB   ARG  52          2HB       ARG  52   2.296 -13.390   2.196
   93   2HB   ARG  52          3HB       ARG  52   0.908 -13.390   3.265
   94   1HG   ARG  52          2HG       ARG  52   2.223 -14.603   4.682
   95   2HG   ARG  52          3HG       ARG  52   1.859 -15.960   3.636
   96   1HD   ARG  52          2HD       ARG  52   4.029 -16.102   2.979
   97   2HD   ARG  52          3HD       ARG  52   4.018 -14.435   2.441
   98    HE   ARG  52           HE       ARG  52   4.229 -14.137   5.159
   99   1HH1  ARG  52          2HH2      ARG  52   5.999 -16.124   2.857
  100   2HH1  ARG  52          1HH2      ARG  52   7.467 -16.108   3.777
  101   1HH2  ARG  52          2HH1      ARG  52   6.165 -14.114   6.373
  102   2HH2  ARG  52          1HH1      ARG  52   7.561 -14.957   5.791
  103    H    ARG  53           H        ARG  53  -1.692 -14.162   1.282
  104    HA   ARG  53           HA       ARG  53  -2.587 -15.964   3.375
  105   1HB   ARG  53          2HB       ARG  53  -3.157 -13.463   3.477
  106   2HB   ARG  53          3HB       ARG  53  -4.149 -13.693   2.051
  107   1HG   ARG  53          2HG       ARG  53  -5.072 -15.741   3.661
  108   2HG   ARG  53          3HG       ARG  53  -4.653 -14.538   4.865
  109   1HD   ARG  53          2HD       ARG  53  -6.112 -13.431   2.518
  110   2HD   ARG  53          3HD       ARG  53  -7.037 -14.598   3.441
  111    HE   ARG  53           HE       ARG  53  -5.737 -12.729   5.220
  112   1HH1  ARG  53          2HH2      ARG  53  -8.444 -13.008   2.989
  113   2HH1  ARG  53          1HH2      ARG  53  -9.387 -11.790   3.781
  114   1HH2  ARG  53          2HH1      ARG  53  -6.981 -11.121   6.265
  115   2HH2  ARG  53          1HH1      ARG  53  -8.549 -10.709   5.656
  116    H    MET  54           H        MET  54  -2.124 -17.631   1.486
  117    HA   MET  54           HA       MET  54  -4.403 -18.754   0.685
  118   1HB   MET  54          2HB       MET  54  -3.862 -16.386  -0.922
  119   2HB   MET  54          3HB       MET  54  -3.706 -17.793  -1.955
  120   1HG   MET  54          2HG       MET  54  -6.001 -18.490  -0.682
  121   2HG   MET  54          3HG       MET  54  -6.134 -16.749  -0.518
  122   1HE   MET  54          1HE       MET  54  -6.882 -19.270  -4.149
  123   2HE   MET  54          2HE       MET  54  -6.006 -19.792  -2.690
  124   3HE   MET  54          3HE       MET  54  -7.700 -19.259  -2.568
  125    H    LYS  55           H        LYS  55  -1.038 -17.924  -0.039
  126    HA   LYS  55           HA       LYS  55  -0.519 -20.074  -1.783
  127   1HB   LYS  55          2HB       LYS  55   0.806 -17.826  -1.093
  128   2HB   LYS  55          3HB       LYS  55   1.662 -18.974  -0.083
  129   1HG   LYS  55          2HG       LYS  55   1.221 -20.052  -2.782
  130   2HG   LYS  55          3HG       LYS  55   2.072 -18.522  -2.841
  131   1HD   LYS  55          2HD       LYS  55   2.954 -20.629  -0.852
  132   2HD   LYS  55          3HD       LYS  55   3.421 -20.791  -2.533
  133   1HE   LYS  55          2HE       LYS  55   3.898 -18.235  -0.935
  134   2HE   LYS  55          3HE       LYS  55   5.075 -19.530  -1.017
  135   1HZ   LYS  55          1HZ       LYS  55   5.399 -17.804  -2.691
  136   2HZ   LYS  55          2HZ       LYS  55   5.177 -19.275  -3.366
  137   3HZ   LYS  55          3HZ       LYS  55   3.965 -18.179  -3.377
  138    H    TRP  56           H        TRP  56  -0.931 -19.787   1.695
  139    HA   TRP  56           HA       TRP  56  -0.140 -22.609   1.922
  140   1HB   TRP  56          2HB       TRP  56   0.749 -22.216   4.101
  141   2HB   TRP  56          3HB       TRP  56   1.543 -21.148   2.960
  142    HD1  TRP  56           HD1      TRP  56   0.190 -18.511   2.937
  143    HE1  TRP  56           HE1      TRP  56  -0.430 -16.987   5.000
  144    HE3  TRP  56           HE3      TRP  56   0.252 -22.248   6.385
  145    HZ2  TRP  56           HZ2      TRP  56  -0.815 -17.504   7.780
  146    HZ3  TRP  56           HZ3      TRP  56  -0.257 -21.652   8.751
  147    HH2  TRP  56           HH2      TRP  56  -0.777 -19.375   9.469
  148    H    LYS  57           H        LYS  57  -2.610 -22.438   1.169
  149    HA   LYS  57           HA       LYS  57  -4.155 -23.284   3.293
  150   1HB   LYS  57          2HB       LYS  57  -3.975 -20.421   3.194
  151   2HB   LYS  57          3HB       LYS  57  -5.608 -20.891   2.769
  152   1HG   LYS  57          2HG       LYS  57  -5.653 -22.393   4.816
  153   2HG   LYS  57          3HG       LYS  57  -4.076 -21.769   5.261
  154   1HD   LYS  57          2HD       LYS  57  -6.038 -19.633   4.651
  155   2HD   LYS  57          3HD       LYS  57  -6.528 -20.653   5.990
  156   1HE   LYS  57          2HE       LYS  57  -3.755 -20.160   6.404
  157   2HE   LYS  57          3HE       LYS  57  -4.427 -18.621   5.899
  158   1HZ   LYS  57          1HZ       LYS  57  -6.007 -20.063   7.810
  159   2HZ   LYS  57          2HZ       LYS  57  -4.561 -19.551   8.369
  160   3HZ   LYS  57          3HZ       LYS  57  -5.628 -18.476   7.756
  161    H    LYS  58           H        LYS  58  -6.690 -23.034   2.524
  162    HA   LYS  58           HA       LYS  58  -6.996 -22.937  -0.302
  163   1HB   LYS  58          2HB       LYS  58  -5.920 -25.080  -0.279
  164   2HB   LYS  58          3HB       LYS  58  -6.908 -25.642   1.055
  165   1HG   LYS  58          2HG       LYS  58  -8.417 -24.668  -1.339
  166   2HG   LYS  58          3HG       LYS  58  -7.483 -26.130  -1.584
  167   1HD   LYS  58          2HD       LYS  58  -8.913 -27.384  -0.326
  168   2HD   LYS  58          3HD       LYS  58  -8.942 -26.204   0.970
  169   1HE   LYS  58          2HE       LYS  58 -10.362 -25.150  -1.353
  170   2HE   LYS  58          3HE       LYS  58 -10.995 -26.732  -0.939
  171   1HZ   LYS  58          1HZ       LYS  58 -11.865 -25.935   0.920
  172   2HZ   LYS  58          2HZ       LYS  58 -10.536 -25.081   1.334
  173   3HZ   LYS  58          3HZ       LYS  58 -11.627 -24.443   0.298
  Start of MODEL   16
    1    H    ARG  43           H        ARG  43  -0.560   0.802  -0.597
    2    HA   ARG  43           HA       ARG  43  -2.160  -0.760  -2.191
    3   1HB   ARG  43          2HB       ARG  43   0.395   0.812  -2.641
    4   2HB   ARG  43          3HB       ARG  43  -0.238  -0.169  -3.950
    5   1HG   ARG  43          2HG       ARG  43  -2.482   1.012  -3.642
    6   2HG   ARG  43          3HG       ARG  43  -1.702   2.080  -2.492
    7   1HD   ARG  43          2HD       ARG  43   0.051   2.222  -4.637
    8   2HD   ARG  43          3HD       ARG  43  -1.481   2.012  -5.461
    9    HE   ARG  43           HE       ARG  43  -0.624   4.365  -3.976
   10   1HH1  ARG  43          2HH2      ARG  43  -3.451   2.523  -4.975
   11   2HH1  ARG  43          1HH2      ARG  43  -4.525   3.879  -4.881
   12   1HH2  ARG  43          2HH1      ARG  43  -2.041   6.153  -3.851
   13   2HH2  ARG  43          1HH1      ARG  43  -3.718   5.957  -4.238
   14    H    GLN  44           H        GLN  44   1.379  -1.090  -1.392
   15    HA   GLN  44           HA       GLN  44   1.340  -3.719  -2.574
   16   1HB   GLN  44          2HB       GLN  44   3.754  -3.649  -2.385
   17   2HB   GLN  44          3HB       GLN  44   3.220  -2.104  -3.014
   18   1HG   GLN  44          2HG       GLN  44   3.231  -1.262  -0.564
   19   2HG   GLN  44          3HG       GLN  44   4.079  -2.742  -0.160
   20   1HE2  GLN  44          1HE2      GLN  44   5.962  -3.259  -1.675
   21   2HE2  GLN  44          2HE2      GLN  44   7.050  -1.961  -2.039
   22    H    ILE  45           H        ILE  45  -0.028  -2.842   0.079
   23    HA   ILE  45           HA       ILE  45   1.309  -4.828   1.783
   24    HB   ILE  45           HB       ILE  45   0.836  -2.164   2.309
   25   1HG1  ILE  45          2HG1      ILE  45   1.562  -2.705   4.568
   26   2HG1  ILE  45          3HG1      ILE  45   1.162  -4.396   4.335
   27   1HG2  ILE  45          1HG2      ILE  45  -0.887  -1.992   3.947
   28   2HG2  ILE  45          2HG2      ILE  45  -1.605  -2.720   2.489
   29   3HG2  ILE  45          3HG2      ILE  45  -1.205  -3.742   3.891
   30   1HD1  ILE  45          1HD1      ILE  45   3.605  -3.047   3.663
   31   2HD1  ILE  45          2HD1      ILE  45   3.203  -4.766   3.437
   32   3HD1  ILE  45          3HD1      ILE  45   2.853  -3.593   2.145
   33    H    LYS  46           H        LYS  46  -1.114  -4.539  -0.398
   34    HA   LYS  46           HA       LYS  46  -2.863  -6.298   1.175
   35   1HB   LYS  46          2HB       LYS  46  -4.784  -5.371   0.042
   36   2HB   LYS  46          3HB       LYS  46  -3.895  -4.086   0.836
   37   1HG   LYS  46          2HG       LYS  46  -2.889  -3.369  -1.264
   38   2HG   LYS  46          3HG       LYS  46  -3.476  -4.791  -2.103
   39   1HD   LYS  46          2HD       LYS  46  -5.817  -4.056  -1.806
   40   2HD   LYS  46          3HD       LYS  46  -5.298  -2.691  -0.836
   41   1HE   LYS  46          2HE       LYS  46  -5.401  -1.574  -2.847
   42   2HE   LYS  46          3HE       LYS  46  -3.787  -2.225  -3.055
   43   1HZ   LYS  46          1HZ       LYS  46  -5.946  -2.706  -4.637
   44   2HZ   LYS  46          2HZ       LYS  46  -4.507  -3.476  -4.701
   45   3HZ   LYS  46          3HZ       LYS  46  -5.733  -4.107  -3.825
   46    H    ILE  47           H        ILE  47  -0.551  -6.163  -1.188
   47    HA   ILE  47           HA       ILE  47  -1.891  -8.236  -2.780
   48    HB   ILE  47           HB       ILE  47   0.067  -7.589  -4.393
   49   1HG1  ILE  47          2HG1      ILE  47   0.559  -5.155  -4.311
   50   2HG1  ILE  47          3HG1      ILE  47  -0.246  -5.055  -2.757
   51   1HG2  ILE  47          1HG2      ILE  47  -2.536  -7.291  -4.524
   52   2HG2  ILE  47          2HG2      ILE  47  -2.146  -5.572  -4.273
   53   3HG2  ILE  47          3HG2      ILE  47  -1.466  -6.443  -5.668
   54   1HD1  ILE  47          1HD1      ILE  47   1.750  -7.231  -2.861
   55   2HD1  ILE  47          2HD1      ILE  47   2.450  -5.618  -3.140
   56   3HD1  ILE  47          3HD1      ILE  47   1.534  -5.945  -1.648
   57    H    TRP  48           H        TRP  48   0.755  -7.388  -0.628
   58    HA   TRP  48           HA       TRP  48   2.239  -9.783  -1.287
   59   1HB   TRP  48          2HB       TRP  48   2.947  -7.302  -0.349
   60   2HB   TRP  48          3HB       TRP  48   2.994  -8.269   1.111
   61    HD1  TRP  48           HD1      TRP  48   5.080  -7.470  -1.874
   62    HE1  TRP  48           HE1      TRP  48   7.252  -8.961  -2.049
   63    HE3  TRP  48           HE3      TRP  48   3.657 -10.881   1.620
   64    HZ2  TRP  48           HZ2      TRP  48   8.110 -11.345  -0.737
   65    HZ3  TRP  48           HZ3      TRP  48   5.221 -12.759   2.113
   66    HH2  TRP  48           HH2      TRP  48   7.380 -13.022   0.999
   67    H    PHE  49           H        PHE  49  -0.102  -8.501   1.078
   68    HA   PHE  49           HA       PHE  49   0.269 -10.454   3.046
   69   1HB   PHE  49          2HB       PHE  49  -1.414  -9.160   3.998
   70   2HB   PHE  49          3HB       PHE  49  -1.237  -8.136   2.587
   71    HD1  PHE  49           HD1      PHE  49  -2.702  -8.685   0.544
   72    HD2  PHE  49           HD2      PHE  49  -3.440 -10.242   4.422
   73    HE1  PHE  49           HE1      PHE  49  -5.080  -9.166  -0.102
   74    HE2  PHE  49           HE2      PHE  49  -5.818 -10.724   3.776
   75    HZ   PHE  49           HZ       PHE  49  -6.609 -10.180   1.522
   76    H    GLN  50           H        GLN  50  -1.764 -10.315   0.081
   77    HA   GLN  50           HA       GLN  50  -3.260 -12.583   0.705
   78   1HB   GLN  50          2HB       GLN  50  -4.189 -11.195  -0.955
   79   2HB   GLN  50          3HB       GLN  50  -2.671 -11.024  -1.815
   80   1HG   GLN  50          2HG       GLN  50  -3.935 -13.767  -1.596
   81   2HG   GLN  50          3HG       GLN  50  -4.580 -12.622  -2.757
   82   1HE2  GLN  50          1HE2      GLN  50  -3.080 -11.621  -4.272
   83   2HE2  GLN  50          2HE2      GLN  50  -1.732 -12.528  -4.874
   84    H    ASN  51           H        ASN  51  -0.095 -12.066  -0.878
   85    HA   ASN  51           HA       ASN  51   0.175 -14.529  -2.051
   86   1HB   ASN  51          2HB       ASN  51   2.063 -12.427  -0.991
   87   2HB   ASN  51          3HB       ASN  51   2.755 -13.993  -1.365
   88   1HD2  ASN  51          1HD2      ASN  51   2.575 -14.845  -3.477
   89   2HD2  ASN  51          2HD2      ASN  51   2.365 -13.822  -4.859
   90    H    ARG  52           H        ARG  52   1.144 -13.324   1.244
   91    HA   ARG  52           HA       ARG  52   2.169 -15.800   2.045
   92   1HB   ARG  52          2HB       ARG  52   2.780 -13.574   3.065
   93   2HB   ARG  52          3HB       ARG  52   1.173 -13.465   3.756
   94   1HG   ARG  52          2HG       ARG  52   1.904 -14.637   5.552
   95   2HG   ARG  52          3HG       ARG  52   2.133 -16.031   4.516
   96   1HD   ARG  52          2HD       ARG  52   4.413 -15.775   4.459
   97   2HD   ARG  52          3HD       ARG  52   4.313 -14.036   4.266
   98    HE   ARG  52           HE       ARG  52   4.690 -13.849   6.553
   99   1HH1  ARG  52          2HH2      ARG  52   3.144 -16.950   5.942
  100   2HH1  ARG  52          1HH2      ARG  52   3.190 -17.444   7.601
  101   1HH2  ARG  52          2HH1      ARG  52   4.751 -14.500   8.743
  102   2HH2  ARG  52          1HH1      ARG  52   4.110 -16.041   9.205
  103    H    ARG  53           H        ARG  53  -1.045 -14.453   1.794
  104    HA   ARG  53           HA       ARG  53  -2.152 -16.087   3.836
  105   1HB   ARG  53          2HB       ARG  53  -2.967 -13.779   2.559
  106   2HB   ARG  53          3HB       ARG  53  -3.947 -14.964   1.720
  107   1HG   ARG  53          2HG       ARG  53  -4.261 -15.796   4.334
  108   2HG   ARG  53          3HG       ARG  53  -4.075 -14.069   4.562
  109   1HD   ARG  53          2HD       ARG  53  -5.825 -13.964   2.514
  110   2HD   ARG  53          3HD       ARG  53  -6.242 -15.567   3.090
  111    HE   ARG  53           HE       ARG  53  -6.187 -14.025   5.407
  112   1HH1  ARG  53          2HH2      ARG  53  -7.888 -13.818   2.333
  113   2HH1  ARG  53          1HH2      ARG  53  -9.270 -13.017   3.006
  114   1HH2  ARG  53          2HH1      ARG  53  -8.008 -12.968   6.295
  115   2HH2  ARG  53          1HH1      ARG  53  -9.338 -12.531   5.275
  116    H    MET  54           H        MET  54  -0.780 -17.884   2.372
  117    HA   MET  54           HA       MET  54  -0.841 -19.638   1.074
  118   1HB   MET  54          2HB       MET  54  -3.186 -19.611   2.726
  119   2HB   MET  54          3HB       MET  54  -3.721 -20.201   1.165
  120   1HG   MET  54          2HG       MET  54  -1.164 -21.432   1.925
  121   2HG   MET  54          3HG       MET  54  -2.373 -21.685   3.169
  122   1HE   MET  54          1HE       MET  54  -2.508 -24.837   2.034
  123   2HE   MET  54          2HE       MET  54  -1.599 -24.531   0.534
  124   3HE   MET  54          3HE       MET  54  -1.097 -23.752   2.053
  125    H    LYS  55           H        LYS  55  -1.261 -17.079  -0.309
  126    HA   LYS  55           HA       LYS  55  -1.832 -16.274  -2.284
  127   1HB   LYS  55          2HB       LYS  55  -1.460 -19.182  -2.784
  128   2HB   LYS  55          3HB       LYS  55  -2.264 -18.275  -4.050
  129   1HG   LYS  55          2HG       LYS  55  -0.213 -17.592  -4.738
  130   2HG   LYS  55          3HG       LYS  55  -0.139 -16.595  -3.299
  131   1HD   LYS  55          2HD       LYS  55   1.628 -17.837  -2.608
  132   2HD   LYS  55          3HD       LYS  55   0.531 -19.185  -2.384
  133   1HE   LYS  55          2HE       LYS  55   1.101 -20.182  -4.424
  134   2HE   LYS  55          3HE       LYS  55   1.516 -18.657  -5.182
  135   1HZ   LYS  55          1HZ       LYS  55   3.580 -19.315  -4.755
  136   2HZ   LYS  55          2HZ       LYS  55   3.314 -18.811  -3.225
  137   3HZ   LYS  55          3HZ       LYS  55   3.148 -20.390  -3.605
  138    H    TRP  56           H        TRP  56  -3.912 -16.715  -0.242
  139    HA   TRP  56           HA       TRP  56  -6.106 -16.532  -0.029
  140   1HB   TRP  56          2HB       TRP  56  -5.623 -14.816  -1.885
  141   2HB   TRP  56          3HB       TRP  56  -6.340 -15.983  -2.978
  142    HD1  TRP  56           HD1      TRP  56  -7.398 -14.114   0.292
  143    HE1  TRP  56           HE1      TRP  56  -9.983 -13.584   0.256
  144    HE3  TRP  56           HE3      TRP  56  -8.352 -16.474  -4.110
  145    HZ2  TRP  56           HZ2      TRP  56 -12.089 -14.197  -1.570
  146    HZ3  TRP  56           HZ3      TRP  56 -10.700 -16.461  -4.948
  147    HH2  TRP  56           HH2      TRP  56 -12.534 -15.374  -3.755
  148    H    LYS  57           H        LYS  57  -4.824 -19.125  -0.581
  149    HA   LYS  57           HA       LYS  57  -5.457 -21.225  -0.849
  150   1HB   LYS  57          2HB       LYS  57  -8.254 -20.163  -1.343
  151   2HB   LYS  57          3HB       LYS  57  -7.825 -21.823  -0.985
  152   1HG   LYS  57          2HG       LYS  57  -6.672 -19.988   0.996
  153   2HG   LYS  57          3HG       LYS  57  -8.409 -19.781   0.885
  154   1HD   LYS  57          2HD       LYS  57  -8.859 -21.885   1.722
  155   2HD   LYS  57          3HD       LYS  57  -7.490 -22.620   0.913
  156   1HE   LYS  57          2HE       LYS  57  -5.953 -21.925   2.607
  157   2HE   LYS  57          3HE       LYS  57  -7.046 -20.703   3.228
  158   1HZ   LYS  57          1HZ       LYS  57  -8.539 -22.634   3.784
  159   2HZ   LYS  57          2HZ       LYS  57  -7.254 -23.606   3.520
  160   3HZ   LYS  57          3HZ       LYS  57  -7.193 -22.471   4.692
  161    H    LYS  58           H        LYS  58  -7.699 -19.671  -3.238
  162    HA   LYS  58           HA       LYS  58  -6.036 -20.868  -5.340
  163   1HB   LYS  58          2HB       LYS  58  -8.672 -21.625  -4.609
  164   2HB   LYS  58          3HB       LYS  58  -8.804 -20.752  -6.122
  165   1HG   LYS  58          2HG       LYS  58  -6.576 -22.314  -6.614
  166   2HG   LYS  58          3HG       LYS  58  -7.490 -23.366  -5.553
  167   1HD   LYS  58          2HD       LYS  58  -8.887 -21.990  -7.867
  168   2HD   LYS  58          3HD       LYS  58  -7.930 -23.428  -8.163
  169   1HE   LYS  58          2HE       LYS  58  -9.665 -23.813  -5.833
  170   2HE   LYS  58          3HE       LYS  58 -10.608 -23.322  -7.227
  171   1HZ   LYS  58          1HZ       LYS  58 -10.189 -25.238  -8.240
  172   2HZ   LYS  58          2HZ       LYS  58  -8.615 -25.283  -7.808
  173   3HZ   LYS  58          3HZ       LYS  58  -9.763 -25.804  -6.769
  Start of MODEL   17
    1    H    ARG  43           H        ARG  43  -0.012  -0.499   0.061
    2    HA   ARG  43           HA       ARG  43   2.264   0.930  -0.831
    3   1HB   ARG  43          2HB       ARG  43   1.573   0.799   2.086
    4   2HB   ARG  43          3HB       ARG  43   3.240   0.435   1.689
    5   1HG   ARG  43          2HG       ARG  43   1.894   2.892   0.518
    6   2HG   ARG  43          3HG       ARG  43   2.547   2.935   2.145
    7   1HD   ARG  43          2HD       ARG  43   4.651   1.783   0.759
    8   2HD   ARG  43          3HD       ARG  43   3.980   2.838  -0.468
    9    HE   ARG  43           HE       ARG  43   4.066   4.515   1.693
   10   1HH1  ARG  43          2HH2      ARG  43   6.472   2.351   0.311
   11   2HH1  ARG  43          1HH2      ARG  43   7.818   3.315   0.819
   12   1HH2  ARG  43          2HH1      ARG  43   5.841   5.788   2.364
   13   2HH2  ARG  43          1HH1      ARG  43   7.457   5.284   1.994
   14    H    GLN  44           H        GLN  44   1.590  -1.327  -1.959
   15    HA   GLN  44           HA       GLN  44   1.851  -3.499  -2.194
   16   1HB   GLN  44          2HB       GLN  44   4.334  -4.194  -1.875
   17   2HB   GLN  44          3HB       GLN  44   3.984  -2.896  -2.999
   18   1HG   GLN  44          2HG       GLN  44   4.519  -1.209  -1.247
   19   2HG   GLN  44          3HG       GLN  44   4.818  -2.489  -0.087
   20   1HE2  GLN  44          1HE2      GLN  44   6.258  -4.323  -1.257
   21   2HE2  GLN  44          2HE2      GLN  44   7.761  -3.732  -1.881
   22    H    ILE  45           H        ILE  45   0.806  -2.736   0.476
   23    HA   ILE  45           HA       ILE  45   1.890  -4.981   2.034
   24    HB   ILE  45           HB       ILE  45   1.743  -2.305   2.721
   25   1HG1  ILE  45          2HG1      ILE  45   2.302  -3.174   5.019
   26   2HG1  ILE  45          3HG1      ILE  45   1.991  -4.794   4.429
   27   1HG2  ILE  45          1HG2      ILE  45   0.089  -2.025   4.391
   28   2HG2  ILE  45          2HG2      ILE  45  -0.750  -2.653   2.952
   29   3HG2  ILE  45          3HG2      ILE  45  -0.388  -3.738   4.315
   30   1HD1  ILE  45          1HD1      ILE  45   4.401  -4.274   4.290
   31   2HD1  ILE  45          2HD1      ILE  45   3.723  -4.492   2.659
   32   3HD1  ILE  45          3HD1      ILE  45   4.048  -2.855   3.276
   33    H    LYS  46           H        LYS  46  -0.509  -4.222  -0.074
   34    HA   LYS  46           HA       LYS  46  -2.448  -5.854   1.414
   35   1HB   LYS  46          2HB       LYS  46  -4.249  -4.601   0.461
   36   2HB   LYS  46          3HB       LYS  46  -3.146  -3.472   1.220
   37   1HG   LYS  46          2HG       LYS  46  -2.256  -2.739  -0.877
   38   2HG   LYS  46          3HG       LYS  46  -2.876  -4.137  -1.733
   39   1HD   LYS  46          2HD       LYS  46  -4.993  -2.553  -0.386
   40   2HD   LYS  46          3HD       LYS  46  -4.115  -1.643  -1.600
   41   1HE   LYS  46          2HE       LYS  46  -5.186  -2.738  -3.276
   42   2HE   LYS  46          3HE       LYS  46  -4.671  -4.292  -2.651
   43   1HZ   LYS  46          1HZ       LYS  46  -6.540  -3.878  -0.959
   44   2HZ   LYS  46          2HZ       LYS  46  -7.112  -2.822  -2.065
   45   3HZ   LYS  46          3HZ       LYS  46  -6.925  -4.395  -2.459
   46    H    ILE  47           H        ILE  47  -0.173  -5.846  -0.990
   47    HA   ILE  47           HA       ILE  47  -1.796  -7.609  -2.689
   48    HB   ILE  47           HB       ILE  47   0.207  -7.104  -4.299
   49   1HG1  ILE  47          2HG1      ILE  47   1.011  -4.766  -4.058
   50   2HG1  ILE  47          3HG1      ILE  47   0.249  -4.676  -2.483
   51   1HG2  ILE  47          1HG2      ILE  47  -1.354  -4.723  -4.451
   52   2HG2  ILE  47          2HG2      ILE  47  -1.478  -6.208  -5.424
   53   3HG2  ILE  47          3HG2      ILE  47  -2.411  -6.053  -3.916
   54   1HD1  ILE  47          1HD1      ILE  47   2.844  -5.551  -2.968
   55   2HD1  ILE  47          2HD1      ILE  47   1.915  -5.865  -1.483
   56   3HD1  ILE  47          3HD1      ILE  47   1.944  -7.077  -2.786
   57    H    TRP  48           H        TRP  48   0.972  -7.266  -0.548
   58    HA   TRP  48           HA       TRP  48   2.117  -9.781  -1.406
   59   1HB   TRP  48          2HB       TRP  48   3.161  -7.483  -0.323
   60   2HB   TRP  48          3HB       TRP  48   3.108  -8.550   1.067
   61    HD1  TRP  48           HD1      TRP  48   5.225  -7.822  -1.913
   62    HE1  TRP  48           HE1      TRP  48   7.179  -9.564  -2.247
   63    HE3  TRP  48           HE3      TRP  48   3.433 -11.254   1.382
   64    HZ2  TRP  48           HZ2      TRP  48   7.742 -12.125  -1.121
   65    HZ3  TRP  48           HZ3      TRP  48   4.745 -13.348   1.707
   66    HH2  TRP  48           HH2      TRP  48   6.832 -13.810   0.520
   67    H    PHE  49           H        PHE  49   0.000  -8.375   1.093
   68    HA   PHE  49           HA       PHE  49   0.147 -10.497   2.915
   69   1HB   PHE  49          2HB       PHE  49  -1.320  -9.057   4.002
   70   2HB   PHE  49          3HB       PHE  49  -1.046  -7.970   2.654
   71    HD1  PHE  49           HD1      PHE  49  -2.623  -8.174   0.635
   72    HD2  PHE  49           HD2      PHE  49  -3.459  -9.901   4.420
   73    HE1  PHE  49           HE1      PHE  49  -5.058  -8.296   0.041
   74    HE2  PHE  49           HE2      PHE  49  -5.895 -10.023   3.826
   75    HZ   PHE  49           HZ       PHE  49  -6.665  -9.219   1.644
   76    H    GLN  50           H        GLN  50  -1.906  -9.871   0.027
   77    HA   GLN  50           HA       GLN  50  -3.666 -11.979   0.541
   78   1HB   GLN  50          2HB       GLN  50  -4.463 -10.329  -0.947
   79   2HB   GLN  50          3HB       GLN  50  -2.979 -10.301  -1.877
   80   1HG   GLN  50          2HG       GLN  50  -4.297 -12.957  -1.864
   81   2HG   GLN  50          3HG       GLN  50  -5.294 -11.697  -2.563
   82   1HE2  GLN  50          1HE2      GLN  50  -2.526 -13.691  -2.894
   83   2HE2  GLN  50          2HE2      GLN  50  -2.004 -13.182  -4.465
   84    H    ASN  51           H        ASN  51  -0.489 -11.725  -1.049
   85    HA   ASN  51           HA       ASN  51  -0.570 -14.071  -2.481
   86   1HB   ASN  51          2HB       ASN  51   1.569 -12.300  -1.325
   87   2HB   ASN  51          3HB       ASN  51   2.079 -13.916  -1.775
   88   1HD2  ASN  51          1HD2      ASN  51   1.056 -10.815  -2.842
   89   2HD2  ASN  51          2HD2      ASN  51   1.223 -11.045  -4.550
   90    H    ARG  52           H        ARG  52   0.554 -13.321   0.893
   91    HA   ARG  52           HA       ARG  52   1.275 -15.983   1.418
   92   1HB   ARG  52          2HB       ARG  52   2.015 -13.728   2.585
   93   2HB   ARG  52          3HB       ARG  52   0.578 -13.945   3.564
   94   1HG   ARG  52          2HG       ARG  52   1.991 -15.167   4.900
   95   2HG   ARG  52          3HG       ARG  52   1.619 -16.456   3.773
   96   1HD   ARG  52          2HD       ARG  52   3.953 -16.528   3.716
   97   2HD   ARG  52          3HD       ARG  52   3.651 -15.435   2.381
   98    HE   ARG  52           HE       ARG  52   4.466 -13.626   3.671
   99   1HH1  ARG  52          2HH2      ARG  52   4.144 -16.512   5.658
  100   2HH1  ARG  52          1HH2      ARG  52   5.035 -15.851   6.988
  101   1HH2  ARG  52          2HH1      ARG  52   5.642 -12.753   5.425
  102   2HH2  ARG  52          1HH1      ARG  52   5.892 -13.698   6.855
  103    H    ARG  53           H        ARG  53  -1.719 -14.171   1.439
  104    HA   ARG  53           HA       ARG  53  -2.998 -15.816   3.359
  105   1HB   ARG  53          2HB       ARG  53  -3.548 -13.357   1.992
  106   2HB   ARG  53          3HB       ARG  53  -4.861 -14.443   1.582
  107   1HG   ARG  53          2HG       ARG  53  -3.932 -13.672   4.385
  108   2HG   ARG  53          3HG       ARG  53  -5.452 -13.241   3.627
  109   1HD   ARG  53          2HD       ARG  53  -5.306 -16.084   3.466
  110   2HD   ARG  53          3HD       ARG  53  -4.756 -15.678   5.080
  111    HE   ARG  53           HE       ARG  53  -6.916 -14.935   5.618
  112   1HH1  ARG  53          2HH2      ARG  53  -6.630 -15.276   2.128
  113   2HH1  ARG  53          1HH2      ARG  53  -8.321 -15.030   1.837
  114   1HH2  ARG  53          2HH1      ARG  53  -9.145 -14.610   5.235
  115   2HH2  ARG  53          1HH1      ARG  53  -9.760 -14.647   3.617
  116    H    MET  54           H        MET  54  -2.149 -16.093   0.023
  117    HA   MET  54           HA       MET  54  -4.153 -18.194  -0.288
  118   1HB   MET  54          2HB       MET  54  -3.149 -16.027  -2.127
  119   2HB   MET  54          3HB       MET  54  -3.440 -17.586  -2.873
  120   1HG   MET  54          2HG       MET  54  -5.771 -17.595  -2.006
  121   2HG   MET  54          3HG       MET  54  -5.490 -16.075  -1.180
  122   1HE   MET  54          1HE       MET  54  -7.725 -15.663  -2.425
  123   2HE   MET  54          2HE       MET  54  -7.833 -15.068  -4.099
  124   3HE   MET  54          3HE       MET  54  -7.754 -16.817  -3.778
  125    H    LYS  55           H        LYS  55  -1.578 -18.547   0.986
  126    HA   LYS  55           HA       LYS  55  -0.260 -20.194  -1.061
  127   1HB   LYS  55          2HB       LYS  55   0.822 -18.009   0.363
  128   2HB   LYS  55          3HB       LYS  55   1.511 -19.440   1.100
  129   1HG   LYS  55          2HG       LYS  55   1.683 -20.099  -1.579
  130   2HG   LYS  55          3HG       LYS  55   1.886 -18.359  -1.652
  131   1HD   LYS  55          2HD       LYS  55   3.714 -18.502   0.053
  132   2HD   LYS  55          3HD       LYS  55   3.511 -20.240   0.126
  133   1HE   LYS  55          2HE       LYS  55   3.883 -20.123  -2.502
  134   2HE   LYS  55          3HE       LYS  55   4.590 -18.559  -2.153
  135   1HZ   LYS  55          1HZ       LYS  55   5.415 -21.092  -0.913
  136   2HZ   LYS  55          2HZ       LYS  55   6.221 -20.312  -2.099
  137   3HZ   LYS  55          3HZ       LYS  55   6.085 -19.633  -0.620
  138    H    TRP  56           H        TRP  56  -1.047 -19.740   2.438
  139    HA   TRP  56           HA       TRP  56  -0.155 -22.088   3.453
  140   1HB   TRP  56          2HB       TRP  56  -2.313 -20.191   4.093
  141   2HB   TRP  56          3HB       TRP  56  -2.550 -21.803   4.738
  142    HD1  TRP  56           HD1      TRP  56   0.868 -19.933   4.504
  143    HE1  TRP  56           HE1      TRP  56   1.960 -19.695   6.896
  144    HE3  TRP  56           HE3      TRP  56  -3.039 -21.942   7.065
  145    HZ2  TRP  56           HZ2      TRP  56   1.086 -20.360   9.529
  146    HZ3  TRP  56           HZ3      TRP  56  -2.838 -22.111   9.544
  147    HH2  TRP  56           HH2      TRP  56  -0.865 -21.360  10.776
  148    H    LYS  57           H        LYS  57  -3.369 -21.469   1.863
  149    HA   LYS  57           HA       LYS  57  -4.768 -22.809   0.807
  150   1HB   LYS  57          2HB       LYS  57  -2.146 -23.879   0.165
  151   2HB   LYS  57          3HB       LYS  57  -3.350 -25.151   0.178
  152   1HG   LYS  57          2HG       LYS  57  -4.777 -23.897  -1.383
  153   2HG   LYS  57          3HG       LYS  57  -3.721 -22.501  -1.294
  154   1HD   LYS  57          2HD       LYS  57  -3.003 -23.523  -3.287
  155   2HD   LYS  57          3HD       LYS  57  -1.841 -24.138  -2.128
  156   1HE   LYS  57          2HE       LYS  57  -4.197 -25.860  -2.161
  157   2HE   LYS  57          3HE       LYS  57  -3.595 -25.652  -3.794
  158   1HZ   LYS  57          1HZ       LYS  57  -1.337 -26.058  -2.539
  159   2HZ   LYS  57          2HZ       LYS  57  -2.313 -26.889  -1.527
  160   3HZ   LYS  57          3HZ       LYS  57  -2.246 -27.289  -3.110
  161    H    LYS  58           H        LYS  58  -6.435 -23.734   1.857
  162    HA   LYS  58           HA       LYS  58  -5.815 -25.972   3.635
  163   1HB   LYS  58          2HB       LYS  58  -6.110 -23.638   4.803
  164   2HB   LYS  58          3HB       LYS  58  -7.815 -23.899   4.496
  165   1HG   LYS  58          2HG       LYS  58  -7.453 -24.845   6.653
  166   2HG   LYS  58          3HG       LYS  58  -7.514 -26.229   5.579
  167   1HD   LYS  58          2HD       LYS  58  -5.440 -26.845   6.245
  168   2HD   LYS  58          3HD       LYS  58  -4.787 -25.347   5.611
  169   1HE   LYS  58          2HE       LYS  58  -4.757 -24.310   7.687
  170   2HE   LYS  58          3HE       LYS  58  -6.196 -25.137   8.248
  171   1HZ   LYS  58          1HZ       LYS  58  -4.859 -27.151   8.432
  172   2HZ   LYS  58          2HZ       LYS  58  -3.521 -26.325   7.988
  173   3HZ   LYS  58          3HZ       LYS  58  -4.285 -25.954   9.383
  Start of MODEL   18
    1    H    ARG  43           H        ARG  43   2.275   1.311  -1.099
    2    HA   ARG  43           HA       ARG  43   0.851  -0.027  -0.167
    3   1HB   ARG  43          2HB       ARG  43  -0.552   0.652  -2.670
    4   2HB   ARG  43          3HB       ARG  43  -0.992  -0.948  -2.104
    5   1HG   ARG  43          2HG       ARG  43  -1.515   0.002   0.157
    6   2HG   ARG  43          3HG       ARG  43  -1.090   1.601  -0.421
    7   1HD   ARG  43          2HD       ARG  43  -2.968   0.476  -2.300
    8   2HD   ARG  43          3HD       ARG  43  -3.611   0.213  -0.691
    9    HE   ARG  43           HE       ARG  43  -3.813   2.550  -0.385
   10   1HH1  ARG  43          2HH2      ARG  43  -2.039   1.845  -3.341
   11   2HH1  ARG  43          1HH2      ARG  43  -2.118   3.472  -3.929
   12   1HH2  ARG  43          2HH1      ARG  43  -3.918   4.698  -1.159
   13   2HH2  ARG  43          1HH1      ARG  43  -3.194   5.106  -2.679
   14    H    GLN  44           H        GLN  44   2.437  -1.695   0.123
   15    HA   GLN  44           HA       GLN  44   2.151  -3.868  -1.799
   16   1HB   GLN  44          2HB       GLN  44   4.509  -4.387  -1.614
   17   2HB   GLN  44          3HB       GLN  44   4.367  -2.686  -2.012
   18   1HG   GLN  44          2HG       GLN  44   4.377  -2.420   0.669
   19   2HG   GLN  44          3HG       GLN  44   5.196  -3.967   0.590
   20   1HE2  GLN  44          1HE2      GLN  44   7.108  -4.162  -0.708
   21   2HE2  GLN  44          2HE2      GLN  44   8.155  -2.805  -0.957
   22    H    ILE  45           H        ILE  45   1.379  -2.830   1.220
   23    HA   ILE  45           HA       ILE  45   2.062  -5.325   2.566
   24    HB   ILE  45           HB       ILE  45   2.196  -2.761   3.410
   25   1HG1  ILE  45          2HG1      ILE  45   2.390  -3.700   5.685
   26   2HG1  ILE  45          3HG1      ILE  45   1.679  -5.203   5.133
   27   1HG2  ILE  45          1HG2      ILE  45  -0.448  -3.821   4.446
   28   2HG2  ILE  45          2HG2      ILE  45   0.396  -2.366   5.028
   29   3HG2  ILE  45          3HG2      ILE  45  -0.218  -2.430   3.359
   30   1HD1  ILE  45          1HD1      ILE  45   4.431  -4.320   4.927
   31   2HD1  ILE  45          2HD1      ILE  45   3.738  -5.908   4.518
   32   3HD1  ILE  45          3HD1      ILE  45   3.782  -4.614   3.296
   33    H    LYS  46           H        LYS  46  -0.256  -4.251   0.463
   34    HA   LYS  46           HA       LYS  46  -2.291  -5.919   1.767
   35   1HB   LYS  46          2HB       LYS  46  -4.022  -4.474   0.982
   36   2HB   LYS  46          3HB       LYS  46  -2.856  -3.489   1.842
   37   1HG   LYS  46          2HG       LYS  46  -2.756  -2.172  -0.004
   38   2HG   LYS  46          3HG       LYS  46  -1.883  -3.472  -0.791
   39   1HD   LYS  46          2HD       LYS  46  -3.890  -4.375  -1.773
   40   2HD   LYS  46          3HD       LYS  46  -4.926  -3.425  -0.726
   41   1HE   LYS  46          2HE       LYS  46  -4.638  -1.472  -1.961
   42   2HE   LYS  46          3HE       LYS  46  -3.010  -1.890  -2.457
   43   1HZ   LYS  46          1HZ       LYS  46  -3.862  -3.410  -4.021
   44   2HZ   LYS  46          2HZ       LYS  46  -5.388  -3.297  -3.447
   45   3HZ   LYS  46          3HZ       LYS  46  -4.710  -2.027  -4.220
   46    H    ILE  47           H        ILE  47   0.010  -5.836  -0.570
   47    HA   ILE  47           HA       ILE  47  -1.702  -7.238  -2.503
   48    HB   ILE  47           HB       ILE  47  -0.656  -6.231  -4.179
   49   1HG1  ILE  47          2HG1      ILE  47   1.392  -7.565  -3.789
   50   2HG1  ILE  47          3HG1      ILE  47   1.722  -5.968  -4.431
   51   1HG2  ILE  47          1HG2      ILE  47   0.242  -4.441  -1.908
   52   2HG2  ILE  47          2HG2      ILE  47   0.346  -4.007  -3.631
   53   3HG2  ILE  47          3HG2      ILE  47  -1.241  -4.306  -2.883
   54   1HD1  ILE  47          1HD1      ILE  47   3.031  -5.490  -2.650
   55   2HD1  ILE  47          2HD1      ILE  47   1.671  -5.794  -1.543
   56   3HD1  ILE  47          3HD1      ILE  47   2.741  -7.132  -2.028
   57    H    TRP  48           H        TRP  48   1.192  -7.315  -0.435
   58    HA   TRP  48           HA       TRP  48   2.030  -9.861  -1.495
   59   1HB   TRP  48          2HB       TRP  48   3.185  -7.751   0.045
   60   2HB   TRP  48          3HB       TRP  48   3.309  -9.236   0.968
   61    HD1  TRP  48           HD1      TRP  48   5.677  -7.556  -0.826
   62    HE1  TRP  48           HE1      TRP  48   7.310  -8.949  -2.362
   63    HE3  TRP  48           HE3      TRP  48   2.735 -11.694  -1.096
   64    HZ2  TRP  48           HZ2      TRP  48   7.189 -11.567  -3.491
   65    HZ3  TRP  48           HZ3      TRP  48   3.566 -13.625  -2.436
   66    HH2  TRP  48           HH2      TRP  48   5.711 -13.607  -3.609
   67    H    PHE  49           H        PHE  49  -0.002  -8.503   1.067
   68    HA   PHE  49           HA       PHE  49   0.002 -10.789   2.724
   69   1HB   PHE  49          2HB       PHE  49  -1.172  -9.244   3.989
   70   2HB   PHE  49          3HB       PHE  49  -0.981  -8.119   2.659
   71    HD1  PHE  49           HD1      PHE  49  -2.787  -7.946   0.932
   72    HD2  PHE  49           HD2      PHE  49  -3.286 -10.202   4.491
   73    HE1  PHE  49           HE1      PHE  49  -5.275  -7.916   0.601
   74    HE2  PHE  49           HE2      PHE  49  -5.774 -10.172   4.161
   75    HZ   PHE  49           HZ       PHE  49  -6.739  -9.029   2.220
   76    H    GLN  50           H        GLN  50  -2.031  -9.650  -0.018
   77    HA   GLN  50           HA       GLN  50  -3.869 -11.793   0.353
   78   1HB   GLN  50          2HB       GLN  50  -5.076 -10.843  -1.476
   79   2HB   GLN  50          3HB       GLN  50  -4.424  -9.480  -0.590
   80   1HG   GLN  50          2HG       GLN  50  -3.380  -8.768  -2.469
   81   2HG   GLN  50          3HG       GLN  50  -2.407 -10.226  -2.471
   82   1HE2  GLN  50          1HE2      GLN  50  -3.126 -12.076  -3.599
   83   2HE2  GLN  50          2HE2      GLN  50  -4.227 -11.964  -4.931
   84    H    ASN  51           H        ASN  51  -0.759 -11.419  -1.059
   85    HA   ASN  51           HA       ASN  51  -1.198 -13.336  -3.131
   86   1HB   ASN  51          2HB       ASN  51   1.055 -11.599  -2.177
   87   2HB   ASN  51          3HB       ASN  51   1.542 -13.101  -2.934
   88   1HD2  ASN  51          1HD2      ASN  51   1.437 -10.098  -3.640
   89   2HD2  ASN  51          2HD2      ASN  51   0.830 -10.055  -5.261
   90    H    ARG  52           H        ARG  52   0.002 -13.120   0.217
   91    HA   ARG  52           HA       ARG  52   1.069 -15.789   0.074
   92   1HB   ARG  52          2HB       ARG  52   2.145 -13.778   1.347
   93   2HB   ARG  52          3HB       ARG  52   0.899 -14.022   2.555
   94   1HG   ARG  52          2HG       ARG  52   2.138 -15.675   3.485
   95   2HG   ARG  52          3HG       ARG  52   1.985 -16.610   2.011
   96   1HD   ARG  52          2HD       ARG  52   4.346 -16.365   2.364
   97   2HD   ARG  52          3HD       ARG  52   3.956 -15.250   1.069
   98    HE   ARG  52           HE       ARG  52   3.665 -13.678   3.318
   99   1HH1  ARG  52          2HH2      ARG  52   6.254 -15.756   2.150
  100   2HH1  ARG  52          1HH2      ARG  52   7.511 -14.825   2.897
  101   1HH2  ARG  52          2HH1      ARG  52   5.323 -12.451   4.304
  102   2HH2  ARG  52          1HH1      ARG  52   6.977 -12.934   4.131
  103    H    ARG  53           H        ARG  53  -1.856 -14.106   0.875
  104    HA   ARG  53           HA       ARG  53  -2.806 -15.562   2.976
  105   1HB   ARG  53          2HB       ARG  53  -3.773 -13.521   1.441
  106   2HB   ARG  53          3HB       ARG  53  -4.748 -14.828   0.798
  107   1HG   ARG  53          2HG       ARG  53  -4.669 -15.020   3.704
  108   2HG   ARG  53          3HG       ARG  53  -5.143 -13.397   3.241
  109   1HD   ARG  53          2HD       ARG  53  -7.240 -14.234   2.933
  110   2HD   ARG  53          3HD       ARG  53  -6.623 -14.987   1.476
  111    HE   ARG  53           HE       ARG  53  -6.607 -17.071   2.566
  112   1HH1  ARG  53          2HH2      ARG  53  -7.039 -14.500   4.929
  113   2HH1  ARG  53          1HH2      ARG  53  -7.406 -15.585   6.230
  114   1HH2  ARG  53          2HH1      ARG  53  -7.091 -18.501   4.280
  115   2HH2  ARG  53          1HH1      ARG  53  -7.435 -17.875   5.858
  116    H    MET  54           H        MET  54  -2.235 -16.499  -0.343
  117    HA   MET  54           HA       MET  54  -4.092 -18.696  -0.188
  118   1HB   MET  54          2HB       MET  54  -3.057 -17.102  -2.259
  119   2HB   MET  54          3HB       MET  54  -2.160 -18.595  -2.453
  120   1HG   MET  54          2HG       MET  54  -4.832 -19.424  -1.986
  121   2HG   MET  54          3HG       MET  54  -4.979 -18.040  -3.052
  122   1HE   MET  54          1HE       MET  54  -5.533 -18.460  -4.931
  123   2HE   MET  54          2HE       MET  54  -4.420 -18.982  -6.219
  124   3HE   MET  54          3HE       MET  54  -5.615 -20.124  -5.559
  125    H    LYS  55           H        LYS  55  -0.819 -17.991   0.631
  126    HA   LYS  55           HA       LYS  55   0.320 -20.509   0.031
  127   1HB   LYS  55          2HB       LYS  55   1.300 -18.065   0.699
  128   2HB   LYS  55          3HB       LYS  55   1.456 -18.886   2.239
  129   1HG   LYS  55          2HG       LYS  55   3.365 -19.814   1.433
  130   2HG   LYS  55          3HG       LYS  55   2.353 -20.812   0.409
  131   1HD   LYS  55          2HD       LYS  55   3.165 -19.775  -1.433
  132   2HD   LYS  55          3HD       LYS  55   2.548 -18.239  -0.859
  133   1HE   LYS  55          2HE       LYS  55   4.683 -18.172   0.660
  134   2HE   LYS  55          3HE       LYS  55   5.295 -19.452  -0.370
  135   1HZ   LYS  55          1HZ       LYS  55   4.961 -18.014  -2.263
  136   2HZ   LYS  55          2HZ       LYS  55   4.378 -16.822  -1.310
  137   3HZ   LYS  55          3HZ       LYS  55   5.936 -17.292  -1.169
  138    H    TRP  56           H        TRP  56  -1.232 -19.053   2.946
  139    HA   TRP  56           HA       TRP  56  -0.713 -21.013   4.769
  140   1HB   TRP  56          2HB       TRP  56  -2.561 -18.839   4.460
  141   2HB   TRP  56          3HB       TRP  56  -3.402 -20.216   5.145
  142    HD1  TRP  56           HD1      TRP  56   0.119 -18.653   5.896
  143    HE1  TRP  56           HE1      TRP  56   0.466 -18.390   8.499
  144    HE3  TRP  56           HE3      TRP  56  -4.418 -20.526   7.220
  145    HZ2  TRP  56           HZ2      TRP  56  -1.161 -18.981  10.769
  146    HZ3  TRP  56           HZ3      TRP  56  -4.961 -20.649   9.650
  147    HH2  TRP  56           HH2      TRP  56  -3.418 -19.915  11.397
  148    H    LYS  57           H        LYS  57  -3.218 -20.887   2.169
  149    HA   LYS  57           HA       LYS  57  -4.423 -22.466   1.209
  150   1HB   LYS  57          2HB       LYS  57  -2.018 -23.905   2.093
  151   2HB   LYS  57          3HB       LYS  57  -3.414 -24.945   1.888
  152   1HG   LYS  57          2HG       LYS  57  -3.749 -24.164  -0.408
  153   2HG   LYS  57          3HG       LYS  57  -2.530 -22.920  -0.217
  154   1HD   LYS  57          2HD       LYS  57  -1.647 -25.730   0.348
  155   2HD   LYS  57          3HD       LYS  57  -2.016 -25.360  -1.325
  156   1HE   LYS  57          2HE       LYS  57  -0.339 -23.669  -1.458
  157   2HE   LYS  57          3HE       LYS  57  -0.245 -23.490   0.282
  158   1HZ   LYS  57          1HZ       LYS  57   1.491 -24.882  -1.029
  159   2HZ   LYS  57          2HZ       LYS  57   1.029 -25.332   0.471
  160   3HZ   LYS  57          3HZ       LYS  57   0.401 -26.084  -0.836
  161    H    LYS  58           H        LYS  58  -5.880 -24.484   1.716
  162    HA   LYS  58           HA       LYS  58  -6.945 -24.007   4.400
  163   1HB   LYS  58          2HB       LYS  58  -8.198 -25.008   1.836
  164   2HB   LYS  58          3HB       LYS  58  -9.000 -25.139   3.387
  165   1HG   LYS  58          2HG       LYS  58  -9.357 -22.856   3.563
  166   2HG   LYS  58          3HG       LYS  58  -7.858 -22.445   2.753
  167   1HD   LYS  58          2HD       LYS  58 -10.184 -23.702   1.242
  168   2HD   LYS  58          3HD       LYS  58 -10.089 -21.970   1.493
  169   1HE   LYS  58          2HE       LYS  58  -8.265 -21.714   0.067
  170   2HE   LYS  58          3HE       LYS  58  -7.609 -23.296   0.439
  171   1HZ   LYS  58          1HZ       LYS  58  -9.071 -24.302  -1.004
  172   2HZ   LYS  58          2HZ       LYS  58 -10.124 -23.055  -1.025
  173   3HZ   LYS  58          3HZ       LYS  58  -8.696 -22.930  -1.807
  Start of MODEL   19
    1    H    ARG  43           H        ARG  43  -1.833   0.279  -5.918
    2    HA   ARG  43           HA       ARG  43  -0.875   0.870  -3.487
    3   1HB   ARG  43          2HB       ARG  43  -3.094  -0.906  -4.487
    4   2HB   ARG  43          3HB       ARG  43  -2.702  -1.019  -2.782
    5   1HG   ARG  43          2HG       ARG  43  -3.207   1.285  -2.385
    6   2HG   ARG  43          3HG       ARG  43  -3.112   1.694  -4.087
    7   1HD   ARG  43          2HD       ARG  43  -5.171  -0.354  -3.286
    8   2HD   ARG  43          3HD       ARG  43  -5.477   1.309  -2.821
    9    HE   ARG  43           HE       ARG  43  -5.463   0.228  -5.552
   10   1HH1  ARG  43          2HH2      ARG  43  -5.240   3.135  -3.581
   11   2HH1  ARG  43          1HH2      ARG  43  -5.734   4.194  -4.861
   12   1HH2  ARG  43          2HH1      ARG  43  -6.114   1.624  -7.240
   13   2HH2  ARG  43          1HH1      ARG  43  -6.234   3.329  -6.956
   14    H    GLN  44           H        GLN  44  -0.417  -0.600  -1.552
   15    HA   GLN  44           HA       GLN  44   0.602  -3.192  -2.278
   16   1HB   GLN  44          2HB       GLN  44   2.398  -1.144  -2.347
   17   2HB   GLN  44          3HB       GLN  44   2.500  -1.551  -0.645
   18   1HG   GLN  44          2HG       GLN  44   3.492  -3.589  -1.047
   19   2HG   GLN  44          3HG       GLN  44   2.507  -3.910  -2.461
   20   1HE2  GLN  44          1HE2      GLN  44   4.723  -4.694  -3.098
   21   2HE2  GLN  44          2HE2      GLN  44   5.757  -3.592  -3.943
   22    H    ILE  45           H        ILE  45   2.162  -3.190   0.362
   23    HA   ILE  45           HA       ILE  45   1.664  -4.105   2.343
   24    HB   ILE  45           HB       ILE  45   1.802  -1.599   2.607
   25   1HG1  ILE  45          2HG1      ILE  45   0.796  -1.731   4.985
   26   2HG1  ILE  45          3HG1      ILE  45   0.406  -3.394   4.592
   27   1HG2  ILE  45          1HG2      ILE  45  -1.181  -1.933   2.507
   28   2HG2  ILE  45          2HG2      ILE  45  -0.452  -0.656   3.510
   29   3HG2  ILE  45          3HG2      ILE  45  -0.147  -0.695   1.757
   30   1HD1  ILE  45          1HD1      ILE  45   3.132  -2.091   4.810
   31   2HD1  ILE  45          2HD1      ILE  45   2.542  -3.589   5.569
   32   3HD1  ILE  45          3HD1      ILE  45   2.922  -3.563   3.830
   33    H    LYS  46           H        LYS  46  -0.113  -4.975   0.165
   34    HA   LYS  46           HA       LYS  46  -2.093  -6.187   1.797
   35   1HB   LYS  46          2HB       LYS  46  -4.013  -5.115   1.224
   36   2HB   LYS  46          3HB       LYS  46  -2.922  -3.748   1.137
   37   1HG   LYS  46          2HG       LYS  46  -2.653  -4.092  -1.315
   38   2HG   LYS  46          3HG       LYS  46  -3.697  -5.498  -1.245
   39   1HD   LYS  46          2HD       LYS  46  -4.701  -2.832  -0.206
   40   2HD   LYS  46          3HD       LYS  46  -4.703  -3.147  -1.929
   41   1HE   LYS  46          2HE       LYS  46  -6.466  -4.601  -1.784
   42   2HE   LYS  46          3HE       LYS  46  -5.804  -5.406  -0.376
   43   1HZ   LYS  46          1HZ       LYS  46  -7.889  -4.119  -0.031
   44   2HZ   LYS  46          2HZ       LYS  46  -6.685  -3.768   1.014
   45   3HZ   LYS  46          3HZ       LYS  46  -7.023  -2.746  -0.213
   46    H    ILE  47           H        ILE  47  -0.798  -5.348  -1.443
   47    HA   ILE  47           HA       ILE  47  -1.964  -7.507  -2.792
   48    HB   ILE  47           HB       ILE  47  -0.214  -7.052  -4.483
   49   1HG1  ILE  47          2HG1      ILE  47   1.188  -4.957  -4.051
   50   2HG1  ILE  47          3HG1      ILE  47   0.823  -5.175  -2.350
   51   1HG2  ILE  47          1HG2      ILE  47  -1.511  -5.425  -5.274
   52   2HG2  ILE  47          2HG2      ILE  47  -2.395  -5.515  -3.732
   53   3HG2  ILE  47          3HG2      ILE  47  -1.087  -4.325  -3.940
   54   1HD1  ILE  47          1HD1      ILE  47   1.652  -7.716  -3.518
   55   2HD1  ILE  47          2HD1      ILE  47   2.868  -6.455  -3.833
   56   3HD1  ILE  47          3HD1      ILE  47   2.372  -6.816  -2.162
   57    H    TRP  48           H        TRP  48   0.906  -7.176  -0.718
   58    HA   TRP  48           HA       TRP  48   1.936  -9.749  -1.485
   59   1HB   TRP  48          2HB       TRP  48   2.886  -7.429  -0.121
   60   2HB   TRP  48          3HB       TRP  48   3.069  -8.805   0.950
   61    HD1  TRP  48           HD1      TRP  48   5.222  -7.084  -1.237
   62    HE1  TRP  48           HE1      TRP  48   7.067  -8.528  -2.452
   63    HE3  TRP  48           HE3      TRP  48   2.980 -11.576  -0.438
   64    HZ2  TRP  48           HZ2      TRP  48   7.374 -11.325  -2.931
   65    HZ3  TRP  48           HZ3      TRP  48   4.117 -13.614  -1.311
   66    HH2  TRP  48           HH2      TRP  48   6.241 -13.539  -2.521
   67    H    PHE  49           H        PHE  49   0.091  -8.223   1.217
   68    HA   PHE  49           HA       PHE  49   0.075 -10.412   2.917
   69   1HB   PHE  49          2HB       PHE  49  -1.839  -8.098   2.297
   70   2HB   PHE  49          3HB       PHE  49  -2.178  -9.210   3.608
   71    HD1  PHE  49           HD1      PHE  49   0.223  -6.680   2.394
   72    HD2  PHE  49           HD2      PHE  49  -1.051  -9.029   5.691
   73    HE1  PHE  49           HE1      PHE  49   1.669  -5.315   3.927
   74    HE2  PHE  49           HE2      PHE  49   0.394  -7.664   7.223
   75    HZ   PHE  49           HZ       PHE  49   1.737  -5.824   6.323
   76    H    GLN  50           H        GLN  50  -1.831  -9.675  -0.002
   77    HA   GLN  50           HA       GLN  50  -3.610 -11.866   0.589
   78   1HB   GLN  50          2HB       GLN  50  -4.921 -11.089  -1.285
   79   2HB   GLN  50          3HB       GLN  50  -4.447  -9.678  -0.359
   80   1HG   GLN  50          2HG       GLN  50  -3.357  -8.799  -2.142
   81   2HG   GLN  50          3HG       GLN  50  -2.377 -10.244  -2.313
   82   1HE2  GLN  50          1HE2      GLN  50  -2.962 -11.865  -3.712
   83   2HE2  GLN  50          2HE2      GLN  50  -4.178 -11.691  -4.933
   84    H    ASN  51           H        ASN  51  -0.528 -11.793  -0.347
   85    HA   ASN  51           HA       ASN  51  -0.914 -13.663  -2.544
   86   1HB   ASN  51          2HB       ASN  51   1.357 -11.819  -1.729
   87   2HB   ASN  51          3HB       ASN  51   1.726 -13.243  -2.681
   88   1HD2  ASN  51          1HD2      ASN  51   2.097 -10.588  -3.514
   89   2HD2  ASN  51          2HD2      ASN  51   1.078 -10.262  -4.877
   90    H    ARG  52           H        ARG  52   0.580 -13.040   0.663
   91    HA   ARG  52           HA       ARG  52   1.948 -15.510   0.717
   92   1HB   ARG  52          2HB       ARG  52   2.684 -13.487   2.010
   93   2HB   ARG  52          3HB       ARG  52   1.234 -13.586   2.989
   94   1HG   ARG  52          2HG       ARG  52   2.935 -14.661   4.284
   95   2HG   ARG  52          3HG       ARG  52   1.962 -15.966   3.634
   96   1HD   ARG  52          2HD       ARG  52   3.800 -15.713   1.614
   97   2HD   ARG  52          3HD       ARG  52   4.777 -15.183   2.970
   98    HE   ARG  52           HE       ARG  52   3.517 -17.501   3.891
   99   1HH1  ARG  52          2HH2      ARG  52   5.610 -16.696   1.179
  100   2HH1  ARG  52          1HH2      ARG  52   6.312 -18.276   1.085
  101   1HH2  ARG  52          2HH1      ARG  52   4.443 -19.587   3.768
  102   2HH2  ARG  52          1HH1      ARG  52   5.644 -19.932   2.569
  103    H    ARG  53           H        ARG  53  -1.300 -14.394   1.395
  104    HA   ARG  53           HA       ARG  53  -1.884 -16.467   3.244
  105   1HB   ARG  53          2HB       ARG  53  -3.049 -14.214   3.200
  106   2HB   ARG  53          3HB       ARG  53  -3.790 -14.657   1.676
  107   1HG   ARG  53          2HG       ARG  53  -5.483 -15.544   2.909
  108   2HG   ARG  53          3HG       ARG  53  -4.386 -16.860   3.277
  109   1HD   ARG  53          2HD       ARG  53  -4.307 -16.245   5.463
  110   2HD   ARG  53          3HD       ARG  53  -3.763 -14.637   5.032
  111    HE   ARG  53           HE       ARG  53  -5.985 -13.843   5.176
  112   1HH1  ARG  53          2HH2      ARG  53  -5.923 -17.355   5.385
  113   2HH1  ARG  53          1HH2      ARG  53  -7.575 -17.480   5.891
  114   1HH2  ARG  53          2HH1      ARG  53  -8.164 -14.008   5.842
  115   2HH2  ARG  53          1HH1      ARG  53  -8.859 -15.564   6.152
  116    H    MET  54           H        MET  54  -1.710 -16.109  -0.216
  117    HA   MET  54           HA       MET  54  -3.708 -17.697  -1.125
  118   1HB   MET  54          2HB       MET  54  -1.379 -16.484  -2.135
  119   2HB   MET  54          3HB       MET  54  -1.077 -18.184  -2.431
  120   1HG   MET  54          2HG       MET  54  -2.342 -17.919  -4.314
  121   2HG   MET  54          3HG       MET  54  -3.728 -17.934  -3.242
  122   1HE   MET  54          1HE       MET  54  -3.697 -15.116  -1.664
  123   2HE   MET  54          2HE       MET  54  -4.804 -14.365  -2.838
  124   3HE   MET  54          3HE       MET  54  -4.981 -16.087  -2.422
  125    H    LYS  55           H        LYS  55  -0.933 -18.599   0.805
  126    HA   LYS  55           HA       LYS  55  -0.496 -21.196   0.025
  127   1HB   LYS  55          2HB       LYS  55   0.551 -19.581   1.888
  128   2HB   LYS  55          3HB       LYS  55  -0.462 -20.551   2.939
  129   1HG   LYS  55          2HG       LYS  55   0.839 -22.417   2.682
  130   2HG   LYS  55          3HG       LYS  55   1.009 -22.180   0.953
  131   1HD   LYS  55          2HD       LYS  55   2.653 -20.273   1.492
  132   2HD   LYS  55          3HD       LYS  55   2.604 -20.805   3.161
  133   1HE   LYS  55          2HE       LYS  55   4.186 -22.356   2.677
  134   2HE   LYS  55          3HE       LYS  55   3.037 -23.169   1.634
  135   1HZ   LYS  55          1HZ       LYS  55   4.883 -22.610   0.336
  136   2HZ   LYS  55          2HZ       LYS  55   3.722 -21.552  -0.106
  137   3HZ   LYS  55          3HZ       LYS  55   4.936 -21.069   0.873
  138    H    TRP  56           H        TRP  56  -2.916 -19.920   2.404
  139    HA   TRP  56           HA       TRP  56  -4.008 -22.228   3.276
  140   1HB   TRP  56          2HB       TRP  56  -4.700 -19.511   3.254
  141   2HB   TRP  56          3HB       TRP  56  -6.100 -20.345   2.609
  142    HD1  TRP  56           HD1      TRP  56  -3.738 -21.248   5.609
  143    HE1  TRP  56           HE1      TRP  56  -5.163 -21.820   7.755
  144    HE3  TRP  56           HE3      TRP  56  -8.272 -20.416   3.463
  145    HZ2  TRP  56           HZ2      TRP  56  -7.963 -21.859   8.302
  146    HZ3  TRP  56           HZ3      TRP  56 -10.302 -20.743   4.872
  147    HH2  TRP  56           HH2      TRP  56 -10.199 -21.440   7.213
  148    H    LYS  57           H        LYS  57  -4.910 -20.422   0.248
  149    HA   LYS  57           HA       LYS  57  -5.715 -22.998  -0.883
  150   1HB   LYS  57          2HB       LYS  57  -7.367 -20.464  -0.808
  151   2HB   LYS  57          3HB       LYS  57  -7.653 -21.745  -1.969
  152   1HG   LYS  57          2HG       LYS  57  -7.494 -23.200   0.373
  153   2HG   LYS  57          3HG       LYS  57  -8.171 -21.697   0.968
  154   1HD   LYS  57          2HD       LYS  57  -9.813 -21.923  -1.104
  155   2HD   LYS  57          3HD       LYS  57  -9.324 -23.605  -1.085
  156   1HE   LYS  57          2HE       LYS  57  -9.979 -22.636   1.619
  157   2HE   LYS  57          3HE       LYS  57 -11.324 -22.427   0.515
  158   1HZ   LYS  57          1HZ       LYS  57 -11.520 -24.569   1.330
  159   2HZ   LYS  57          2HZ       LYS  57 -10.862 -24.799  -0.147
  160   3HZ   LYS  57          3HZ       LYS  57  -9.928 -24.908   1.188
  161    H    LYS  58           H        LYS  58  -3.683 -23.029  -1.982
  162    HA   LYS  58           HA       LYS  58  -2.680 -20.879  -3.428
  163   1HB   LYS  58          2HB       LYS  58  -2.295 -23.870  -3.626
  164   2HB   LYS  58          3HB       LYS  58  -1.456 -22.757  -4.688
  165   1HG   LYS  58          2HG       LYS  58   0.095 -22.479  -3.057
  166   2HG   LYS  58          3HG       LYS  58  -1.120 -21.633  -2.120
  167   1HD   LYS  58          2HD       LYS  58  -0.371 -23.378  -0.679
  168   2HD   LYS  58          3HD       LYS  58  -1.909 -23.952  -1.293
  169   1HE   LYS  58          2HE       LYS  58  -0.829 -25.830  -1.978
  170   2HE   LYS  58          3HE       LYS  58  -0.063 -24.853  -3.216
  171   1HZ   LYS  58          1HZ       LYS  58   1.264 -24.440  -0.807
  172   2HZ   LYS  58          2HZ       LYS  58   1.130 -26.052  -1.039
  173   3HZ   LYS  58          3HZ       LYS  58   1.839 -25.119  -2.176
  Start of MODEL   20
    1    H    ARG  43           H        ARG  43  -0.464  -0.679   1.820
    2    HA   ARG  43           HA       ARG  43  -0.537   0.156  -0.939
    3   1HB   ARG  43          2HB       ARG  43   0.530   1.761   1.315
    4   2HB   ARG  43          3HB       ARG  43   1.707   1.522   0.039
    5   1HG   ARG  43          2HG       ARG  43   0.674   3.328  -0.923
    6   2HG   ARG  43          3HG       ARG  43  -0.485   2.137  -1.479
    7   1HD   ARG  43          2HD       ARG  43  -1.947   2.581   0.458
    8   2HD   ARG  43          3HD       ARG  43  -0.756   3.658   1.158
    9    HE   ARG  43           HE       ARG  43  -1.612   4.395  -1.562
   10   1HH1  ARG  43          2HH2      ARG  43  -2.161   4.810   1.889
   11   2HH1  ARG  43          1HH2      ARG  43  -2.990   6.320   1.706
   12   1HH2  ARG  43          2HH1      ARG  43  -2.704   6.387  -1.805
   13   2HH2  ARG  43          1HH1      ARG  43  -3.301   7.223  -0.410
   14    H    GLN  44           H        GLN  44   0.050  -2.111  -1.312
   15    HA   GLN  44           HA       GLN  44   1.647  -3.489  -1.973
   16   1HB   GLN  44          2HB       GLN  44   3.268  -1.433  -1.641
   17   2HB   GLN  44          3HB       GLN  44   3.742  -2.256  -0.168
   18   1HG   GLN  44          2HG       GLN  44   4.056  -4.370  -1.681
   19   2HG   GLN  44          3HG       GLN  44   3.987  -3.255  -3.030
   20   1HE2  GLN  44          1HE2      GLN  44   6.183  -4.247  -3.259
   21   2HE2  GLN  44          2HE2      GLN  44   7.523  -3.443  -2.512
   22    H    ILE  45           H        ILE  45   0.676  -2.721   1.223
   23    HA   ILE  45           HA       ILE  45   1.805  -5.174   2.324
   24    HB   ILE  45           HB       ILE  45   1.574  -2.687   3.367
   25   1HG1  ILE  45          2HG1      ILE  45   1.911  -3.856   5.601
   26   2HG1  ILE  45          3HG1      ILE  45   1.682  -5.373   4.756
   27   1HG2  ILE  45          1HG2      ILE  45  -0.982  -3.151   3.382
   28   2HG2  ILE  45          2HG2      ILE  45  -0.617  -4.161   4.801
   29   3HG2  ILE  45          3HG2      ILE  45  -0.213  -2.428   4.815
   30   1HD1  ILE  45          1HD1      ILE  45   3.523  -4.524   3.112
   31   2HD1  ILE  45          2HD1      ILE  45   3.887  -3.323   4.375
   32   3HD1  ILE  45          3HD1      ILE  45   4.034  -5.061   4.729
   33    H    LYS  46           H        LYS  46  -0.797  -4.285   0.451
   34    HA   LYS  46           HA       LYS  46  -2.533  -6.254   1.770
   35   1HB   LYS  46          2HB       LYS  46  -3.502  -4.014   1.771
   36   2HB   LYS  46          3HB       LYS  46  -3.271  -3.875   0.040
   37   1HG   LYS  46          2HG       LYS  46  -5.266  -4.887  -0.307
   38   2HG   LYS  46          3HG       LYS  46  -4.662  -6.340   0.464
   39   1HD   LYS  46          2HD       LYS  46  -5.456  -5.656   2.631
   40   2HD   LYS  46          3HD       LYS  46  -5.694  -4.000   2.112
   41   1HE   LYS  46          2HE       LYS  46  -7.250  -6.350   0.938
   42   2HE   LYS  46          3HE       LYS  46  -7.825  -5.407   2.299
   43   1HZ   LYS  46          1HZ       LYS  46  -6.979  -3.848   0.052
   44   2HZ   LYS  46          2HZ       LYS  46  -8.277  -4.794  -0.241
   45   3HZ   LYS  46          3HZ       LYS  46  -8.319  -3.706   0.975
   46    H    ILE  47           H        ILE  47  -0.559  -5.461  -0.969
   47    HA   ILE  47           HA       ILE  47  -1.947  -7.360  -2.675
   48    HB   ILE  47           HB       ILE  47  -1.056  -6.270  -4.390
   49   1HG1  ILE  47          2HG1      ILE  47   1.150  -7.283  -4.039
   50   2HG1  ILE  47          3HG1      ILE  47   1.273  -5.640  -4.636
   51   1HG2  ILE  47          1HG2      ILE  47  -1.847  -4.477  -2.800
   52   2HG2  ILE  47          2HG2      ILE  47  -0.138  -4.210  -2.375
   53   3HG2  ILE  47          3HG2      ILE  47  -0.690  -3.951  -4.047
   54   1HD1  ILE  47          1HD1      ILE  47   2.513  -5.054  -2.837
   55   2HD1  ILE  47          2HD1      ILE  47   1.192  -5.542  -1.749
   56   3HD1  ILE  47          3HD1      ILE  47   2.417  -6.732  -2.250
   57    H    TRP  48           H        TRP  48   0.880  -7.041  -0.569
   58    HA   TRP  48           HA       TRP  48   2.011  -9.513  -1.590
   59   1HB   TRP  48          2HB       TRP  48   3.002  -7.183  -0.260
   60   2HB   TRP  48          3HB       TRP  48   3.356  -8.583   0.733
   61    HD1  TRP  48           HD1      TRP  48   5.291  -6.721  -1.463
   62    HE1  TRP  48           HE1      TRP  48   7.013  -8.031  -2.973
   63    HE3  TRP  48           HE3      TRP  48   3.091 -11.274  -0.937
   64    HZ2  TRP  48           HZ2      TRP  48   7.258 -10.763  -3.759
   65    HZ3  TRP  48           HZ3      TRP  48   4.135 -13.211  -2.108
   66    HH2  TRP  48           HH2      TRP  48   6.148 -13.010  -3.481
   67    H    PHE  49           H        PHE  49  -0.278  -8.347   0.735
   68    HA   PHE  49           HA       PHE  49   0.161 -10.441   2.642
   69   1HB   PHE  49          2HB       PHE  49  -0.955  -8.756   3.779
   70   2HB   PHE  49          3HB       PHE  49  -1.355  -7.955   2.273
   71    HD1  PHE  49           HD1      PHE  49  -2.458 -10.713   4.507
   72    HD2  PHE  49           HD2      PHE  49  -3.561  -7.925   1.505
   73    HE1  PHE  49           HE1      PHE  49  -4.869 -11.334   4.817
   74    HE2  PHE  49           HE2      PHE  49  -5.973  -8.545   1.815
   75    HZ   PHE  49           HZ       PHE  49  -6.599 -10.242   3.467
   76    H    GLN  50           H        GLN  50  -1.978  -9.786  -0.155
   77    HA   GLN  50           HA       GLN  50  -3.608 -12.047   0.452
   78   1HB   GLN  50          2HB       GLN  50  -4.953 -11.358  -1.356
   79   2HB   GLN  50          3HB       GLN  50  -4.308  -9.847  -0.747
   80   1HG   GLN  50          2HG       GLN  50  -3.594  -9.448  -2.871
   81   2HG   GLN  50          3HG       GLN  50  -2.343 -10.636  -2.564
   82   1HE2  GLN  50          1HE2      GLN  50  -2.564 -10.794  -4.944
   83   2HE2  GLN  50          2HE2      GLN  50  -3.687 -11.938  -5.602
   84    H    ASN  51           H        ASN  51  -0.583 -11.454  -1.119
   85    HA   ASN  51           HA       ASN  51  -0.820 -13.590  -2.976
   86   1HB   ASN  51          2HB       ASN  51   1.426 -11.764  -2.041
   87   2HB   ASN  51          3HB       ASN  51   1.809 -13.164  -3.022
   88   1HD2  ASN  51          1HD2      ASN  51   2.021 -10.296  -3.580
   89   2HD2  ASN  51          2HD2      ASN  51   1.121  -9.988  -5.028
   90    H    ARG  52           H        ARG  52   0.443 -12.982   0.319
   91    HA   ARG  52           HA       ARG  52   1.713 -15.549   0.397
   92   1HB   ARG  52          2HB       ARG  52   2.725 -13.543   1.526
   93   2HB   ARG  52          3HB       ARG  52   1.333 -13.440   2.585
   94   1HG   ARG  52          2HG       ARG  52   2.694 -16.107   2.481
   95   2HG   ARG  52          3HG       ARG  52   3.615 -14.810   3.219
   96   1HD   ARG  52          2HD       ARG  52   0.738 -15.466   4.009
   97   2HD   ARG  52          3HD       ARG  52   2.131 -16.151   4.821
   98    HE   ARG  52           HE       ARG  52   2.264 -13.237   4.641
   99   1HH1  ARG  52          2HH2      ARG  52   0.972 -15.930   6.501
  100   2HH1  ARG  52          1HH2      ARG  52   0.825 -15.016   7.964
  101   1HH2  ARG  52          2HH1      ARG  52   2.070 -12.030   6.572
  102   2HH2  ARG  52          1HH1      ARG  52   1.454 -12.782   8.005
  103    H    ARG  53           H        ARG  53  -1.358 -14.056   1.163
  104    HA   ARG  53           HA       ARG  53  -2.080 -15.815   3.225
  105   1HB   ARG  53          2HB       ARG  53  -3.189 -13.633   2.966
  106   2HB   ARG  53          3HB       ARG  53  -3.737 -14.052   1.356
  107   1HG   ARG  53          2HG       ARG  53  -5.544 -15.186   2.154
  108   2HG   ARG  53          3HG       ARG  53  -4.573 -16.079   3.307
  109   1HD   ARG  53          2HD       ARG  53  -4.696 -14.292   4.943
  110   2HD   ARG  53          3HD       ARG  53  -5.344 -13.165   3.769
  111    HE   ARG  53           HE       ARG  53  -6.834 -15.235   5.210
  112   1HH1  ARG  53          2HH2      ARG  53  -6.795 -13.174   2.358
  113   2HH1  ARG  53          1HH2      ARG  53  -8.510 -13.239   2.131
  114   1HH2  ARG  53          2HH1      ARG  53  -9.098 -15.321   4.910
  115   2HH2  ARG  53          1HH1      ARG  53  -9.829 -14.469   3.592
  116    H    MET  54           H        MET  54  -1.954 -16.008  -0.269
  117    HA   MET  54           HA       MET  54  -4.022 -17.784  -0.726
  118   1HB   MET  54          2HB       MET  54  -2.486 -16.449  -2.376
  119   2HB   MET  54          3HB       MET  54  -1.334 -17.757  -2.190
  120   1HG   MET  54          2HG       MET  54  -2.458 -18.935  -3.771
  121   2HG   MET  54          3HG       MET  54  -3.843 -19.016  -2.701
  122   1HE   MET  54          1HE       MET  54  -2.697 -15.893  -5.699
  123   2HE   MET  54          2HE       MET  54  -1.876 -17.399  -5.222
  124   3HE   MET  54          3HE       MET  54  -3.142 -17.434  -6.472
  125    H    LYS  55           H        LYS  55  -0.931 -18.210   0.849
  126    HA   LYS  55           HA       LYS  55  -0.177 -20.733   0.313
  127   1HB   LYS  55          2HB       LYS  55   0.909 -19.146   1.893
  128   2HB   LYS  55          3HB       LYS  55  -0.332 -19.498   3.079
  129   1HG   LYS  55          2HG       LYS  55   0.359 -22.029   2.643
  130   2HG   LYS  55          3HG       LYS  55   1.833 -21.326   2.005
  131   1HD   LYS  55          2HD       LYS  55   0.826 -20.377   4.694
  132   2HD   LYS  55          3HD       LYS  55   1.611 -21.941   4.599
  133   1HE   LYS  55          2HE       LYS  55   3.603 -20.855   4.709
  134   2HE   LYS  55          3HE       LYS  55   3.296 -20.259   3.090
  135   1HZ   LYS  55          1HZ       LYS  55   2.219 -18.357   4.020
  136   2HZ   LYS  55          2HZ       LYS  55   2.375 -18.928   5.542
  137   3HZ   LYS  55          3HZ       LYS  55   3.701 -18.497   4.692
  138    H    TRP  56           H        TRP  56  -2.829 -19.755   2.581
  139    HA   TRP  56           HA       TRP  56  -3.545 -22.171   3.559
  140   1HB   TRP  56          2HB       TRP  56  -4.971 -19.653   2.938
  141   2HB   TRP  56          3HB       TRP  56  -5.982 -21.066   3.168
  142    HD1  TRP  56           HD1      TRP  56  -4.831 -18.351   5.188
  143    HE1  TRP  56           HE1      TRP  56  -4.625 -18.861   7.770
  144    HE3  TRP  56           HE3      TRP  56  -4.929 -23.415   4.732
  145    HZ2  TRP  56           HZ2      TRP  56  -4.529 -21.269   9.296
  146    HZ3  TRP  56           HZ3      TRP  56  -4.774 -24.771   6.817
  147    HH2  TRP  56           HH2      TRP  56  -4.580 -23.778   9.041
  148    H    LYS  57           H        LYS  57  -4.541 -20.691   0.395
  149    HA   LYS  57           HA       LYS  57  -5.851 -23.131  -0.383
  150   1HB   LYS  57          2HB       LYS  57  -5.373 -20.490  -1.788
  151   2HB   LYS  57          3HB       LYS  57  -6.212 -21.841  -2.525
  152   1HG   LYS  57          2HG       LYS  57  -8.118 -21.131  -1.523
  153   2HG   LYS  57          3HG       LYS  57  -7.417 -21.571   0.022
  154   1HD   LYS  57          2HD       LYS  57  -7.783 -19.331   0.457
  155   2HD   LYS  57          3HD       LYS  57  -6.192 -19.185  -0.261
  156   1HE   LYS  57          2HE       LYS  57  -7.480 -17.563  -1.424
  157   2HE   LYS  57          3HE       LYS  57  -7.416 -18.913  -2.539
  158   1HZ   LYS  57          1HZ       LYS  57  -9.656 -17.775  -1.828
  159   2HZ   LYS  57          2HZ       LYS  57  -9.580 -19.358  -2.224
  160   3HZ   LYS  57          3HZ       LYS  57  -9.600 -18.909  -0.654
  161    H    LYS  58           H        LYS  58  -4.169 -24.702  -0.307
  162    HA   LYS  58           HA       LYS  58  -2.561 -25.938  -1.177
  163   1HB   LYS  58          2HB       LYS  58  -3.300 -24.275  -3.569
  164   2HB   LYS  58          3HB       LYS  58  -1.922 -25.353  -3.658
  165   1HG   LYS  58          2HG       LYS  58  -3.282 -27.151  -3.896
  166   2HG   LYS  58          3HG       LYS  58  -4.102 -26.777  -2.393
  167   1HD   LYS  58          2HD       LYS  58  -5.531 -25.099  -3.636
  168   2HD   LYS  58          3HD       LYS  58  -4.756 -25.588  -5.130
  169   1HE   LYS  58          2HE       LYS  58  -5.631 -27.852  -4.946
  170   2HE   LYS  58          3HE       LYS  58  -6.173 -27.578  -3.303
  171   1HZ   LYS  58          1HZ       LYS  58  -7.700 -25.918  -4.163
  172   2HZ   LYS  58          2HZ       LYS  58  -7.215 -26.220  -5.692
  173   3HZ   LYS  58          3HZ       LYS  58  -7.981 -27.380  -4.834