*HEADER    PRION PROTEIN                           17-SEP-99   1QLX
*TITLE     HUMAN PRION PROTEIN
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: PRION PROTEIN;
*COMPND   3 CHAIN: A;
*COMPND   4 SYNONYM: PRP, MAJOR PRION PROTEIN, PRP27-30, PRP33-35C,
*COMPND   5 (ASCR).PRP;
*COMPND   6 FRAGMENT: RESIDUES 23-230;
*COMPND   7 ENGINEERED: YES;
*COMPND   8 MUTATION: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE   3 ORGANISM_COMMON: HUMAN;
*SOURCE   4 ORGAN: BRAIN;
*SOURCE   5 CELLULAR_LOCATION: EXTRACELLULAR;
*SOURCE   6 GENE: PRNP;
*SOURCE   7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);
*SOURCE   9 EXPRESSION_SYSTEM_CELLULAR_LOCATION: CYTOPLASM;
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PRSET A
*KEYWDS     PRION, BRAIN, GLYCOPROTEIN, GPI-ANCHOR, REPEAT,
*KEYWDS   2 POLYMORPHISM, DISEASE MUTATION
*EXPDTA    NMR, REPRESENTATIVE STRUCTURE
*AUTHOR    R.ZAHN,A.LIU,T.LUHRS,K.WUTHRICH




  Entry H atom name         Submitted Coord H atom name
    1    H    LEU 125           H        LEU 125   7.896 -14.223   2.734
    2    HA   LEU 125           HA       LEU 125   8.979 -11.673   1.892
    3   1HB   LEU 125          1HB       LEU 125   6.964 -11.985   4.046
    4   2HB   LEU 125          2HB       LEU 125   8.272 -10.841   4.188
    5    HG   LEU 125           HG       LEU 125   6.099 -10.955   2.073
    6   1HD1  LEU 125          1HD1      LEU 125   5.545  -9.986   4.267
    7   2HD1  LEU 125          2HD1      LEU 125   6.946  -8.918   4.148
    8   3HD1  LEU 125          3HD1      LEU 125   5.607  -8.717   3.014
    9   1HD2  LEU 125          1HD2      LEU 125   8.607  -9.271   2.264
   10   2HD2  LEU 125          2HD2      LEU 125   8.012 -10.187   0.863
   11   3HD2  LEU 125          3HD2      LEU 125   7.164  -8.749   1.368
   12    H    GLY 126           H        GLY 126   9.197 -12.144   5.236
   13   1HA   GLY 126          1HA       GLY 126  11.094 -12.829   6.464
   14   2HA   GLY 126          2HA       GLY 126  11.863 -13.423   4.982
   15    H    GLY 127           H        GLY 127  12.464 -11.212   7.130
   16   1HA   GLY 127          1HA       GLY 127  13.874  -9.475   7.101
   17   2HA   GLY 127          2HA       GLY 127  13.888  -9.484   5.343
   18    H    TYR 128           H        TYR 128  10.886  -9.119   5.259
   19    HA   TYR 128           HA       TYR 128  10.745  -6.231   5.487
   20   1HB   TYR 128          1HB       TYR 128   9.157  -8.422   4.319
   21   2HB   TYR 128          2HB       TYR 128   8.183  -7.139   5.004
   22    HD1  TYR 128           HD1      TYR 128  10.756  -7.898   2.421
   23    HD2  TYR 128           HD2      TYR 128   8.064  -4.965   4.032
   24    HE1  TYR 128           HE1      TYR 128  11.202  -6.426   0.481
   25    HE2  TYR 128           HE2      TYR 128   8.485  -3.484   2.080
   26    HH   TYR 128           HH       TYR 128   9.800  -3.115   0.173
   27    H    MET 129           H        MET 129   8.974  -5.123   6.533
   28    HA   MET 129           HA       MET 129   7.974  -6.259   9.075
   29   1HB   MET 129          1HB       MET 129   9.933  -4.729   9.287
   30   2HB   MET 129          2HB       MET 129   8.972  -3.400   8.706
   31   1HG   MET 129          1HG       MET 129   7.649  -3.367  10.635
   32   2HG   MET 129          2HG       MET 129   7.985  -5.062  11.010
   33   1HE   MET 129          2HE       MET 129  10.043  -6.023  11.785
   34   2HE   MET 129          3HE       MET 129  11.258  -5.176  10.816
   35   3HE   MET 129          1HE       MET 129  11.402  -5.174  12.580
   36    H    LEU 130           H        LEU 130   6.184  -4.513   9.759
   37    HA   LEU 130           HA       LEU 130   4.604  -3.597   7.413
   38   1HB   LEU 130          1HB       LEU 130   3.553  -5.647   8.276
   39   2HB   LEU 130          2HB       LEU 130   3.556  -4.979   9.912
   40    HG   LEU 130           HG       LEU 130   2.134  -3.134   9.199
   41   1HD1  LEU 130          3HD1      LEU 130   2.575  -4.263   6.480
   42   2HD1  LEU 130          1HD1      LEU 130   0.892  -3.847   6.810
   43   3HD1  LEU 130          2HD1      LEU 130   2.131  -2.625   7.036
   44   1HD2  LEU 130          2HD2      LEU 130   0.914  -5.821   8.513
   45   2HD2  LEU 130          3HD2      LEU 130   1.003  -5.047  10.120
   46   3HD2  LEU 130          1HD2      LEU 130   0.020  -4.318   8.849
   47    H    GLY 131           H        GLY 131   4.273  -1.457   7.495
   48   1HA   GLY 131          1HA       GLY 131   5.258   0.052   9.776
   49   2HA   GLY 131          2HA       GLY 131   4.666   0.686   8.240
   50    H    SER 132           H        SER 132   3.872   2.170  10.212
   51    HA   SER 132           HA       SER 132   1.730   1.479  11.795
   52   1HB   SER 132          2HB       SER 132   1.745   3.676  12.372
   53   2HB   SER 132          1HB       SER 132   1.662   4.209  10.699
   54    HG   SER 132           HG       SER 132   3.663   4.777  11.109
   55    H    ALA 133           H        ALA 133  -0.434   1.361  11.584
   56    HA   ALA 133           HA       ALA 133  -1.629   1.030   8.981
   57   1HB   ALA 133          2HB       ALA 133  -2.429  -0.071  11.140
   58   2HB   ALA 133          3HB       ALA 133  -2.998   1.515  11.693
   59   3HB   ALA 133          1HB       ALA 133  -3.697   0.762  10.241
   60    H    MET 134           H        MET 134  -2.944   2.661   7.871
   61    HA   MET 134           HA       MET 134  -3.297   5.322   9.132
   62   1HB   MET 134          1HB       MET 134  -1.791   4.789   6.540
   63   2HB   MET 134          2HB       MET 134  -2.416   6.374   7.008
   64   1HG   MET 134          1HG       MET 134  -1.147   6.261   9.120
   65   2HG   MET 134          2HG       MET 134  -0.424   4.745   8.626
   66   1HE   MET 134          1HE       MET 134   0.384   4.815   5.806
   67   2HE   MET 134          2HE       MET 134   1.993   5.560   5.843
   68   3HE   MET 134          3HE       MET 134   1.521   4.395   7.112
   69    H    SER 135           H        SER 135  -4.571   6.800   7.369
   70    HA   SER 135           HA       SER 135  -7.100   5.585   7.138
   71   1HB   SER 135          1HB       SER 135  -6.961   7.912   5.572
   72   2HB   SER 135          2HB       SER 135  -7.657   7.712   7.174
   73    HG   SER 135           HG       SER 135  -5.759   8.329   8.095
   74    H    ARG 136           H        ARG 136  -7.854   4.373   5.582
   75    HA   ARG 136           HA       ARG 136  -6.552   3.734   3.129
   76   1HB   ARG 136          2HB       ARG 136  -7.988   2.230   4.266
   77   2HB   ARG 136          1HB       ARG 136  -8.479   2.480   2.597
   78   1HG   ARG 136          1HG       ARG 136  -9.834   4.069   4.806
   79   2HG   ARG 136          2HG       ARG 136 -10.385   3.651   3.179
   80   1HD   ARG 136          2HD       ARG 136 -10.504   1.249   3.891
   81   2HD   ARG 136          1HD       ARG 136 -11.625   2.336   4.761
   82    HE   ARG 136           HE       ARG 136  -9.499   2.376   6.390
   83   1HH1  ARG 136          1HH1      ARG 136  -9.330   1.080   8.241
   84   2HH1  ARG 136          2HH1      ARG 136  -9.602  -0.651   8.116
   85   1HH2  ARG 136          1HH2      ARG 136 -10.627  -0.545   4.795
   86   2HH2  ARG 136          2HH2      ARG 136 -10.474  -1.529   6.235
   87   1HB   PRO 137          1HB       PRO 137  -6.005   7.797  -0.668
   88   2HB   PRO 137          2HB       PRO 137  -5.264   7.855   0.938
   89   1HG   PRO 137          1HG       PRO 137  -5.556   5.472  -0.849
   90   2HG   PRO 137          2HG       PRO 137  -4.189   5.916   0.185
   91   1HD   PRO 137          1HD       PRO 137  -6.155   4.070   0.840
   92   2HD   PRO 137          2HD       PRO 137  -5.146   4.933   2.009
   93    H    ILE 138           H        ILE 138  -9.023   8.791   0.255
   94    HA   ILE 138           HA       ILE 138 -10.356   7.050  -1.735
   95    HB   ILE 138           HB       ILE 138 -10.836  10.017  -1.309
   96   1HG1  ILE 138          1HG1      ILE 138 -11.500   9.161   0.784
   97   2HG1  ILE 138          2HG1      ILE 138 -12.958   9.313  -0.163
   98   1HG2  ILE 138          1HG2      ILE 138 -12.467   7.813  -2.639
   99   2HG2  ILE 138          2HG2      ILE 138 -12.964   9.503  -2.444
  100   3HG2  ILE 138          3HG2      ILE 138 -11.579   9.091  -3.458
  101   1HD1  ILE 138          3HD1      ILE 138 -12.700   6.773  -0.647
  102   2HD1  ILE 138          1HD1      ILE 138 -11.503   6.793   0.662
  103   3HD1  ILE 138          2HD1      ILE 138 -13.169   7.304   0.988
  104    H    ILE 139           H        ILE 139  -8.611   6.557  -3.168
  105    HA   ILE 139           HA       ILE 139  -7.210   8.634  -4.554
  106    HB   ILE 139           HB       ILE 139  -7.991   5.744  -5.102
  107   1HG1  ILE 139          1HG1      ILE 139  -5.455   5.704  -5.374
  108   2HG1  ILE 139          2HG1      ILE 139  -5.393   7.332  -4.709
  109   1HG2  ILE 139          2HG2      ILE 139  -8.093   6.858  -7.309
  110   2HG2  ILE 139          3HG2      ILE 139  -6.458   7.521  -7.007
  111   3HG2  ILE 139          1HG2      ILE 139  -6.718   5.781  -7.156
  112   1HD1  ILE 139          2HD1      ILE 139  -6.548   4.922  -3.356
  113   2HD1  ILE 139          3HD1      ILE 139  -4.848   5.435  -3.245
  114   3HD1  ILE 139          1HD1      ILE 139  -6.140   6.516  -2.646
  115    H    HIS 140           H        HIS 140  -7.930   9.769  -6.258
  116    HA   HIS 140           HA       HIS 140 -10.752   9.525  -7.122
  117   1HB   HIS 140          2HB       HIS 140 -10.471  11.772  -8.055
  118   2HB   HIS 140          1HB       HIS 140  -8.777  11.807  -7.517
  119    HD1  HIS 140           HD1      HIS 140 -11.775  10.532  -5.477
  120    HD2  HIS 140           HD2      HIS 140  -8.832  13.553  -5.518
  121    HE1  HIS 140           HE1      HIS 140 -11.875  11.693  -3.170
  122    H    PHE 141           H        PHE 141 -10.938   8.149  -8.735
  123    HA   PHE 141           HA       PHE 141  -8.682   7.659 -10.600
  124   1HB   PHE 141          1HB       PHE 141 -11.440   6.415 -10.267
  125   2HB   PHE 141          2HB       PHE 141 -10.283   5.931 -11.496
  126    HD1  PHE 141           HD1      PHE 141  -8.062   4.948 -10.846
  127    HD2  PHE 141           HD2      PHE 141 -11.196   5.649  -7.971
  128    HE1  PHE 141           HE1      PHE 141  -6.904   3.457  -9.228
  129    HE2  PHE 141           HE2      PHE 141 -10.033   4.162  -6.349
  130    HZ   PHE 141           HZ       PHE 141  -7.873   3.098  -6.966
  131    H    GLY 142           H        GLY 142 -11.183   9.910 -10.291
  132   1HA   GLY 142          1HA       GLY 142 -11.695  11.614 -11.791
  133   2HA   GLY 142          2HA       GLY 142 -11.019  10.680 -13.129
  134    H    SER 143           H        SER 143 -12.777   8.325 -11.788
  135    HA   SER 143           HA       SER 143 -15.435   9.223 -12.805
  136   1HB   SER 143          1HB       SER 143 -14.274   6.423 -12.855
  137   2HB   SER 143          2HB       SER 143 -15.922   6.890 -13.289
  138    HG   SER 143           HG       SER 143 -13.759   6.808 -14.798
  139    H    ASP 144           H        ASP 144 -16.571   9.652 -10.992
  140    HA   ASP 144           HA       ASP 144 -15.727   8.837  -8.374
  141   1HB   ASP 144          1HB       ASP 144 -18.472   9.831  -9.201
  142   2HB   ASP 144          2HB       ASP 144 -17.823   9.774  -7.561
  143    H    TYR 145           H        TYR 145 -17.602   7.273 -10.835
  144    HA   TYR 145           HA       TYR 145 -18.956   5.283  -9.351
  145   1HB   TYR 145          1HB       TYR 145 -19.344   5.551 -11.704
  146   2HB   TYR 145          2HB       TYR 145 -17.647   5.274 -12.090
  147    HD1  TYR 145           HD1      TYR 145 -16.773   3.066 -12.399
  148    HD2  TYR 145           HD2      TYR 145 -20.775   3.606 -10.886
  149    HE1  TYR 145           HE1      TYR 145 -17.092   0.643 -12.456
  150    HE2  TYR 145           HE2      TYR 145 -21.102   1.129 -10.905
  151    HH   TYR 145           HH       TYR 145 -18.458  -1.112 -11.898
  152    H    GLU 146           H        GLU 146 -15.526   5.423 -10.541
  153    HA   GLU 146           HA       GLU 146 -14.845   2.792  -9.558
  154   1HB   GLU 146          1HB       GLU 146 -13.308   5.119 -10.780
  155   2HB   GLU 146          2HB       GLU 146 -12.505   3.665 -10.162
  156   1HG   GLU 146          1HG       GLU 146 -14.001   2.261 -11.603
  157   2HG   GLU 146          2HG       GLU 146 -14.679   3.747 -12.276
  158    H    ASP 147           H        ASP 147 -14.539   6.098  -8.471
  159    HA   ASP 147           HA       ASP 147 -12.756   5.820  -6.261
  160   1HB   ASP 147          1HB       ASP 147 -15.152   7.680  -6.668
  161   2HB   ASP 147          2HB       ASP 147 -14.115   7.777  -5.271
  162    H    ARG 148           H        ARG 148 -16.302   5.819  -6.456
  163    HA   ARG 148           HA       ARG 148 -16.688   4.943  -3.752
  164   1HB   ARG 148          1HB       ARG 148 -18.247   6.331  -5.072
  165   2HB   ARG 148          2HB       ARG 148 -18.569   4.993  -6.155
  166   1HG   ARG 148          1HG       ARG 148 -19.040   4.414  -3.246
  167   2HG   ARG 148          2HG       ARG 148 -20.011   5.716  -3.915
  168   1HD   ARG 148          1HD       ARG 148 -20.428   3.958  -5.898
  169   2HD   ARG 148          2HD       ARG 148 -19.978   2.789  -4.674
  170    HE   ARG 148           HE       ARG 148 -22.046   3.010  -3.827
  171   1HH1  ARG 148          1HH1      ARG 148 -24.183   3.893  -3.600
  172   2HH1  ARG 148          2HH1      ARG 148 -24.583   5.411  -4.363
  173   1HH2  ARG 148          1HH2      ARG 148 -21.491   5.926  -5.818
  174   2HH2  ARG 148          2HH2      ARG 148 -22.930   6.736  -5.298
  175    H    TYR 149           H        TYR 149 -16.084   3.247  -6.815
  176    HA   TYR 149           HA       TYR 149 -17.379   0.759  -6.054
  177   1HB   TYR 149          1HB       TYR 149 -16.822   1.232  -8.397
  178   2HB   TYR 149          2HB       TYR 149 -15.115   1.275  -8.024
  179    HD1  TYR 149           HD1      TYR 149 -13.799  -0.708  -8.095
  180    HD2  TYR 149           HD2      TYR 149 -18.110  -0.987  -8.104
  181    HE1  TYR 149           HE1      TYR 149 -13.631  -3.087  -8.705
  182    HE2  TYR 149           HE2      TYR 149 -17.941  -3.388  -8.690
  183    HH   TYR 149           HH       TYR 149 -14.814  -5.079  -9.084
  184    H    TYR 150           H        TYR 150 -13.937   1.863  -5.954
  185    HA   TYR 150           HA       TYR 150 -12.996  -0.245  -4.266
  186   1HB   TYR 150          1HB       TYR 150 -11.162   0.830  -4.883
  187   2HB   TYR 150          2HB       TYR 150 -11.999   2.361  -5.182
  188    HD1  TYR 150           HD1      TYR 150 -10.728   0.136  -2.436
  189    HD2  TYR 150           HD2      TYR 150 -11.728   4.149  -3.652
  190    HE1  TYR 150           HE1      TYR 150  -9.740   1.005  -0.342
  191    HE2  TYR 150           HE2      TYR 150 -10.782   5.012  -1.559
  192    HH   TYR 150           HH       TYR 150  -9.208   4.445   0.075
  193    H    ARG 151           H        ARG 151 -14.431   2.974  -3.491
  194    HA   ARG 151           HA       ARG 151 -14.066   2.854  -0.778
  195   1HB   ARG 151          1HB       ARG 151 -14.953   4.768  -2.223
  196   2HB   ARG 151          2HB       ARG 151 -16.583   4.137  -1.872
  197   1HG   ARG 151          1HG       ARG 151 -16.333   4.483   0.451
  198   2HG   ARG 151          2HG       ARG 151 -14.593   4.782   0.222
  199   1HD   ARG 151          1HD       ARG 151 -15.842   6.836   0.575
  200   2HD   ARG 151          2HD       ARG 151 -14.852   6.767  -0.861
  201    HE   ARG 151           HE       ARG 151 -16.793   6.951  -2.167
  202   1HH1  ARG 151          1HH1      ARG 151 -19.000   7.673  -2.433
  203   2HH1  ARG 151          2HH1      ARG 151 -20.132   7.528  -1.146
  204   1HH2  ARG 151          1HH2      ARG 151 -17.677   6.419   1.205
  205   2HH2  ARG 151          2HH2      ARG 151 -19.324   6.927   1.054
  206    H    GLU 152           H        GLU 152 -16.842   1.388  -2.488
  207    HA   GLU 152           HA       GLU 152 -18.210   0.616  -0.068
  208   1HB   GLU 152          1HB       GLU 152 -18.289  -0.458  -2.908
  209   2HB   GLU 152          2HB       GLU 152 -19.280  -1.123  -1.586
  210   1HG   GLU 152          1HG       GLU 152 -20.184   1.127  -1.109
  211   2HG   GLU 152          2HG       GLU 152 -19.258   1.813  -2.431
  212    H    ASN 153           H        ASN 153 -15.772  -1.035  -2.059
  213    HA   ASN 153           HA       ASN 153 -15.621  -3.427  -0.402
  214   1HB   ASN 153          1HB       ASN 153 -13.877  -2.355  -2.668
  215   2HB   ASN 153          2HB       ASN 153 -13.620  -3.893  -1.861
  216   2HD2  ASN 153          1HD2      ASN 153 -15.785  -2.148  -4.130
  217   1HD2  ASN 153          2HD2      ASN 153 -16.755  -3.530  -4.527
  218    H    MET 154           H        MET 154 -14.294  -0.281  -0.036
  219    HA   MET 154           HA       MET 154 -11.730  -0.710   0.594
  220   1HB   MET 154          2HB       MET 154 -12.958   1.503   0.350
  221   2HB   MET 154          1HB       MET 154 -11.579   1.469   1.445
  222   1HG   MET 154          1HG       MET 154 -14.330   0.982   2.502
  223   2HG   MET 154          2HG       MET 154 -12.893   1.485   3.357
  224   1HE   MET 154          1HE       MET 154 -12.116   3.981   1.277
  225   2HE   MET 154          2HE       MET 154 -13.144   5.347   1.702
  226   3HE   MET 154          3HE       MET 154 -12.153   4.624   2.949
  227    H    HIS 155           H        HIS 155 -14.320  -1.544   2.841
  228    HA   HIS 155           HA       HIS 155 -12.812  -1.711   5.227
  229   1HB   HIS 155          2HB       HIS 155 -15.195  -1.987   5.253
  230   2HB   HIS 155          1HB       HIS 155 -14.389  -3.350   6.001
  231    HD1  HIS 155           HD1      HIS 155 -16.044  -5.330   5.577
  232    HD2  HIS 155           HD2      HIS 155 -15.524  -2.792   2.246
  233    HE1  HIS 155           HE1      HIS 155 -17.410  -6.290   3.683
  234    H    ARG 156           H        ARG 156 -12.913  -3.959   2.436
  235    HA   ARG 156           HA       ARG 156 -11.212  -5.934   3.776
  236   1HB   ARG 156          1HB       ARG 156 -12.154  -5.658   0.896
  237   2HB   ARG 156          2HB       ARG 156 -11.275  -7.030   1.560
  238   1HG   ARG 156          1HG       ARG 156 -13.412  -6.847   3.332
  239   2HG   ARG 156          2HG       ARG 156 -14.144  -6.278   1.826
  240   1HD   ARG 156          2HD       ARG 156 -13.228  -8.366   0.708
  241   2HD   ARG 156          1HD       ARG 156 -14.470  -8.649   1.933
  242    HE   ARG 156           HE       ARG 156 -11.905  -8.702   3.186
  243   1HH1  ARG 156          1HH1      ARG 156 -11.229 -10.532   4.133
  244   2HH1  ARG 156          2HH1      ARG 156 -11.677 -12.123   3.580
  245   1HH2  ARG 156          1HH2      ARG 156 -13.940 -10.774   1.158
  246   2HH2  ARG 156          2HH2      ARG 156 -13.400 -12.249   1.830
  247    H    TYR 157           H        TYR 157 -10.578  -2.980   2.064
  248    HA   TYR 157           HA       TYR 157  -8.200  -3.825   0.704
  249   1HB   TYR 157          1HB       TYR 157  -9.557  -1.222   1.310
  250   2HB   TYR 157          2HB       TYR 157  -7.841  -1.132   1.044
  251    HD1  TYR 157           HD1      TYR 157  -7.486  -0.269  -1.119
  252    HD2  TYR 157           HD2      TYR 157 -10.563  -3.258  -0.583
  253    HE1  TYR 157           HE1      TYR 157  -7.700  -0.499  -3.548
  254    HE2  TYR 157           HE2      TYR 157 -10.698  -3.543  -3.020
  255    HH   TYR 157           HH       TYR 157  -9.489  -3.131  -5.077
  256   1HB   PRO 158          1HB       PRO 158  -2.961  -2.654   2.838
  257   2HB   PRO 158          2HB       PRO 158  -3.535  -4.230   2.252
  258   1HG   PRO 158          2HG       PRO 158  -3.559  -3.028   0.218
  259   2HG   PRO 158          1HG       PRO 158  -4.130  -1.529   1.037
  260   1HD   PRO 158          1HD       PRO 158  -6.167  -2.379   0.234
  261   2HD   PRO 158          2HD       PRO 158  -5.665  -4.076   0.458
  262    H    ASN 159           H        ASN 159  -4.422  -2.676   5.640
  263    HA   ASN 159           HA       ASN 159  -5.417   0.142   5.805
  264   1HB   ASN 159          1HB       ASN 159  -6.269  -1.878   7.281
  265   2HB   ASN 159          2HB       ASN 159  -4.749  -1.663   8.148
  266   2HD2  ASN 159          1HD2      ASN 159  -4.938   1.439   7.874
  267   1HD2  ASN 159          2HD2      ASN 159  -6.143   1.827   9.060
  268    H    GLN 160           H        GLN 160  -2.552  -1.718   5.646
  269    HA   GLN 160           HA       GLN 160  -0.827   0.464   6.564
  270   1HB   GLN 160          1HB       GLN 160   0.110  -1.966   7.759
  271   2HB   GLN 160          2HB       GLN 160   0.071  -0.374   8.374
  272   1HG   GLN 160          1HG       GLN 160  -2.347  -0.830   9.057
  273   2HG   GLN 160          2HG       GLN 160  -2.242  -2.297   8.296
  274   2HE2  GLN 160          1HE2      GLN 160   0.639  -1.347  10.277
  275   1HE2  GLN 160          2HE2      GLN 160   0.252  -2.462  11.549
  276    H    VAL 161           H        VAL 161   1.538  -0.115   5.887
  277    HA   VAL 161           HA       VAL 161   1.431  -1.813   3.419
  278    HB   VAL 161           HB       VAL 161   2.958  -0.393   2.322
  279   1HG1  VAL 161          2HG1      VAL 161   0.645   1.228   3.449
  280   2HG1  VAL 161          3HG1      VAL 161   1.686   1.745   2.109
  281   3HG1  VAL 161          1HG1      VAL 161   0.732   0.305   1.922
  282   1HG2  VAL 161          2HG2      VAL 161   4.313   0.494   4.205
  283   2HG2  VAL 161          3HG2      VAL 161   3.713   1.788   3.196
  284   3HG2  VAL 161          1HG2      VAL 161   2.923   1.461   4.755
  285    H    TYR 162           H        TYR 162   3.278  -3.178   3.003
  286    HA   TYR 162           HA       TYR 162   4.881  -3.731   5.405
  287   1HB   TYR 162          1HB       TYR 162   4.539  -4.990   2.714
  288   2HB   TYR 162          2HB       TYR 162   5.840  -5.489   3.790
  289    HD1  TYR 162           HD1      TYR 162   2.281  -5.774   3.046
  290    HD2  TYR 162           HD2      TYR 162   5.300  -6.569   6.009
  291    HE1  TYR 162           HE1      TYR 162   0.763  -7.400   4.152
  292    HE2  TYR 162           HE2      TYR 162   3.791  -8.127   7.151
  293    HH   TYR 162           HH       TYR 162   0.697  -9.150   5.785
  294    H    TYR 163           H        TYR 163   7.071  -3.198   5.555
  295    HA   TYR 163           HA       TYR 163   8.384  -1.675   3.427
  296   1HB   TYR 163          1HB       TYR 163   8.558   0.310   4.500
  297   2HB   TYR 163          2HB       TYR 163   6.910  -0.107   4.897
  298    HD1  TYR 163           HD1      TYR 163   6.844  -1.609   7.239
  299    HD2  TYR 163           HD2      TYR 163   9.807   1.312   6.165
  300    HE1  TYR 163           HE1      TYR 163   7.302  -1.214   9.653
  301    HE2  TYR 163           HE2      TYR 163  10.293   1.706   8.574
  302    HH   TYR 163           HH       TYR 163   8.245   0.467  11.138
  303    H    ARG 164           H        ARG 164  10.670  -0.860   4.560
  304    HA   ARG 164           HA       ARG 164  11.605  -2.868   6.478
  305   1HB   ARG 164          1HB       ARG 164  12.777  -2.463   3.690
  306   2HB   ARG 164          2HB       ARG 164  13.803  -2.910   5.055
  307   1HG   ARG 164          1HG       ARG 164  12.280  -4.795   5.573
  308   2HG   ARG 164          2HG       ARG 164  11.430  -4.502   4.051
  309   1HD   ARG 164          1HD       ARG 164  14.418  -5.118   4.257
  310   2HD   ARG 164          2HD       ARG 164  13.181  -6.357   4.132
  311    HE   ARG 164           HE       ARG 164  12.728  -5.868   1.965
  312   1HH1  ARG 164          1HH1      ARG 164  13.514  -5.185  -0.233
  313   2HH1  ARG 164          2HH1      ARG 164  14.915  -4.173  -0.266
  314   1HH2  ARG 164          1HH2      ARG 164  15.321  -3.695   3.178
  315   2HH2  ARG 164          2HH2      ARG 164  15.750  -3.195   1.581
  316   1HB   PRO 165          1HB       PRO 165  15.598  -0.297   9.633
  317   2HB   PRO 165          2HB       PRO 165  13.926  -0.682  10.143
  318   1HG   PRO 165          2HG       PRO 165  14.828  -2.870   9.812
  319   2HG   PRO 165          1HG       PRO 165  15.758  -2.337   8.373
  320   1HD   PRO 165          1HD       PRO 165  13.862  -3.259   7.322
  321   2HD   PRO 165          2HD       PRO 165  12.767  -2.734   8.633
  322    H    MET 166           H        MET 166  15.335   2.068   8.533
  323    HA   MET 166           HA       MET 166  16.436   2.353   5.852
  324   1HB   MET 166          1HB       MET 166  16.426   4.207   8.242
  325   2HB   MET 166          2HB       MET 166  17.357   4.516   6.763
  326   1HG   MET 166          1HG       MET 166  15.261   4.213   5.423
  327   2HG   MET 166          2HG       MET 166  14.351   4.119   6.928
  328   1HE   MET 166          2HE       MET 166  13.929   6.147   4.383
  329   2HE   MET 166          3HE       MET 166  12.813   6.102   5.759
  330   3HE   MET 166          1HE       MET 166  13.499   7.647   5.236
  331    H    ASP 167           H        ASP 167  17.630   0.468   5.880
  332    HA   ASP 167           HA       ASP 167  20.051   0.062   7.387
  333   1HB   ASP 167          1HB       ASP 167  20.481  -1.717   5.741
  334   2HB   ASP 167          2HB       ASP 167  18.918  -1.841   6.531
  335    H    GLU 168           H        GLU 168  19.821   0.411   3.905
  336    HA   GLU 168           HA       GLU 168  22.141   2.255   3.632
  337   1HB   GLU 168          1HB       GLU 168  23.189   0.655   2.146
  338   2HB   GLU 168          2HB       GLU 168  22.843  -0.160   3.681
  339   1HG   GLU 168          1HG       GLU 168  20.697  -1.052   2.568
  340   2HG   GLU 168          2HG       GLU 168  21.319  -0.432   1.046
  341    H    TYR 169           H        TYR 169  19.257   0.662   2.297
  342    HA   TYR 169           HA       TYR 169  19.715   1.363  -0.362
  343   1HB   TYR 169          1HB       TYR 169  18.502  -0.600   0.673
  344   2HB   TYR 169          2HB       TYR 169  17.156   0.463   1.024
  345    HD1  TYR 169           HD1      TYR 169  15.485   0.889  -0.680
  346    HD2  TYR 169           HD2      TYR 169  19.216  -1.034  -1.687
  347    HE1  TYR 169           HE1      TYR 169  14.504   0.141  -2.817
  348    HE2  TYR 169           HE2      TYR 169  18.249  -1.766  -3.847
  349    HH   TYR 169           HH       TYR 169  14.832  -1.124  -4.756
  350    H    SER 170           H        SER 170  17.470   2.614   2.028
  351    HA   SER 170           HA       SER 170  15.667   3.817   1.953
  352   1HB   SER 170          1HB       SER 170  16.009   6.188   1.947
  353   2HB   SER 170          2HB       SER 170  17.245   5.329   2.851
  354    HG   SER 170           HG       SER 170  18.675   5.646   1.031
  355    H    ASN 171           H        ASN 171  16.784   5.764  -0.690
  356    HA   ASN 171           HA       ASN 171  15.928   6.348  -2.678
  357   1HB   ASN 171          1HB       ASN 171  15.987   3.692  -2.951
  358   2HB   ASN 171          2HB       ASN 171  14.234   3.887  -2.984
  359   2HD2  ASN 171          1HD2      ASN 171  13.573   5.843  -4.638
  360   1HD2  ASN 171          2HD2      ASN 171  14.487   5.898  -6.121
  361    H    GLN 172           H        GLN 172  14.132   7.346  -3.508
  362    HA   GLN 172           HA       GLN 172  11.617   7.327  -1.908
  363   1HB   GLN 172          1HB       GLN 172  12.479   9.506  -2.600
  364   2HB   GLN 172          2HB       GLN 172  12.397   9.018  -4.283
  365   1HG   GLN 172          1HG       GLN 172   9.783   8.488  -3.200
  366   2HG   GLN 172          2HG       GLN 172  10.288   9.986  -2.443
  367   2HE2  GLN 172          1HE2      GLN 172   8.456  10.890  -3.633
  368   1HE2  GLN 172          2HE2      GLN 172   8.617  11.397  -5.306
  369    H    ASN 173           H        ASN 173  11.491   7.679  -5.395
  370    HA   ASN 173           HA       ASN 173   9.192   6.347  -5.426
  371   1HB   ASN 173          1HB       ASN 173  10.807   7.609  -7.404
  372   2HB   ASN 173          2HB       ASN 173  10.324   6.056  -8.085
  373   2HD2  ASN 173          1HD2      ASN 173   9.137   9.145  -6.775
  374   1HD2  ASN 173          2HD2      ASN 173   7.456   8.894  -7.245
  375    H    ASN 174           H        ASN 174  12.236   4.663  -6.381
  376    HA   ASN 174           HA       ASN 174  10.843   2.298  -7.137
  377   1HB   ASN 174          1HB       ASN 174  13.331   3.100  -7.600
  378   2HB   ASN 174          2HB       ASN 174  13.694   2.099  -6.191
  379   2HD2  ASN 174          1HD2      ASN 174  14.256   1.770  -9.260
  380   1HD2  ASN 174          2HD2      ASN 174  13.582   0.199  -9.589
  381    H    PHE 175           H        PHE 175  11.773   3.426  -3.899
  382    HA   PHE 175           HA       PHE 175  11.675   0.768  -2.669
  383   1HB   PHE 175          1HB       PHE 175  12.969   2.356  -1.538
  384   2HB   PHE 175          2HB       PHE 175  11.731   3.594  -1.601
  385    HD1  PHE 175           HD1      PHE 175   9.621   3.378  -0.147
  386    HD2  PHE 175           HD2      PHE 175  13.060   0.804   0.333
  387    HE1  PHE 175           HE1      PHE 175   8.873   2.811   2.097
  388    HE2  PHE 175           HE2      PHE 175  12.248   0.182   2.588
  389    HZ   PHE 175           HZ       PHE 175  10.197   1.255   3.509
  390    H    VAL 176           H        VAL 176   9.454   3.578  -3.112
  391    HA   VAL 176           HA       VAL 176   7.202   2.332  -1.868
  392    HB   VAL 176           HB       VAL 176   7.381   4.427  -4.082
  393   1HG1  VAL 176          1HG1      VAL 176   4.931   3.447  -2.574
  394   2HG1  VAL 176          2HG1      VAL 176   4.989   4.931  -3.558
  395   3HG1  VAL 176          3HG1      VAL 176   5.215   3.354  -4.320
  396   1HG2  VAL 176          3HG2      VAL 176   6.769   4.674  -1.108
  397   2HG2  VAL 176          1HG2      VAL 176   8.271   5.176  -1.910
  398   3HG2  VAL 176          2HG2      VAL 176   6.758   6.005  -2.288
  399    H    HIS 177           H        HIS 177   8.412   2.283  -5.286
  400    HA   HIS 177           HA       HIS 177   6.296   0.753  -6.256
  401   1HB   HIS 177          1HB       HIS 177   8.108   1.990  -7.539
  402   2HB   HIS 177          2HB       HIS 177   9.173   0.613  -7.251
  403    HD1  HIS 177           HD1      HIS 177   8.627  -1.606  -8.683
  404    HD2  HIS 177           HD2      HIS 177   6.012   1.659  -9.226
  405    HE1  HIS 177           HE1      HIS 177   7.071  -2.225 -10.617
  406    H    ASP 178           H        ASP 178   9.192  -0.351  -4.513
  407    HA   ASP 178           HA       ASP 178   8.628  -3.207  -4.762
  408   1HB   ASP 178          1HB       ASP 178  10.605  -1.493  -3.349
  409   2HB   ASP 178          2HB       ASP 178  10.081  -2.854  -2.384
  410    H    CYS 179           H        CYS 179   7.943  -0.733  -2.194
  411    HA   CYS 179           HA       CYS 179   6.848  -2.542  -0.332
  412   1HB   CYS 179          1HB       CYS 179   6.270  -0.669   0.897
  413   2HB   CYS 179          2HB       CYS 179   7.559  -0.026  -0.085
  414    H    VAL 180           H        VAL 180   5.377  -0.745  -2.994
  415    HA   VAL 180           HA       VAL 180   2.672  -1.477  -2.648
  416    HB   VAL 180           HB       VAL 180   4.313  -0.658  -5.060
  417   1HG1  VAL 180          2HG1      VAL 180   1.324  -1.200  -4.926
  418   2HG1  VAL 180          3HG1      VAL 180   2.115  -0.285  -6.222
  419   3HG1  VAL 180          1HG1      VAL 180   2.498  -1.993  -6.001
  420   1HG2  VAL 180          3HG2      VAL 180   3.770   1.035  -3.220
  421   2HG2  VAL 180          1HG2      VAL 180   3.128   1.448  -4.814
  422   3HG2  VAL 180          2HG2      VAL 180   2.056   0.764  -3.575
  423    H    ASN 181           H        ASN 181   5.228  -2.923  -4.736
  424    HA   ASN 181           HA       ASN 181   3.564  -4.965  -5.686
  425   1HB   ASN 181          1HB       ASN 181   5.877  -4.161  -6.553
  426   2HB   ASN 181          2HB       ASN 181   6.558  -5.360  -5.447
  427   2HD2  ASN 181          1HD2      ASN 181   6.519  -7.579  -6.193
  428   1HD2  ASN 181          2HD2      ASN 181   5.330  -8.102  -7.398
  429    H    ILE 182           H        ILE 182   5.888  -5.089  -2.918
  430    HA   ILE 182           HA       ILE 182   5.314  -7.703  -2.070
  431    HB   ILE 182           HB       ILE 182   6.448  -5.223  -0.841
  432   1HG1  ILE 182          1HG1      ILE 182   8.324  -6.686  -0.332
  433   2HG1  ILE 182          2HG1      ILE 182   7.415  -8.101  -0.861
  434   1HG2  ILE 182          3HG2      ILE 182   5.461  -7.553   0.812
  435   2HG2  ILE 182          1HG2      ILE 182   6.717  -6.395   1.359
  436   3HG2  ILE 182          2HG2      ILE 182   5.096  -5.830   0.961
  437   1HD1  ILE 182          1HD1      ILE 182   8.358  -5.853  -2.646
  438   2HD1  ILE 182          2HD1      ILE 182   9.069  -7.473  -2.487
  439   3HD1  ILE 182          3HD1      ILE 182   7.437  -7.298  -3.152
  440    H    THR 183           H        THR 183   3.603  -4.636  -0.942
  441    HA   THR 183           HA       THR 183   2.003  -6.160   0.822
  442    HB   THR 183           HB       THR 183   1.411  -3.524  -0.525
  443    HG1  THR 183           HG1      THR 183   3.304  -3.245   0.483
  444   1HG2  THR 183          2HG2      THR 183   0.410  -4.606   2.137
  445   2HG2  THR 183          3HG2      THR 183   0.146  -2.959   1.522
  446   3HG2  THR 183          1HG2      THR 183  -0.564  -4.342   0.668
  447    H    ILE 184           H        ILE 184   1.220  -5.093  -2.653
  448    HA   ILE 184           HA       ILE 184  -1.198  -6.381  -2.750
  449    HB   ILE 184           HB       ILE 184   0.970  -5.452  -4.642
  450   1HG1  ILE 184          1HG1      ILE 184  -0.881  -4.059  -5.436
  451   2HG1  ILE 184          2HG1      ILE 184  -1.999  -4.860  -4.315
  452   1HG2  ILE 184          3HG2      ILE 184  -1.458  -6.999  -5.601
  453   2HG2  ILE 184          1HG2      ILE 184  -0.332  -6.042  -6.610
  454   3HG2  ILE 184          2HG2      ILE 184   0.253  -7.477  -5.804
  455   1HD1  ILE 184          1HD1      ILE 184   0.263  -3.012  -3.596
  456   2HD1  ILE 184          2HD1      ILE 184  -1.461  -2.649  -3.652
  457   3HD1  ILE 184          3HD1      ILE 184  -0.884  -3.812  -2.467
  458    H    LYS 185           H        LYS 185   2.107  -7.754  -3.422
  459    HA   LYS 185           HA       LYS 185   1.236 -10.305  -4.256
  460   1HB   LYS 185          1HB       LYS 185   3.568  -9.477  -4.419
  461   2HB   LYS 185          2HB       LYS 185   3.744  -9.541  -2.673
  462   1HG   LYS 185          1HG       LYS 185   3.478 -11.973  -2.648
  463   2HG   LYS 185          2HG       LYS 185   3.089 -11.979  -4.378
  464   1HD   LYS 185          1HD       LYS 185   5.346 -10.967  -4.828
  465   2HD   LYS 185          2HD       LYS 185   5.685 -11.071  -3.103
  466   1HE   LYS 185          1HE       LYS 185   5.548 -13.496  -3.145
  467   2HE   LYS 185          2HE       LYS 185   5.078 -13.486  -4.854
  468   1HZ   LYS 185          3HZ       LYS 185   7.587 -12.222  -3.969
  469   2HZ   LYS 185          1HZ       LYS 185   7.524 -13.835  -4.247
  470   3HZ   LYS 185          2HZ       LYS 185   7.195 -12.766  -5.466
  471    H    GLN 186           H        GLN 186   2.196  -9.254  -0.955
  472    HA   GLN 186           HA       GLN 186   1.428 -11.672   0.302
  473   1HB   GLN 186          1HB       GLN 186   1.919  -8.805   1.189
  474   2HB   GLN 186          2HB       GLN 186   1.226  -9.921   2.335
  475   1HG   GLN 186          1HG       GLN 186   3.548 -11.102   0.926
  476   2HG   GLN 186          2HG       GLN 186   3.982  -9.625   1.756
  477   2HE2  GLN 186          1HE2      GLN 186   3.854 -12.919   2.198
  478   1HE2  GLN 186          2HE2      GLN 186   3.689 -12.959   3.946
  479    H    HIS 187           H        HIS 187  -0.660  -8.937  -0.691
  480    HA   HIS 187           HA       HIS 187  -3.019 -10.065   0.601
  481   1HB   HIS 187          1HB       HIS 187  -2.452  -7.856  -1.229
  482   2HB   HIS 187          2HB       HIS 187  -3.837  -8.776  -1.780
  483    HD1  HIS 187           HD1      HIS 187  -3.042  -8.123   1.978
  484    HD2  HIS 187           HD2      HIS 187  -5.775  -7.142  -1.091
  485    HE1  HIS 187           HE1      HIS 187  -4.931  -6.796   3.063
  486    H    THR 188           H        THR 188  -1.756 -10.292  -2.713
  487    HA   THR 188           HA       THR 188  -3.538 -12.211  -3.735
  488    HB   THR 188           HB       THR 188  -0.709 -11.680  -4.704
  489    HG1  THR 188           HG1      THR 188  -1.650  -9.679  -4.371
  490   1HG2  THR 188          2HG2      THR 188  -3.316 -12.321  -6.161
  491   2HG2  THR 188          3HG2      THR 188  -1.781 -11.895  -6.946
  492   3HG2  THR 188          1HG2      THR 188  -1.889 -13.375  -6.020
  493    H    VAL 189           H        VAL 189  -1.002 -12.767  -1.482
  494    HA   VAL 189           HA       VAL 189  -1.261 -15.699  -1.972
  495    HB   VAL 189           HB       VAL 189   0.820 -14.252  -0.270
  496   1HG1  VAL 189          2HG1      VAL 189   0.554 -17.175  -1.130
  497   2HG1  VAL 189          3HG1      VAL 189   1.944 -16.492  -0.280
  498   3HG1  VAL 189          1HG1      VAL 189   0.369 -16.553   0.522
  499   1HG2  VAL 189          1HG2      VAL 189   1.097 -15.519  -3.023
  500   2HG2  VAL 189          2HG2      VAL 189   1.223 -13.788  -2.642
  501   3HG2  VAL 189          3HG2      VAL 189   2.431 -14.894  -2.015
  502    H    THR 190           H        THR 190  -0.802 -13.631   0.970
  503    HA   THR 190           HA       THR 190  -1.879 -15.613   2.559
  504    HB   THR 190           HB       THR 190  -1.882 -12.674   3.313
  505    HG1  THR 190           HG1      THR 190   0.224 -12.692   3.498
  506   1HG2  THR 190          2HG2      THR 190  -1.281 -15.239   4.840
  507   2HG2  THR 190          3HG2      THR 190  -1.119 -13.598   5.500
  508   3HG2  THR 190          1HG2      THR 190  -2.711 -14.201   5.021
  509    H    THR 191           H        THR 191  -3.624 -12.936   0.960
  510    HA   THR 191           HA       THR 191  -6.085 -13.565   2.480
  511    HB   THR 191           HB       THR 191  -5.578 -11.456   0.352
  512    HG1  THR 191           HG1      THR 191  -4.421 -11.035   2.198
  513   1HG2  THR 191          3HG2      THR 191  -7.947 -11.909   2.215
  514   2HG2  THR 191          1HG2      THR 191  -7.662 -10.425   1.290
  515   3HG2  THR 191          2HG2      THR 191  -7.941 -11.954   0.441
  516    H    THR 192           H        THR 192  -4.631 -13.992  -0.745
  517    HA   THR 192           HA       THR 192  -7.091 -14.994  -1.887
  518    HB   THR 192           HB       THR 192  -4.222 -14.840  -2.724
  519    HG1  THR 192           HG1      THR 192  -6.569 -13.352  -2.992
  520   1HG2  THR 192          2HG2      THR 192  -6.525 -15.882  -4.385
  521   2HG2  THR 192          3HG2      THR 192  -4.962 -15.303  -5.046
  522   3HG2  THR 192          1HG2      THR 192  -5.005 -16.710  -3.974
  523    H    THR 193           H        THR 193  -4.316 -16.617  -0.392
  524    HA   THR 193           HA       THR 193  -5.044 -19.287  -0.609
  525    HB   THR 193           HB       THR 193  -4.006 -17.581   1.693
  526    HG1  THR 193           HG1      THR 193  -2.653 -17.722  -0.041
  527   1HG2  THR 193          2HG2      THR 193  -4.160 -20.592   1.531
  528   2HG2  THR 193          3HG2      THR 193  -3.099 -19.716   2.651
  529   3HG2  THR 193          1HG2      THR 193  -4.864 -19.566   2.788
  530    H    LYS 194           H        LYS 194  -6.841 -16.688   1.062
  531    HA   LYS 194           HA       LYS 194  -8.434 -18.578   2.581
  532   1HB   LYS 194          1HB       LYS 194  -9.057 -15.635   2.255
  533   2HB   LYS 194          2HB       LYS 194  -9.482 -16.706   3.585
  534   1HG   LYS 194          1HG       LYS 194  -7.082 -16.834   4.258
  535   2HG   LYS 194          2HG       LYS 194  -6.646 -15.887   2.869
  536   1HD   LYS 194          1HD       LYS 194  -6.547 -14.428   4.661
  537   2HD   LYS 194          2HD       LYS 194  -8.008 -13.967   3.766
  538   1HE   LYS 194          1HE       LYS 194  -9.417 -14.609   5.471
  539   2HE   LYS 194          2HE       LYS 194  -8.404 -15.982   5.922
  540   1HZ   LYS 194          1HZ       LYS 194  -7.752 -13.174   6.577
  541   2HZ   LYS 194          2HZ       LYS 194  -8.409 -14.263   7.601
  542   3HZ   LYS 194          3HZ       LYS 194  -6.907 -14.530   7.050
  543    H    GLY 195           H        GLY 195  -8.411 -18.295  -0.557
  544   1HA   GLY 195          1HA       GLY 195  -9.914 -18.675  -2.214
  545   2HA   GLY 195          2HA       GLY 195 -11.195 -18.914  -1.011
  546    H    GLU 196           H        GLU 196  -9.176 -15.958  -1.069
  547    HA   GLU 196           HA       GLU 196 -11.451 -14.518  -2.350
  548   1HB   GLU 196          1HB       GLU 196 -11.329 -14.040   0.093
  549   2HB   GLU 196          2HB       GLU 196  -9.721 -13.361  -0.137
  550   1HG   GLU 196          1HG       GLU 196 -11.431 -11.595  -0.124
  551   2HG   GLU 196          2HG       GLU 196 -10.676 -11.676  -1.712
  552    H    ASN 197           H        ASN 197 -10.566 -14.788  -4.315
  553    HA   ASN 197           HA       ASN 197  -7.808 -13.893  -4.858
  554   1HB   ASN 197          1HB       ASN 197  -9.072 -16.025  -5.800
  555   2HB   ASN 197          2HB       ASN 197  -9.700 -14.892  -6.997
  556   2HD2  ASN 197          1HD2      ASN 197  -7.559 -13.282  -7.868
  557   1HD2  ASN 197          2HD2      ASN 197  -6.186 -14.334  -8.178
  558    H    PHE 198           H        PHE 198  -7.362 -12.045  -5.784
  559    HA   PHE 198           HA       PHE 198  -9.345  -9.990  -6.410
  560   1HB   PHE 198          2HB       PHE 198  -7.418  -8.571  -6.686
  561   2HB   PHE 198          1HB       PHE 198  -6.328  -9.964  -6.710
  562    HD1  PHE 198           HD1      PHE 198  -8.890  -8.218  -4.567
  563    HD2  PHE 198           HD2      PHE 198  -5.453 -10.834  -4.660
  564    HE1  PHE 198           HE1      PHE 198  -8.873  -8.296  -2.105
  565    HE2  PHE 198           HE2      PHE 198  -5.477 -10.943  -2.205
  566    HZ   PHE 198           HZ       PHE 198  -7.161  -9.635  -0.897
  567    H    THR 199           H        THR 199  -8.993  -8.689  -8.471
  568    HA   THR 199           HA       THR 199  -8.240 -10.285 -10.836
  569    HB   THR 199           HB       THR 199 -10.029  -8.906 -11.990
  570    HG1  THR 199           HG1      THR 199 -11.663  -8.054 -10.548
  571   1HG2  THR 199          3HG2      THR 199 -10.406 -11.285 -11.370
  572   2HG2  THR 199          1HG2      THR 199 -11.033 -10.769  -9.797
  573   3HG2  THR 199          2HG2      THR 199 -11.903 -10.333 -11.282
  574    H    GLU 200           H        GLU 200  -7.631  -8.648 -12.671
  575    HA   GLU 200           HA       GLU 200  -5.389  -7.295 -11.726
  576   1HB   GLU 200          1HB       GLU 200  -5.781  -8.178 -14.019
  577   2HB   GLU 200          2HB       GLU 200  -6.898  -6.864 -14.350
  578   1HG   GLU 200          1HG       GLU 200  -4.414  -5.712 -13.349
  579   2HG   GLU 200          2HG       GLU 200  -4.005  -6.936 -14.529
  580    H    THR 201           H        THR 201  -8.536  -5.756 -12.743
  581    HA   THR 201           HA       THR 201  -7.677  -3.131 -12.251
  582    HB   THR 201           HB       THR 201 -10.464  -4.315 -12.088
  583    HG1  THR 201           HG1      THR 201 -10.541  -3.784 -14.281
  584   1HG2  THR 201          1HG2      THR 201  -9.526  -1.448 -12.561
  585   2HG2  THR 201          2HG2      THR 201 -11.194  -2.019 -12.828
  586   3HG2  THR 201          3HG2      THR 201 -10.506  -2.036 -11.210
  587    H    ASP 202           H        ASP 202  -8.951  -5.578  -9.958
  588    HA   ASP 202           HA       ASP 202  -9.319  -3.744  -7.757
  589   1HB   ASP 202          1HB       ASP 202 -10.002  -6.388  -8.153
  590   2HB   ASP 202          2HB       ASP 202  -8.535  -6.626  -7.276
  591    H    VAL 203           H        VAL 203  -6.624  -5.480  -9.108
  592    HA   VAL 203           HA       VAL 203  -4.914  -5.264  -6.732
  593    HB   VAL 203           HB       VAL 203  -4.378  -6.094  -9.625
  594   1HG1  VAL 203          3HG1      VAL 203  -2.419  -5.755  -7.340
  595   2HG1  VAL 203          1HG1      VAL 203  -2.077  -6.738  -8.801
  596   3HG1  VAL 203          2HG1      VAL 203  -2.344  -5.001  -8.927
  597   1HG2  VAL 203          1HG2      VAL 203  -5.576  -7.699  -8.091
  598   2HG2  VAL 203          2HG2      VAL 203  -4.015  -8.274  -8.675
  599   3HG2  VAL 203          3HG2      VAL 203  -4.168  -7.656  -7.013
  600    H    LYS 204           H        LYS 204  -5.190  -3.680  -9.915
  601    HA   LYS 204           HA       LYS 204  -3.277  -1.660  -9.501
  602   1HB   LYS 204          1HB       LYS 204  -5.713  -2.098 -11.160
  603   2HB   LYS 204          2HB       LYS 204  -5.159  -0.464 -11.086
  604   1HG   LYS 204          1HG       LYS 204  -3.310  -0.937 -12.383
  605   2HG   LYS 204          2HG       LYS 204  -3.011  -2.476 -11.601
  606   1HD   LYS 204          2HD       LYS 204  -4.858  -3.509 -12.876
  607   2HD   LYS 204          1HD       LYS 204  -3.527  -2.961 -13.874
  608   1HE   LYS 204          2HE       LYS 204  -6.106  -1.387 -13.456
  609   2HE   LYS 204          1HE       LYS 204  -5.826  -2.505 -14.804
  610   1HZ   LYS 204          1HZ       LYS 204  -3.967  -1.142 -15.484
  611   2HZ   LYS 204          2HZ       LYS 204  -5.368  -0.253 -15.402
  612   3HZ   LYS 204          3HZ       LYS 204  -4.289  -0.068 -14.220
  613    H    MET 205           H        MET 205  -6.780  -1.653  -8.586
  614    HA   MET 205           HA       MET 205  -6.748   0.993  -7.484
  615   1HB   MET 205          1HB       MET 205  -8.461  -1.467  -7.027
  616   2HB   MET 205          2HB       MET 205  -8.700   0.024  -6.088
  617   1HG   MET 205          1HG       MET 205  -9.076   1.261  -8.183
  618   2HG   MET 205          2HG       MET 205  -8.949  -0.244  -9.097
  619   1HE   MET 205          3HE       MET 205 -11.417   1.289  -9.729
  620   2HE   MET 205          1HE       MET 205 -12.801   1.245  -8.616
  621   3HE   MET 205          2HE       MET 205 -11.371   2.211  -8.204
  622    H    MET 206           H        MET 206  -6.049  -2.226  -5.931
  623    HA   MET 206           HA       MET 206  -5.400  -1.150  -3.354
  624   1HB   MET 206          1HB       MET 206  -4.847  -3.704  -4.840
  625   2HB   MET 206          2HB       MET 206  -3.730  -3.286  -3.563
  626   1HG   MET 206          1HG       MET 206  -5.070  -3.939  -1.987
  627   2HG   MET 206          2HG       MET 206  -6.342  -2.867  -2.541
  628   1HE   MET 206          3HE       MET 206  -4.674  -6.369  -3.148
  629   2HE   MET 206          1HE       MET 206  -5.953  -7.247  -4.012
  630   3HE   MET 206          2HE       MET 206  -5.084  -5.911  -4.799
  631    H    GLU 207           H        GLU 207  -3.283  -1.695  -6.274
  632    HA   GLU 207           HA       GLU 207  -0.857  -1.034  -5.119
  633   1HB   GLU 207          1HB       GLU 207  -1.839  -0.423  -7.941
  634   2HB   GLU 207          2HB       GLU 207  -0.196  -0.181  -7.381
  635   1HG   GLU 207          1HG       GLU 207  -0.029  -2.634  -6.890
  636   2HG   GLU 207          2HG       GLU 207  -1.593  -2.878  -7.552
  637    H    ARG 208           H        ARG 208  -3.265   1.148  -6.572
  638    HA   ARG 208           HA       ARG 208  -1.952   3.571  -6.058
  639   1HB   ARG 208          1HB       ARG 208  -4.480   2.752  -7.049
  640   2HB   ARG 208          2HB       ARG 208  -4.873   3.736  -5.682
  641   1HG   ARG 208          1HG       ARG 208  -3.198   4.427  -8.093
  642   2HG   ARG 208          2HG       ARG 208  -4.730   5.112  -7.665
  643   1HD   ARG 208          1HD       ARG 208  -3.336   6.017  -5.543
  644   2HD   ARG 208          2HD       ARG 208  -1.975   5.721  -6.620
  645    HE   ARG 208           HE       ARG 208  -4.236   7.228  -7.755
  646   1HH1  ARG 208          1HH1      ARG 208  -3.852   9.235  -8.600
  647   2HH1  ARG 208          2HH1      ARG 208  -2.334  10.045  -8.408
  648   1HH2  ARG 208          1HH2      ARG 208  -0.899   7.519  -6.349
  649   2HH2  ARG 208          2HH2      ARG 208  -0.675   9.077  -7.008
  650    H    VAL 209           H        VAL 209  -4.348   1.892  -3.940
  651    HA   VAL 209           HA       VAL 209  -4.278   3.866  -1.920
  652    HB   VAL 209           HB       VAL 209  -5.175   0.980  -2.139
  653   1HG1  VAL 209          3HG1      VAL 209  -4.912   2.355   0.544
  654   2HG1  VAL 209          1HG1      VAL 209  -6.023   1.002   0.225
  655   3HG1  VAL 209          2HG1      VAL 209  -4.282   0.768   0.060
  656   1HG2  VAL 209          2HG2      VAL 209  -6.500   3.557  -1.209
  657   2HG2  VAL 209          3HG2      VAL 209  -6.592   2.839  -2.825
  658   3HG2  VAL 209          1HG2      VAL 209  -7.323   2.020  -1.430
  659    H    VAL 210           H        VAL 210  -2.325   0.902  -2.371
  660    HA   VAL 210           HA       VAL 210  -0.966   1.068   0.135
  661    HB   VAL 210           HB       VAL 210  -0.278  -0.355  -2.478
  662   1HG1  VAL 210          2HG1      VAL 210   1.718  -0.053  -0.932
  663   2HG1  VAL 210          3HG1      VAL 210   0.830  -1.014   0.275
  664   3HG1  VAL 210          1HG1      VAL 210   1.225  -1.706  -1.288
  665   1HG2  VAL 210          2HG2      VAL 210  -1.979  -1.110  -0.096
  666   2HG2  VAL 210          3HG2      VAL 210  -2.189  -1.539  -1.786
  667   3HG2  VAL 210          1HG2      VAL 210  -1.010  -2.376  -0.835
  668    H    GLU 211           H        GLU 211  -0.143   2.224  -3.183
  669    HA   GLU 211           HA       GLU 211   2.393   3.328  -2.727
  670   1HB   GLU 211          1HB       GLU 211   1.405   3.000  -4.915
  671   2HB   GLU 211          2HB       GLU 211   0.073   4.031  -4.544
  672   1HG   GLU 211          1HG       GLU 211   2.386   5.680  -4.235
  673   2HG   GLU 211          2HG       GLU 211   2.641   4.708  -5.684
  674    H    GLN 212           H        GLN 212  -0.790   4.931  -2.581
  675    HA   GLN 212           HA       GLN 212  -0.064   7.457  -1.692
  676   1HB   GLN 212          1HB       GLN 212  -2.514   5.758  -1.351
  677   2HB   GLN 212          2HB       GLN 212  -2.457   7.384  -0.703
  678   1HG   GLN 212          1HG       GLN 212  -1.908   6.675  -3.632
  679   2HG   GLN 212          2HG       GLN 212  -3.432   7.234  -2.960
  680   2HE2  GLN 212          1HE2      GLN 212  -0.266   8.213  -4.045
  681   1HE2  GLN 212          2HE2      GLN 212  -0.473   9.947  -3.731
  682    H    MET 213           H        MET 213  -0.934   4.644   0.424
  683    HA   MET 213           HA       MET 213  -0.317   6.004   2.888
  684   1HB   MET 213          1HB       MET 213  -0.423   3.070   2.122
  685   2HB   MET 213          2HB       MET 213   0.038   3.615   3.741
  686   1HG   MET 213          1HG       MET 213  -2.182   4.842   3.849
  687   2HG   MET 213          2HG       MET 213  -2.647   4.000   2.388
  688   1HE   MET 213          2HE       MET 213  -2.544   1.545   2.172
  689   2HE   MET 213          3HE       MET 213  -3.420   0.577   3.386
  690   3HE   MET 213          1HE       MET 213  -4.154   2.062   2.716
  691    H    CYS 214           H        CYS 214   1.734   4.127   0.603
  692    HA   CYS 214           HA       CYS 214   3.887   3.872   2.471
  693   1HB   CYS 214          1HB       CYS 214   3.315   2.379   0.480
  694   2HB   CYS 214          2HB       CYS 214   3.990   3.636  -0.552
  695    H    ILE 215           H        ILE 215   3.255   6.156  -0.222
  696    HA   ILE 215           HA       ILE 215   5.653   7.649  -0.173
  697    HB   ILE 215           HB       ILE 215   2.734   8.392  -0.641
  698   1HG1  ILE 215          1HG1      ILE 215   5.064   8.283  -2.614
  699   2HG1  ILE 215          2HG1      ILE 215   4.045   6.894  -2.266
  700   1HG2  ILE 215          3HG2      ILE 215   5.138  10.252  -0.941
  701   2HG2  ILE 215          1HG2      ILE 215   3.518  10.580  -1.583
  702   3HG2  ILE 215          2HG2      ILE 215   3.760  10.460   0.147
  703   1HD1  ILE 215          3HD1      ILE 215   2.040   8.125  -3.037
  704   2HD1  ILE 215          1HD1      ILE 215   3.063   9.510  -3.472
  705   3HD1  ILE 215          2HD1      ILE 215   3.281   7.969  -4.296
  706    H    THR 216           H        THR 216   2.721   7.923   1.849
  707    HA   THR 216           HA       THR 216   3.713   9.937   3.572
  708    HB   THR 216           HB       THR 216   1.667   7.790   4.312
  709    HG1  THR 216           HG1      THR 216   0.945   8.500   2.360
  710   1HG2  THR 216          3HG2      THR 216   1.930  10.735   5.051
  711   2HG2  THR 216          1HG2      THR 216   0.629   9.633   5.561
  712   3HG2  THR 216          2HG2      THR 216   2.288   9.354   6.109
  713    H    GLN 217           H        GLN 217   3.747   6.275   4.120
  714    HA   GLN 217           HA       GLN 217   4.971   6.647   6.649
  715   1HB   GLN 217          1HB       GLN 217   5.276   4.360   6.816
  716   2HB   GLN 217          2HB       GLN 217   3.879   4.522   5.801
  717   1HG   GLN 217          2HG       GLN 217   5.431   4.097   3.823
  718   2HG   GLN 217          1HG       GLN 217   5.028   2.778   4.899
  719   2HE2  GLN 217          1HE2      GLN 217   7.514   4.394   6.634
  720   1HE2  GLN 217          2HE2      GLN 217   8.823   3.577   5.807
  721    H    TYR 218           H        TYR 218   6.490   6.373   3.414
  722    HA   TYR 218           HA       TYR 218   9.173   6.138   4.311
  723   1HB   TYR 218          1HB       TYR 218   8.658   5.700   2.007
  724   2HB   TYR 218          2HB       TYR 218   7.890   7.268   1.802
  725    HD1  TYR 218           HD1      TYR 218   9.109   8.837   0.562
  726    HD2  TYR 218           HD2      TYR 218  11.245   5.963   2.988
  727    HE1  TYR 218           HE1      TYR 218  11.269   9.800  -0.184
  728    HE2  TYR 218           HE2      TYR 218  13.388   6.938   2.251
  729    HH   TYR 218           HH       TYR 218  14.103   9.370   1.438
  730    H    GLU 219           H        GLU 219   7.285   9.038   3.280
  731    HA   GLU 219           HA       GLU 219   9.118  11.027   3.989
  732   1HB   GLU 219          1HB       GLU 219   6.098  10.833   3.838
  733   2HB   GLU 219          2HB       GLU 219   6.775  12.259   4.555
  734   1HG   GLU 219          2HG       GLU 219   6.358  12.591   2.178
  735   2HG   GLU 219          1HG       GLU 219   7.340  11.196   1.753
  736    H    ARG 220           H        ARG 220   6.775   9.364   6.084
  737    HA   ARG 220           HA       ARG 220   7.374  10.929   8.430
  738   1HB   ARG 220          1HB       ARG 220   6.160   8.157   8.069
  739   2HB   ARG 220          2HB       ARG 220   6.316   8.970   9.630
  740   1HG   ARG 220          1HG       ARG 220   5.008  10.899   8.734
  741   2HG   ARG 220          2HG       ARG 220   4.764  10.070   7.237
  742   1HD   ARG 220          1HD       ARG 220   3.525   8.280   8.296
  743   2HD   ARG 220          2HD       ARG 220   3.951   8.863   9.911
  744    HE   ARG 220           HE       ARG 220   1.735   9.683   8.350
  745   1HH1  ARG 220          1HH1      ARG 220   0.430  11.237   9.008
  746   2HH1  ARG 220          2HH1      ARG 220   0.847  12.395  10.256
  747   1HH2  ARG 220          1HH2      ARG 220   4.171  11.136  10.543
  748   2HH2  ARG 220          2HH2      ARG 220   3.123  12.369  11.096
  749    H    GLU 221           H        GLU 221   8.772   7.808   7.247
  750    HA   GLU 221           HA       GLU 221  10.462   7.497   9.609
  751   1HB   GLU 221          1HB       GLU 221  10.626   6.328   6.800
  752   2HB   GLU 221          2HB       GLU 221  11.793   5.962   8.065
  753   1HG   GLU 221          1HG       GLU 221   8.811   5.365   8.198
  754   2HG   GLU 221          2HG       GLU 221  10.089   4.199   7.861
  755    H    SER 222           H        SER 222  10.911   9.077   6.398
  756    HA   SER 222           HA       SER 222  13.594   9.782   6.693
  757   1HB   SER 222          1HB       SER 222  11.273  11.184   5.317
  758   2HB   SER 222          2HB       SER 222  12.969  11.630   5.076
  759    HG   SER 222           HG       SER 222  13.113  10.053   3.734
  760    H    GLN 223           H        GLN 223  10.762  11.211   8.353
  761    HA   GLN 223           HA       GLN 223  12.171  13.594   9.205
  762   1HB   GLN 223          1HB       GLN 223   9.773  12.225  10.498
  763   2HB   GLN 223          2HB       GLN 223  10.439  13.783  10.965
  764   1HG   GLN 223          1HG       GLN 223  10.015  14.650   8.660
  765   2HG   GLN 223          2HG       GLN 223   9.272  13.111   8.242
  766   2HE2  GLN 223          1HE2      GLN 223   8.225  16.037   8.532
  767   1HE2  GLN 223          2HE2      GLN 223   6.689  15.734   9.292
  768    H    ALA 224           H        ALA 224  11.960  10.236  10.486
  769    HA   ALA 224           HA       ALA 224  13.494  10.967  12.868
  770   1HB   ALA 224          1HB       ALA 224  12.550   8.279  11.773
  771   2HB   ALA 224          3HB       ALA 224  11.858   9.215  13.126
  772   3HB   ALA 224          2HB       ALA 224  13.461   8.496  13.286
  773    H    TYR 225           H        TYR 225  14.186   9.687   9.603
  774    HA   TYR 225           HA       TYR 225  16.909   8.937  10.057
  775   1HB   TYR 225          1HB       TYR 225  15.748   8.614   7.904
  776   2HB   TYR 225          2HB       TYR 225  15.649  10.348   7.663
  777    HD1  TYR 225           HD1      TYR 225  17.854   7.416   7.487
  778    HD2  TYR 225           HD2      TYR 225  17.642  11.724   7.151
  779    HE1  TYR 225           HE1      TYR 225  20.074   7.452   6.344
  780    HE2  TYR 225           HE2      TYR 225  19.853  11.752   6.059
  781    HH   TYR 225           HH       TYR 225  21.466  10.427   5.024
  782    H    TYR 226           H        TYR 226  15.464  12.179   9.441
  783    HA   TYR 226           HA       TYR 226  17.932  13.586   9.666
  784   1HB   TYR 226          1HB       TYR 226  15.621  14.367   8.813
  785   2HB   TYR 226          2HB       TYR 226  15.226  14.646  10.504
  786    HD1  TYR 226           HD1      TYR 226  15.264  16.939  11.021
  787    HD2  TYR 226           HD2      TYR 226  18.201  15.382   8.246
  788    HE1  TYR 226           HE1      TYR 226  16.123  19.192  10.671
  789    HE2  TYR 226           HE2      TYR 226  19.113  17.630   7.949
  790    HH   TYR 226           HH       TYR 226  18.730  19.885   8.302
  791    H    GLN 227           H        GLN 227  15.743  12.288  12.183
  792    HA   GLN 227           HA       GLN 227  16.851  13.892  14.294
  793   1HB   GLN 227          1HB       GLN 227  15.323  12.920  15.656
  794   2HB   GLN 227          2HB       GLN 227  14.553  12.602  14.142
  795   1HG   GLN 227          1HG       GLN 227  14.516  10.386  14.612
  796   2HG   GLN 227          2HG       GLN 227  16.239  10.297  14.795
  797   2HE2  GLN 227          1HE2      GLN 227  13.232  10.135  16.414
  798   1HE2  GLN 227          2HE2      GLN 227  13.861  10.162  18.046
  799    H    ARG 228           H        ARG 228  18.003  11.108  12.657
  800    HA   ARG 228           HA       ARG 228  19.595  10.062  14.852
  801   1HB   ARG 228          1HB       ARG 228  19.725   9.682  11.826
  802   2HB   ARG 228          2HB       ARG 228  20.820   8.869  12.894
  803   1HG   ARG 228          1HG       ARG 228  18.064   8.581  13.869
  804   2HG   ARG 228          2HG       ARG 228  18.173   8.073  12.197
  805   1HD   ARG 228          1HD       ARG 228  20.312   7.081  14.088
  806   2HD   ARG 228          2HD       ARG 228  18.674   6.476  14.324
  807    HE   ARG 228           HE       ARG 228  19.067   6.166  11.629
  808   1HH1  ARG 228          1HH1      ARG 228  19.068   3.885  11.038
  809   2HH1  ARG 228          2HH1      ARG 228  20.084   2.790  11.901
  810   1HH2  ARG 228          1HH2      ARG 228  21.164   5.194  14.279
  811   2HH2  ARG 228          2HH2      ARG 228  21.253   3.526  13.819

  No H/Q in entry =         811