*HEADER    PRION PROTEIN                           08-MAY-00   1E1J
*TITLE     HUMAN PRION PROTEIN VARIANT M166V
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: PRION PROTEIN;
*COMPND   3 CHAIN: A;
*COMPND   4 FRAGMENT: GLOBULAR DOMAIN RESIDUES 125-228;
*COMPND   5 ENGINEERED: YES;
*COMPND   6 MUTATION: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE   3 ORGANISM_COMMON: HUMAN;
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI
*KEYWDS    PRION PROTEIN
*EXPDTA    NMR, 1 STRUCTURES
*AUTHOR    L.CALZOLAI,D.A.LYSEK,P.GUNTERT,C.VON SCHROETTER,R.ZAHN,
*AUTHOR   2 R.RIEK,K.WUTHRICH




  Entry H atom name         Submitted Coord H atom name
    1    H    LEU 125           H        LEU 125   4.239 -14.640   0.067
    2    HA   LEU 125           HA       LEU 125   6.256 -12.649  -0.814
    3   1HB   LEU 125          1HB       LEU 125   4.294 -11.391  -0.487
    4   2HB   LEU 125          2HB       LEU 125   5.424 -10.995   0.775
    5    HG   LEU 125           HG       LEU 125   3.496 -13.116   1.591
    6   1HD1  LEU 125          1HD1      LEU 125   4.163 -10.394   2.794
    7   2HD1  LEU 125          2HD1      LEU 125   3.167 -11.654   3.552
    8   3HD1  LEU 125          3HD1      LEU 125   4.887 -11.942   3.263
    9   1HD2  LEU 125          1HD2      LEU 125   2.105 -11.755   0.006
   10   2HD2  LEU 125          2HD2      LEU 125   1.526 -11.733   1.679
   11   3HD2  LEU 125          3HD2      LEU 125   2.401 -10.337   1.022
   12    H    GLY 126           H        GLY 126   6.570 -15.381   0.243
   13   1HA   GLY 126          1HA       GLY 126   6.699 -15.731   2.904
   14   2HA   GLY 126          2HA       GLY 126   7.809 -16.527   1.792
   15    H    GLY 127           H        GLY 127   9.302 -14.149   1.059
   16   1HA   GLY 127          1HA       GLY 127  11.065 -13.956   3.436
   17   2HA   GLY 127          2HA       GLY 127  11.473 -13.607   1.754
   18    H    TYR 128           H        TYR 128   8.510 -12.070   2.775
   19    HA   TYR 128           HA       TYR 128   9.858  -9.444   2.548
   20   1HB   TYR 128          1HB       TYR 128   6.954 -10.402   2.545
   21   2HB   TYR 128          2HB       TYR 128   7.413  -8.725   2.675
   22    HD1  TYR 128           HD1      TYR 128   8.802 -11.466   0.351
   23    HD2  TYR 128           HD2      TYR 128   6.787  -7.703   0.744
   24    HE1  TYR 128           HE1      TYR 128   9.180 -11.009  -2.016
   25    HE2  TYR 128           HE2      TYR 128   7.391  -7.091  -1.556
   26    HH   TYR 128           HH       TYR 128   8.783  -9.484  -3.835
   27    H    MET 129           H        MET 129   9.923  -7.992   4.180
   28    HA   MET 129           HA       MET 129   9.176  -8.772   6.927
   29   1HB   MET 129          1HB       MET 129  10.395  -6.847   7.665
   30   2HB   MET 129          2HB       MET 129  11.407  -7.790   6.603
   31   1HG   MET 129          1HG       MET 129  11.781  -6.048   5.286
   32   2HG   MET 129          2HG       MET 129  10.061  -5.784   5.005
   33   1HE   MET 129          1HE       MET 129  11.871  -3.426   4.709
   34   2HE   MET 129          2HE       MET 129  12.318  -2.481   6.151
   35   3HE   MET 129          3HE       MET 129  13.107  -4.038   5.829
   36    H    LEU 130           H        LEU 130   8.439  -6.304   7.932
   37    HA   LEU 130           HA       LEU 130   6.099  -5.303   6.454
   38   1HB   LEU 130          1HB       LEU 130   5.089  -7.099   7.687
   39   2HB   LEU 130          2HB       LEU 130   6.073  -6.809   9.085
   40    HG   LEU 130           HG       LEU 130   4.667  -4.371   8.798
   41   1HD1  LEU 130          1HD1      LEU 130   3.164  -5.531   7.148
   42   2HD1  LEU 130          2HD1      LEU 130   2.690  -6.638   8.480
   43   3HD1  LEU 130          3HD1      LEU 130   2.374  -4.914   8.599
   44   1HD2  LEU 130          1HD2      LEU 130   4.126  -6.815  10.536
   45   2HD2  LEU 130          2HD2      LEU 130   5.162  -5.420  10.911
   46   3HD2  LEU 130          3HD2      LEU 130   3.409  -5.220  10.802
   47    H    GLY 131           H        GLY 131   6.529  -3.119   6.476
   48   1HA   GLY 131          1HA       GLY 131   8.462  -1.970   8.333
   49   2HA   GLY 131          2HA       GLY 131   7.577  -1.158   7.026
   50    H    SER 132           H        SER 132   7.605   0.419   9.077
   51    HA   SER 132           HA       SER 132   6.023  -0.294  11.278
   52   1HB   SER 132          1HB       SER 132   7.775   1.320  11.396
   53   2HB   SER 132          2HB       SER 132   6.265   2.100  11.878
   54    HG   SER 132           HG       SER 132   7.984   2.929  10.115
   55    H    ALA 133           H        ALA 133   4.174   0.703  12.032
   56    HA   ALA 133           HA       ALA 133   1.944   0.978  10.138
   57   1HB   ALA 133          1HB       ALA 133   1.628  -0.143  12.297
   58   2HB   ALA 133          2HB       ALA 133   0.623   1.303  12.216
   59   3HB   ALA 133          3HB       ALA 133   2.120   1.344  13.162
   60    H    MET 134           H        MET 134   0.463   2.889  10.415
   61    HA   MET 134           HA       MET 134   1.522   5.368  11.419
   62   1HB   MET 134          1HB       MET 134   2.630   5.418   9.226
   63   2HB   MET 134          2HB       MET 134   1.419   6.675   9.368
   64   1HG   MET 134          1HG       MET 134   0.141   4.390   8.171
   65   2HG   MET 134          2HG       MET 134   0.390   6.006   7.546
   66   1HE   MET 134          1HE       MET 134   1.330   2.346   7.544
   67   2HE   MET 134          2HE       MET 134   2.831   2.228   6.611
   68   3HE   MET 134          3HE       MET 134   2.881   2.873   8.258
   69    H    SER 135           H        SER 135  -0.293   7.117  11.213
   70    HA   SER 135           HA       SER 135  -2.929   5.923  11.593
   71   1HB   SER 135          1HB       SER 135  -2.662   7.943  12.727
   72   2HB   SER 135          2HB       SER 135  -1.793   8.699  11.403
   73    HG   SER 135           HG       SER 135  -3.862   8.713  10.235
   74    H    ARG 136           H        ARG 136  -4.666   6.028  10.089
   75    HA   ARG 136           HA       ARG 136  -4.277   5.528   7.404
   76   1HB   ARG 136          1HB       ARG 136  -6.604   6.516   7.040
   77   2HB   ARG 136          2HB       ARG 136  -6.463   5.113   8.060
   78   1HG   ARG 136          1HG       ARG 136  -6.440   7.821   9.408
   79   2HG   ARG 136          2HG       ARG 136  -7.956   7.243   8.718
   80   1HD   ARG 136          1HD       ARG 136  -8.001   5.287  10.073
   81   2HD   ARG 136          2HD       ARG 136  -6.324   5.505  10.592
   82    HE   ARG 136           HE       ARG 136  -7.879   7.788  11.327
   83   1HH1  ARG 136          1HH1      ARG 136  -7.448   4.350  12.239
   84   2HH1  ARG 136          2HH1      ARG 136  -7.681   4.645  13.927
   85   1HH2  ARG 136          1HH2      ARG 136  -8.557   8.009  13.584
   86   2HH2  ARG 136          2HH2      ARG 136  -8.252   6.705  14.696
   87    HA   PRO 137           HA       PRO 137  -3.172   9.691   5.912
   88   1HB   PRO 137          1HB       PRO 137  -2.604   9.089   3.337
   89   2HB   PRO 137          2HB       PRO 137  -1.555   8.493   4.665
   90   1HG   PRO 137          1HG       PRO 137  -2.152   6.446   3.501
   91   2HG   PRO 137          2HG       PRO 137  -3.838   7.002   3.306
   92   1HD   PRO 137          1HD       PRO 137  -4.171   5.784   5.235
   93   2HD   PRO 137          2HD       PRO 137  -2.499   6.043   5.819
   94    H    ILE 138           H        ILE 138  -4.076  11.043   4.054
   95    HA   ILE 138           HA       ILE 138  -6.862  10.270   3.299
   96    HB   ILE 138           HB       ILE 138  -5.783  13.084   3.423
   97   1HG1  ILE 138          1HG1      ILE 138  -5.588  12.276   5.700
   98   2HG1  ILE 138          2HG1      ILE 138  -6.827  13.498   5.531
   99   1HG2  ILE 138          1HG2      ILE 138  -8.613  11.957   3.369
  100   2HG2  ILE 138          2HG2      ILE 138  -8.192  13.681   3.500
  101   3HG2  ILE 138          3HG2      ILE 138  -7.778  12.769   2.042
  102   1HD1  ILE 138          1HD1      ILE 138  -7.390  10.508   5.734
  103   2HD1  ILE 138          2HD1      ILE 138  -7.378  11.638   7.098
  104   3HD1  ILE 138          3HD1      ILE 138  -8.568  11.856   5.814
  105    H    ILE 139           H        ILE 139  -7.014   9.810   1.133
  106    HA   ILE 139           HA       ILE 139  -4.864  10.740  -0.702
  107    HB   ILE 139           HB       ILE 139  -6.726   8.323  -0.820
  108   1HG1  ILE 139          1HG1      ILE 139  -4.722   7.014  -1.147
  109   2HG1  ILE 139          2HG1      ILE 139  -3.710   8.461  -1.160
  110   1HG2  ILE 139          1HG2      ILE 139  -4.983   9.528  -3.030
  111   2HG2  ILE 139          2HG2      ILE 139  -5.729   7.918  -3.095
  112   3HG2  ILE 139          3HG2      ILE 139  -6.755   9.343  -3.047
  113   1HD1  ILE 139          1HD1      ILE 139  -5.289   7.533   1.268
  114   2HD1  ILE 139          2HD1      ILE 139  -3.621   7.041   0.918
  115   3HD1  ILE 139          3HD1      ILE 139  -3.978   8.747   1.211
  116    H    HIS 140           H        HIS 140  -5.507  12.522  -1.742
  117    HA   HIS 140           HA       HIS 140  -8.402  13.214  -1.779
  118   1HB   HIS 140          1HB       HIS 140  -5.933  14.913  -2.290
  119   2HB   HIS 140          2HB       HIS 140  -7.618  15.442  -2.317
  120    HD1  HIS 140           HD1      HIS 140  -4.867  14.427   0.158
  121    HD2  HIS 140           HD2      HIS 140  -8.808  15.954   0.039
  122    HE1  HIS 140           HE1      HIS 140  -5.410  15.249   2.508
  123    H    PHE 141           H        PHE 141  -8.839  11.652  -3.434
  124    HA   PHE 141           HA       PHE 141  -7.540  11.155  -5.761
  125   1HB   PHE 141          1HB       PHE 141 -10.565  11.313  -5.443
  126   2HB   PHE 141          2HB       PHE 141  -9.700  10.384  -6.656
  127    HD1  PHE 141           HD1      PHE 141 -10.482  10.634  -3.032
  128    HD2  PHE 141           HD2      PHE 141  -8.675   8.295  -6.159
  129    HE1  PHE 141           HE1      PHE 141 -10.290   8.704  -1.478
  130    HE2  PHE 141           HE2      PHE 141  -8.477   6.364  -4.612
  131    HZ   PHE 141           HZ       PHE 141  -9.298   6.577  -2.256
  132    H    GLY 142           H        GLY 142  -9.834  13.824  -5.303
  133   1HA   GLY 142          1HA       GLY 142  -9.348  15.740  -7.093
  134   2HA   GLY 142          2HA       GLY 142  -9.756  14.431  -8.199
  135    H    SER 143           H        SER 143 -11.609  13.573  -5.687
  136    HA   SER 143           HA       SER 143 -13.855  15.388  -6.155
  137   1HB   SER 143          1HB       SER 143 -13.763  12.395  -6.776
  138   2HB   SER 143          2HB       SER 143 -15.279  13.289  -6.573
  139    HG   SER 143           HG       SER 143 -13.987  13.023  -8.772
  140    H    ASP 144           H        ASP 144 -15.209  15.482  -4.432
  141    HA   ASP 144           HA       ASP 144 -14.529  14.496  -1.840
  142   1HB   ASP 144          1HB       ASP 144 -17.316  15.209  -2.803
  143   2HB   ASP 144          2HB       ASP 144 -16.704  15.223  -1.145
  144    H    TYR 145           H        TYR 145 -16.483  13.295  -4.528
  145    HA   TYR 145           HA       TYR 145 -17.980  11.355  -3.162
  146   1HB   TYR 145          1HB       TYR 145 -18.403  12.024  -5.493
  147   2HB   TYR 145          2HB       TYR 145 -16.940  11.193  -6.027
  148    HD1  TYR 145           HD1      TYR 145 -20.157  10.671  -4.148
  149    HD2  TYR 145           HD2      TYR 145 -17.022   8.837  -6.514
  150    HE1  TYR 145           HE1      TYR 145 -21.335   8.521  -4.033
  151    HE2  TYR 145           HE2      TYR 145 -18.254   6.706  -6.462
  152    HH   TYR 145           HH       TYR 145 -21.039   6.091  -4.436
  153    H    GLU 146           H        GLU 146 -14.802  10.924  -4.783
  154    HA   GLU 146           HA       GLU 146 -14.524   8.149  -4.065
  155   1HB   GLU 146          1HB       GLU 146 -12.637  10.293  -5.003
  156   2HB   GLU 146          2HB       GLU 146 -12.150   8.587  -4.829
  157   1HG   GLU 146          1HG       GLU 146 -14.542   8.966  -6.410
  158   2HG   GLU 146          2HG       GLU 146 -13.306  10.021  -7.018
  159    H    ASP 147           H        ASP 147 -13.709  11.232  -2.532
  160    HA   ASP 147           HA       ASP 147 -11.787  10.293  -0.606
  161   1HB   ASP 147          1HB       ASP 147 -11.993  12.655  -1.164
  162   2HB   ASP 147          2HB       ASP 147 -13.682  12.686  -0.660
  163    H    ARG 148           H        ARG 148 -15.264  10.696  -0.686
  164    HA   ARG 148           HA       ARG 148 -15.802   9.787   2.041
  165   1HB   ARG 148          1HB       ARG 148 -17.475  10.312  -0.413
  166   2HB   ARG 148          2HB       ARG 148 -18.076   9.080   0.683
  167   1HG   ARG 148          1HG       ARG 148 -19.113  10.883   1.522
  168   2HG   ARG 148          2HG       ARG 148 -17.715  10.803   2.585
  169   1HD   ARG 148          1HD       ARG 148 -16.593  12.580   1.281
  170   2HD   ARG 148          2HD       ARG 148 -17.928  12.623   0.131
  171    HE   ARG 148           HE       ARG 148 -17.756  13.838   2.715
  172   1HH1  ARG 148          1HH1      ARG 148 -20.154  12.565   0.367
  173   2HH1  ARG 148          2HH1      ARG 148 -21.527  13.136   1.228
  174   1HH2  ARG 148          1HH2      ARG 148 -19.636  14.458   3.940
  175   2HH2  ARG 148          2HH2      ARG 148 -21.221  14.323   3.201
  176    H    TYR 149           H        TYR 149 -15.623   8.287  -1.134
  177    HA   TYR 149           HA       TYR 149 -16.743   5.769  -0.482
  178   1HB   TYR 149          1HB       TYR 149 -15.992   6.890  -2.776
  179   2HB   TYR 149          2HB       TYR 149 -14.497   6.035  -2.481
  180    HD1  TYR 149           HD1      TYR 149 -14.887   3.384  -1.844
  181    HD2  TYR 149           HD2      TYR 149 -17.560   5.905  -4.127
  182    HE1  TYR 149           HE1      TYR 149 -15.946   1.390  -2.826
  183    HE2  TYR 149           HE2      TYR 149 -18.647   3.930  -5.062
  184    HH   TYR 149           HH       TYR 149 -18.958   1.577  -4.682
  185    H    TYR 150           H        TYR 150 -13.315   6.778  -0.626
  186    HA   TYR 150           HA       TYR 150 -12.147   4.463   0.486
  187   1HB   TYR 150          1HB       TYR 150 -10.808   6.107  -0.593
  188   2HB   TYR 150          2HB       TYR 150 -11.434   7.413   0.397
  189    HD1  TYR 150           HD1      TYR 150  -9.944   4.102   1.475
  190    HD2  TYR 150           HD2      TYR 150  -9.595   8.398   1.398
  191    HE1  TYR 150           HE1      TYR 150  -7.952   3.960   2.924
  192    HE2  TYR 150           HE2      TYR 150  -7.685   8.277   2.936
  193    HH   TYR 150           HH       TYR 150  -6.330   6.939   4.162
  194    H    ARG 151           H        ARG 151 -13.336   7.466   2.141
  195    HA   ARG 151           HA       ARG 151 -12.685   6.707   4.744
  196   1HB   ARG 151          1HB       ARG 151 -14.591   8.620   3.501
  197   2HB   ARG 151          2HB       ARG 151 -14.917   8.228   5.176
  198   1HG   ARG 151          1HG       ARG 151 -12.104   8.852   4.287
  199   2HG   ARG 151          2HG       ARG 151 -13.252  10.198   4.480
  200   1HD   ARG 151          1HD       ARG 151 -12.108   8.309   6.568
  201   2HD   ARG 151          2HD       ARG 151 -11.946  10.054   6.473
  202    HE   ARG 151           HE       ARG 151 -14.231  10.347   7.136
  203   1HH1  ARG 151          1HH1      ARG 151 -13.148   6.920   7.367
  204   2HH1  ARG 151          2HH1      ARG 151 -14.459   6.468   8.381
  205   1HH2  ARG 151          1HH2      ARG 151 -15.863   9.669   8.667
  206   2HH2  ARG 151          2HH2      ARG 151 -15.984   7.969   9.072
  207    H    GLU 152           H        GLU 152 -15.623   5.767   2.905
  208    HA   GLU 152           HA       GLU 152 -17.052   4.792   5.148
  209   1HB   GLU 152          1HB       GLU 152 -17.123   3.792   2.265
  210   2HB   GLU 152          2HB       GLU 152 -18.258   3.362   3.531
  211   1HG   GLU 152          1HG       GLU 152 -18.289   6.137   3.641
  212   2HG   GLU 152          2HG       GLU 152 -18.104   5.822   1.949
  213    H    ASN 153           H        ASN 153 -14.638   3.098   3.091
  214    HA   ASN 153           HA       ASN 153 -14.986   0.702   4.828
  215   1HB   ASN 153          1HB       ASN 153 -14.582  -0.637   2.877
  216   2HB   ASN 153          2HB       ASN 153 -14.202   0.786   1.910
  217   2HD2  ASN 153          2HD2      ASN 153 -15.893   1.214   0.530
  218   1HD2  ASN 153          1HD2      ASN 153 -17.567   1.347   0.962
  219    H    MET 154           H        MET 154 -12.889   2.981   5.079
  220    HA   MET 154           HA       MET 154 -10.379   1.923   4.131
  221   1HB   MET 154          1HB       MET 154  -9.382   3.685   5.709
  222   2HB   MET 154          2HB       MET 154 -10.322   4.235   4.334
  223   1HG   MET 154          1HG       MET 154 -12.057   5.004   5.573
  224   2HG   MET 154          2HG       MET 154 -11.796   3.938   6.917
  225   1HE   MET 154          1HE       MET 154 -10.194   7.039   5.041
  226   2HE   MET 154          2HE       MET 154  -9.071   7.637   6.272
  227   3HE   MET 154          3HE       MET 154  -8.768   6.076   5.488
  228    H    HIS 155           H        HIS 155 -12.294   1.446   6.950
  229    HA   HIS 155           HA       HIS 155 -10.026   0.349   8.480
  230   1HB   HIS 155          1HB       HIS 155 -12.126   1.359   9.520
  231   2HB   HIS 155          2HB       HIS 155 -12.934  -0.168   9.132
  232    HD1  HIS 155           HD1      HIS 155 -13.149  -1.076  11.656
  233    HD2  HIS 155           HD2      HIS 155  -9.279   0.164  10.510
  234    HE1  HIS 155           HE1      HIS 155 -11.581  -1.669  13.572
  235    H    ARG 156           H        ARG 156 -12.086  -0.949   5.996
  236    HA   ARG 156           HA       ARG 156 -11.392  -3.748   6.678
  237   1HB   ARG 156          1HB       ARG 156 -12.801  -2.520   4.252
  238   2HB   ARG 156          2HB       ARG 156 -12.416  -4.229   4.418
  239   1HG   ARG 156          1HG       ARG 156 -14.211  -2.700   6.350
  240   2HG   ARG 156          2HG       ARG 156 -14.783  -3.629   4.973
  241   1HD   ARG 156          1HD       ARG 156 -12.988  -5.307   6.547
  242   2HD   ARG 156          2HD       ARG 156 -14.179  -4.548   7.612
  243    HE   ARG 156           HE       ARG 156 -15.431  -5.625   5.253
  244   1HH1  ARG 156          1HH1      ARG 156 -14.385  -6.513   8.544
  245   2HH1  ARG 156          2HH1      ARG 156 -15.542  -7.819   8.631
  246   1HH2  ARG 156          1HH2      ARG 156 -16.615  -7.463   5.305
  247   2HH2  ARG 156          2HH2      ARG 156 -17.079  -8.157   6.834
  248    H    TYR 157           H        TYR 157 -10.436  -1.092   4.498
  249    HA   TYR 157           HA       TYR 157  -8.510  -2.486   2.973
  250   1HB   TYR 157          1HB       TYR 157  -8.575   0.427   3.879
  251   2HB   TYR 157          2HB       TYR 157  -7.523  -0.211   2.656
  252    HD1  TYR 157           HD1      TYR 157 -10.760  -1.720   2.056
  253    HD2  TYR 157           HD2      TYR 157  -8.447   1.915   1.536
  254    HE1  TYR 157           HE1      TYR 157 -12.217  -1.043   0.206
  255    HE2  TYR 157           HE2      TYR 157  -9.926   2.613  -0.222
  256    HH   TYR 157           HH       TYR 157 -11.726   2.077  -1.576
  257    HA   PRO 158           HA       PRO 158  -5.219  -3.269   5.857
  258   1HB   PRO 158          1HB       PRO 158  -2.916  -2.661   4.402
  259   2HB   PRO 158          2HB       PRO 158  -3.860  -4.156   4.287
  260   1HG   PRO 158          1HG       PRO 158  -4.011  -3.458   2.039
  261   2HG   PRO 158          2HG       PRO 158  -3.941  -1.736   2.500
  262   1HD   PRO 158          1HD       PRO 158  -6.228  -1.893   2.171
  263   2HD   PRO 158          2HD       PRO 158  -6.291  -3.622   2.623
  264    H    ASN 159           H        ASN 159  -3.468  -2.393   7.095
  265    HA   ASN 159           HA       ASN 159  -3.412   0.595   7.269
  266   1HB   ASN 159          1HB       ASN 159  -4.340  -0.737   9.261
  267   2HB   ASN 159          2HB       ASN 159  -3.083   0.463   9.572
  268   2HD2  ASN 159          2HD2      ASN 159  -1.405  -0.214  10.879
  269   1HD2  ASN 159          1HD2      ASN 159  -0.858  -1.886  10.991
  270    H    GLN 160           H        GLN 160  -1.412  -2.212   6.552
  271    HA   GLN 160           HA       GLN 160   1.055  -0.622   6.677
  272   1HB   GLN 160          1HB       GLN 160   0.262  -3.031   8.285
  273   2HB   GLN 160          2HB       GLN 160   1.868  -3.028   7.578
  274   1HG   GLN 160          1HG       GLN 160   2.452  -0.961   8.693
  275   2HG   GLN 160          2HG       GLN 160   0.797  -0.742   9.258
  276   2HE2  GLN 160          2HE2      GLN 160   3.876  -2.367   9.924
  277   1HE2  GLN 160          1HE2      GLN 160   3.346  -3.083  11.421
  278    H    VAL 161           H        VAL 161   2.808  -2.117   5.500
  279    HA   VAL 161           HA       VAL 161   1.528  -3.791   3.424
  280    HB   VAL 161           HB       VAL 161   2.637  -2.709   1.625
  281   1HG1  VAL 161          1HG1      VAL 161   0.567  -1.529   2.456
  282   2HG1  VAL 161          2HG1      VAL 161   1.610  -0.445   3.378
  283   3HG1  VAL 161          3HG1      VAL 161   1.712  -0.475   1.610
  284   1HG2  VAL 161          1HG2      VAL 161   4.798  -2.144   2.659
  285   2HG2  VAL 161          2HG2      VAL 161   4.105  -0.768   1.815
  286   3HG2  VAL 161          3HG2      VAL 161   4.019  -0.826   3.583
  287    H    TYR 162           H        TYR 162   3.367  -4.838   2.015
  288    HA   TYR 162           HA       TYR 162   5.443  -5.889   3.878
  289   1HB   TYR 162          1HB       TYR 162   5.153  -8.050   2.823
  290   2HB   TYR 162          2HB       TYR 162   3.995  -7.395   1.676
  291    HD1  TYR 162           HD1      TYR 162   4.391  -7.458   5.437
  292    HD2  TYR 162           HD2      TYR 162   1.777  -8.015   2.066
  293    HE1  TYR 162           HE1      TYR 162   2.572  -8.125   6.964
  294    HE2  TYR 162           HE2      TYR 162  -0.055  -8.690   3.580
  295    HH   TYR 162           HH       TYR 162  -0.724  -9.022   5.787
  296    H    TYR 163           H        TYR 163   7.513  -6.035   3.010
  297    HA   TYR 163           HA       TYR 163   8.134  -5.945   0.236
  298   1HB   TYR 163          1HB       TYR 163   7.617  -3.540   0.471
  299   2HB   TYR 163          2HB       TYR 163   9.202  -3.938  -0.019
  300    HD1  TYR 163           HD1      TYR 163   7.837  -3.913   3.629
  301    HD2  TYR 163           HD2      TYR 163  10.404  -1.988   0.749
  302    HE1  TYR 163           HE1      TYR 163   8.722  -2.534   5.361
  303    HE2  TYR 163           HE2      TYR 163  11.177  -0.440   2.508
  304    HH   TYR 163           HH       TYR 163  10.160  -0.858   5.932
  305    H    ARG 164           H        ARG 164  10.779  -5.331   0.291
  306    HA   ARG 164           HA       ARG 164  11.999  -6.866   2.547
  307   1HB   ARG 164          1HB       ARG 164  12.713  -6.666  -0.410
  308   2HB   ARG 164          2HB       ARG 164  13.881  -7.145   0.793
  309   1HG   ARG 164          1HG       ARG 164  12.419  -9.030   1.503
  310   2HG   ARG 164          2HG       ARG 164  11.283  -8.609   0.216
  311   1HD   ARG 164          1HD       ARG 164  13.148  -8.880  -1.458
  312   2HD   ARG 164          2HD       ARG 164  12.730 -10.375  -0.626
  313    HE   ARG 164           HE       ARG 164  15.220  -8.855  -0.482
  314   1HH1  ARG 164          1HH1      ARG 164  13.217 -11.091   1.392
  315   2HH1  ARG 164          2HH1      ARG 164  14.524 -11.903   2.148
  316   1HH2  ARG 164          1HH2      ARG 164  17.010  -9.937   0.505
  317   2HH2  ARG 164          2HH2      ARG 164  16.772 -11.255   1.604
  318    HA   PRO 165           HA       PRO 165  14.444  -3.142   3.226
  319   1HB   PRO 165          1HB       PRO 165  17.052  -3.981   3.573
  320   2HB   PRO 165          2HB       PRO 165  15.752  -4.232   4.783
  321   1HG   PRO 165          1HG       PRO 165  16.524  -6.468   4.359
  322   2HG   PRO 165          2HG       PRO 165  16.670  -6.151   2.604
  323   1HD   PRO 165          1HD       PRO 165  14.539  -7.189   2.744
  324   2HD   PRO 165          2HD       PRO 165  14.128  -6.360   4.258
  325    H    VAL 166           H        VAL 166  16.427  -1.863   2.408
  326    HA   VAL 166           HA       VAL 166  16.605  -1.931  -0.528
  327    HB   VAL 166           HB       VAL 166  17.500   0.162   1.475
  328   1HG1  VAL 166          1HG1      VAL 166  18.618   0.387  -0.769
  329   2HG1  VAL 166          2HG1      VAL 166  17.012   0.483  -1.517
  330   3HG1  VAL 166          3HG1      VAL 166  17.524   1.730  -0.369
  331   1HG2  VAL 166          1HG2      VAL 166  14.968  -0.153  -0.200
  332   2HG2  VAL 166          2HG2      VAL 166  15.111   0.045   1.570
  333   3HG2  VAL 166          3HG2      VAL 166  15.450   1.389   0.510
  334    H    ASP 167           H        ASP 167  17.748  -4.049  -0.153
  335    HA   ASP 167           HA       ASP 167  20.602  -3.851   0.669
  336   1HB   ASP 167          1HB       ASP 167  19.381  -5.257   2.129
  337   2HB   ASP 167          2HB       ASP 167  18.450  -5.956   0.807
  338    H    GLU 168           H        GLU 168  18.415  -4.859  -1.973
  339    HA   GLU 168           HA       GLU 168  20.692  -5.251  -3.756
  340   1HB   GLU 168          1HB       GLU 168  19.293  -7.518  -2.460
  341   2HB   GLU 168          2HB       GLU 168  19.304  -7.628  -4.210
  342   1HG   GLU 168          1HG       GLU 168  21.901  -7.075  -2.768
  343   2HG   GLU 168          2HG       GLU 168  21.223  -8.703  -2.819
  344    H    TYR 169           H        TYR 169  17.198  -6.000  -3.455
  345    HA   TYR 169           HA       TYR 169  16.208  -5.730  -6.009
  346   1HB   TYR 169          1HB       TYR 169  15.181  -5.486  -3.268
  347   2HB   TYR 169          2HB       TYR 169  14.400  -4.325  -4.293
  348    HD1  TYR 169           HD1      TYR 169  15.412  -7.919  -4.956
  349    HD2  TYR 169           HD2      TYR 169  12.263  -4.998  -4.520
  350    HE1  TYR 169           HE1      TYR 169  13.726  -9.694  -5.210
  351    HE2  TYR 169           HE2      TYR 169  10.568  -6.745  -4.723
  352    HH   TYR 169           HH       TYR 169  11.497 -10.220  -5.248
  353    H    SER 170           H        SER 170  16.178  -3.184  -3.633
  354    HA   SER 170           HA       SER 170  16.035  -0.892  -3.724
  355   1HB   SER 170          1HB       SER 170  18.782  -1.680  -4.742
  356   2HB   SER 170          2HB       SER 170  18.374  -0.130  -3.974
  357    HG   SER 170           HG       SER 170  19.154  -1.452  -2.435
  358    H    ASN 171           H        ASN 171  14.379  -0.605  -5.282
  359    HA   ASN 171           HA       ASN 171  15.303   1.180  -7.398
  360   1HB   ASN 171          1HB       ASN 171  13.460   0.596  -8.890
  361   2HB   ASN 171          2HB       ASN 171  12.826  -0.564  -7.737
  362   2HD2  ASN 171          2HD2      ASN 171  16.337  -0.553  -8.507
  363   1HD2  ASN 171          1HD2      ASN 171  16.237  -2.036  -9.434
  364    H    GLN 172           H        GLN 172  13.261   2.662  -7.866
  365    HA   GLN 172           HA       GLN 172  11.786   3.107  -5.316
  366   1HB   GLN 172          1HB       GLN 172  13.087   5.024  -6.292
  367   2HB   GLN 172          2HB       GLN 172  11.992   4.963  -7.677
  368   1HG   GLN 172          1HG       GLN 172  10.103   5.198  -6.075
  369   2HG   GLN 172          2HG       GLN 172  11.283   5.662  -4.822
  370   2HE2  GLN 172          2HE2      GLN 172  11.189   8.040  -4.648
  371   1HE2  GLN 172          1HE2      GLN 172  10.869   9.018  -6.064
  372    H    ASN 173           H        ASN 173  10.509   4.024  -8.573
  373    HA   ASN 173           HA       ASN 173   7.978   3.176  -7.770
  374   1HB   ASN 173          1HB       ASN 173   9.155   4.193 -10.295
  375   2HB   ASN 173          2HB       ASN 173   7.799   3.114 -10.562
  376   2HD2  ASN 173          2HD2      ASN 173   5.860   3.660  -8.637
  377   1HD2  ASN 173          1HD2      ASN 173   5.514   5.381  -8.711
  378    H    ASN 174           H        ASN 174  10.397   1.328  -9.597
  379    HA   ASN 174           HA       ASN 174   8.621  -0.842 -10.284
  380   1HB   ASN 174          1HB       ASN 174  10.741  -0.317 -11.457
  381   2HB   ASN 174          2HB       ASN 174  11.659  -0.817 -10.037
  382   2HD2  ASN 174          2HD2      ASN 174  12.511  -2.900 -10.372
  383   1HD2  ASN 174          1HD2      ASN 174  11.669  -4.158 -11.263
  384    H    PHE 175           H        PHE 175  10.219  -0.025  -7.288
  385    HA   PHE 175           HA       PHE 175   9.857  -2.725  -6.157
  386   1HB   PHE 175          1HB       PHE 175  11.729  -1.058  -5.518
  387   2HB   PHE 175          2HB       PHE 175  10.497  -0.175  -4.635
  388    HD1  PHE 175           HD1      PHE 175   9.397  -3.515  -3.991
  389    HD2  PHE 175           HD2      PHE 175  12.678  -0.809  -3.127
  390    HE1  PHE 175           HE1      PHE 175  10.204  -5.046  -2.397
  391    HE2  PHE 175           HE2      PHE 175  13.320  -2.291  -1.246
  392    HZ   PHE 175           HZ       PHE 175  12.173  -4.465  -0.931
  393    H    VAL 176           H        VAL 176   8.469   0.646  -6.039
  394    HA   VAL 176           HA       VAL 176   6.419   0.066  -4.270
  395    HB   VAL 176           HB       VAL 176   6.346   2.079  -6.532
  396   1HG1  VAL 176          1HG1      VAL 176   4.606   1.868  -4.026
  397   2HG1  VAL 176          2HG1      VAL 176   4.638   3.245  -5.155
  398   3HG1  VAL 176          3HG1      VAL 176   4.054   1.681  -5.709
  399   1HG2  VAL 176          1HG2      VAL 176   7.061   2.328  -3.569
  400   2HG2  VAL 176          2HG2      VAL 176   8.199   2.461  -4.920
  401   3HG2  VAL 176          3HG2      VAL 176   6.940   3.676  -4.716
  402    H    HIS 177           H        HIS 177   6.230  -0.238  -7.894
  403    HA   HIS 177           HA       HIS 177   3.610  -1.274  -7.920
  404   1HB   HIS 177          1HB       HIS 177   5.968  -1.778  -9.764
  405   2HB   HIS 177          2HB       HIS 177   4.357  -2.413 -10.064
  406    HD1  HIS 177           HD1      HIS 177   2.437  -0.020  -9.616
  407    HD2  HIS 177           HD2      HIS 177   6.298   0.254 -11.275
  408    HE1  HIS 177           HE1      HIS 177   2.389   1.971 -11.169
  409    H    ASP 178           H        ASP 178   6.533  -2.885  -6.850
  410    HA   ASP 178           HA       ASP 178   5.342  -5.555  -7.128
  411   1HB   ASP 178          1HB       ASP 178   7.826  -5.025  -7.483
  412   2HB   ASP 178          2HB       ASP 178   7.948  -4.913  -5.724
  413    H    CYS 179           H        CYS 179   6.505  -3.429  -4.413
  414    HA   CYS 179           HA       CYS 179   5.488  -5.027  -2.320
  415   1HB   CYS 179          1HB       CYS 179   7.043  -3.065  -2.072
  416   2HB   CYS 179          2HB       CYS 179   5.726  -3.157  -0.891
  417    H    VAL 180           H        VAL 180   3.885  -2.572  -4.309
  418    HA   VAL 180           HA       VAL 180   1.495  -2.491  -2.768
  419    HB   VAL 180           HB       VAL 180   2.064  -1.620  -5.620
  420   1HG1  VAL 180          1HG1      VAL 180  -0.457  -1.302  -3.959
  421   2HG1  VAL 180          2HG1      VAL 180  -0.099  -0.320  -5.383
  422   3HG1  VAL 180          3HG1      VAL 180  -0.298  -2.075  -5.557
  423   1HG2  VAL 180          1HG2      VAL 180   3.106  -0.288  -3.660
  424   2HG2  VAL 180          2HG2      VAL 180   2.057   0.629  -4.755
  425   3HG2  VAL 180          3HG2      VAL 180   1.451   0.100  -3.186
  426    H    ASN 181           H        ASN 181   2.272  -4.146  -5.883
  427    HA   ASN 181           HA       ASN 181  -0.267  -5.477  -5.907
  428   1HB   ASN 181          1HB       ASN 181   1.129  -5.023  -7.908
  429   2HB   ASN 181          2HB       ASN 181   2.351  -6.140  -7.260
  430   2HD2  ASN 181          2HD2      ASN 181   2.281  -7.457  -9.066
  431   1HD2  ASN 181          1HD2      ASN 181   0.875  -8.368  -9.566
  432    H    ILE 182           H        ILE 182   2.781  -6.279  -4.333
  433    HA   ILE 182           HA       ILE 182   2.088  -9.016  -3.653
  434    HB   ILE 182           HB       ILE 182   3.908  -6.892  -2.472
  435   1HG1  ILE 182          1HG1      ILE 182   4.552  -8.129  -4.600
  436   2HG1  ILE 182          2HG1      ILE 182   5.713  -8.149  -3.289
  437   1HG2  ILE 182          1HG2      ILE 182   3.300  -9.589  -1.275
  438   2HG2  ILE 182          2HG2      ILE 182   4.816  -8.711  -0.946
  439   3HG2  ILE 182          3HG2      ILE 182   3.265  -7.997  -0.497
  440   1HD1  ILE 182          1HD1      ILE 182   3.826 -10.427  -3.967
  441   2HD1  ILE 182          2HD1      ILE 182   5.528 -10.318  -4.449
  442   3HD1  ILE 182          3HD1      ILE 182   5.111 -10.468  -2.734
  443    H    THR 183           H        THR 183   1.583  -5.838  -2.067
  444    HA   THR 183           HA       THR 183   0.272  -7.020   0.228
  445    HB   THR 183           HB       THR 183   0.553  -4.138  -0.662
  446    HG1  THR 183           HG1      THR 183   2.537  -4.869  -0.359
  447   1HG2  THR 183          1HG2      THR 183  -0.023  -5.312   2.088
  448   2HG2  THR 183          2HG2      THR 183   0.239  -3.595   1.713
  449   3HG2  THR 183          3HG2      THR 183  -1.189  -4.396   1.102
  450    H    ILE 184           H        ILE 184  -0.791  -5.915  -2.882
  451    HA   ILE 184           HA       ILE 184  -3.600  -5.691  -2.032
  452    HB   ILE 184           HB       ILE 184  -2.038  -5.014  -4.523
  453   1HG1  ILE 184          1HG1      ILE 184  -2.143  -3.589  -2.355
  454   2HG1  ILE 184          2HG1      ILE 184  -2.432  -2.750  -3.829
  455   1HG2  ILE 184          1HG2      ILE 184  -5.069  -5.017  -4.306
  456   2HG2  ILE 184          2HG2      ILE 184  -4.123  -4.117  -5.522
  457   3HG2  ILE 184          3HG2      ILE 184  -4.045  -5.876  -5.465
  458   1HD1  ILE 184          1HD1      ILE 184  -4.890  -2.858  -3.465
  459   2HD1  ILE 184          2HD1      ILE 184  -4.582  -3.669  -1.900
  460   3HD1  ILE 184          3HD1      ILE 184  -3.979  -2.030  -2.223
  461    H    LYS 185           H        LYS 185  -1.629  -7.810  -4.284
  462    HA   LYS 185           HA       LYS 185  -3.818  -9.531  -4.836
  463   1HB   LYS 185          1HB       LYS 185  -1.567  -9.369  -6.015
  464   2HB   LYS 185          2HB       LYS 185  -0.905 -10.360  -4.702
  465   1HG   LYS 185          1HG       LYS 185  -2.615 -12.147  -5.328
  466   2HG   LYS 185          2HG       LYS 185  -3.184 -11.069  -6.604
  467   1HD   LYS 185          1HD       LYS 185  -1.703 -12.624  -7.658
  468   2HD   LYS 185          2HD       LYS 185  -0.866 -11.071  -7.581
  469   1HE   LYS 185          1HE       LYS 185   0.092 -12.071  -5.291
  470   2HE   LYS 185          2HE       LYS 185  -0.374 -13.615  -6.000
  471   1HZ   LYS 185          1HZ       LYS 185   1.033 -12.965  -7.944
  472   2HZ   LYS 185          2HZ       LYS 185   1.460 -11.589  -7.126
  473   3HZ   LYS 185          3HZ       LYS 185   1.906 -13.040  -6.549
  474    H    GLN 186           H        GLN 186  -1.470  -9.525  -2.069
  475    HA   GLN 186           HA       GLN 186  -2.418 -11.997  -1.024
  476   1HB   GLN 186          1HB       GLN 186  -1.384 -11.429   1.071
  477   2HB   GLN 186          2HB       GLN 186  -0.379 -10.891  -0.255
  478   1HG   GLN 186          1HG       GLN 186  -1.348  -8.600   0.087
  479   2HG   GLN 186          2HG       GLN 186  -0.244  -9.196   1.317
  480   2HE2  GLN 186          2HE2      GLN 186  -2.312  -7.036   1.531
  481   1HE2  GLN 186          1HE2      GLN 186  -3.277  -7.505   2.910
  482    H    HIS 187           H        HIS 187  -3.861  -8.751  -0.887
  483    HA   HIS 187           HA       HIS 187  -5.830  -9.476   1.114
  484   1HB   HIS 187          1HB       HIS 187  -5.971  -7.277   1.274
  485   2HB   HIS 187          2HB       HIS 187  -4.893  -7.053  -0.072
  486    HD1  HIS 187           HD1      HIS 187  -6.201  -7.105  -2.600
  487    HD2  HIS 187           HD2      HIS 187  -8.271  -6.160   0.955
  488    HE1  HIS 187           HE1      HIS 187  -8.383  -5.897  -3.288
  489    H    THR 188           H        THR 188  -5.668  -9.268  -2.489
  490    HA   THR 188           HA       THR 188  -8.408 -10.016  -2.746
  491    HB   THR 188           HB       THR 188  -6.581 -10.479  -5.069
  492    HG1  THR 188           HG1      THR 188  -7.389  -7.887  -4.611
  493   1HG2  THR 188          1HG2      THR 188  -9.237  -8.996  -4.591
  494   2HG2  THR 188          2HG2      THR 188  -8.482  -9.264  -6.176
  495   3HG2  THR 188          3HG2      THR 188  -9.070 -10.635  -5.249
  496    H    VAL 189           H        VAL 189  -5.786 -11.930  -1.808
  497    HA   VAL 189           HA       VAL 189  -7.099 -14.469  -2.624
  498    HB   VAL 189           HB       VAL 189  -4.523 -13.685  -1.208
  499   1HG1  VAL 189          1HG1      VAL 189  -5.711 -16.468  -1.352
  500   2HG1  VAL 189          2HG1      VAL 189  -4.017 -16.096  -0.926
  501   3HG1  VAL 189          3HG1      VAL 189  -5.337 -15.511   0.112
  502   1HG2  VAL 189          1HG2      VAL 189  -4.530 -13.735  -3.700
  503   2HG2  VAL 189          2HG2      VAL 189  -3.473 -14.980  -3.009
  504   3HG2  VAL 189          3HG2      VAL 189  -5.065 -15.422  -3.645
  505    H    THR 190           H        THR 190  -6.135 -12.786   0.474
  506    HA   THR 190           HA       THR 190  -7.610 -14.603   2.034
  507    HB   THR 190           HB       THR 190  -6.778 -11.737   2.506
  508    HG1  THR 190           HG1      THR 190  -5.586 -14.274   3.141
  509   1HG2  THR 190          1HG2      THR 190  -7.629 -13.810   4.542
  510   2HG2  THR 190          2HG2      THR 190  -6.717 -12.338   4.948
  511   3HG2  THR 190          3HG2      THR 190  -8.353 -12.213   4.275
  512    H    THR 191           H        THR 191  -8.750 -11.689   0.374
  513    HA   THR 191           HA       THR 191 -11.265 -11.505   1.756
  514    HB   THR 191           HB       THR 191 -10.154  -9.752   0.308
  515    HG1  THR 191           HG1      THR 191 -11.983  -8.819   0.432
  516   1HG2  THR 191          1HG2      THR 191  -9.932 -11.169  -1.787
  517   2HG2  THR 191          2HG2      THR 191 -11.682 -11.013  -1.995
  518   3HG2  THR 191          3HG2      THR 191 -10.665  -9.564  -2.015
  519    H    THR 192           H        THR 192 -10.391 -13.121  -1.411
  520    HA   THR 192           HA       THR 192 -12.876 -14.395  -1.639
  521    HB   THR 192           HB       THR 192 -11.557 -15.894  -3.162
  522    HG1  THR 192           HG1      THR 192  -9.444 -15.259  -1.965
  523   1HG2  THR 192          1HG2      THR 192 -12.588 -13.626  -3.823
  524   2HG2  THR 192          2HG2      THR 192 -10.999 -12.922  -3.544
  525   3HG2  THR 192          3HG2      THR 192 -11.208 -14.117  -4.834
  526    H    THR 193           H        THR 193 -10.080 -15.277   0.271
  527    HA   THR 193           HA       THR 193 -10.775 -18.034   0.741
  528    HB   THR 193           HB       THR 193  -9.199 -16.161   2.530
  529    HG1  THR 193           HG1      THR 193  -8.614 -17.456   0.144
  530   1HG2  THR 193          1HG2      THR 193  -9.172 -19.179   2.277
  531   2HG2  THR 193          2HG2      THR 193  -8.044 -18.218   3.263
  532   3HG2  THR 193          3HG2      THR 193  -9.770 -18.239   3.665
  533    H    LYS 194           H        LYS 194 -11.578 -14.964   2.230
  534    HA   LYS 194           HA       LYS 194 -13.290 -16.283   4.267
  535   1HB   LYS 194          1HB       LYS 194 -13.269 -14.413   5.455
  536   2HB   LYS 194          2HB       LYS 194 -11.750 -14.233   4.582
  537   1HG   LYS 194          1HG       LYS 194 -13.300 -12.731   2.982
  538   2HG   LYS 194          2HG       LYS 194 -14.282 -12.640   4.430
  539   1HD   LYS 194          1HD       LYS 194 -12.705 -10.781   4.327
  540   2HD   LYS 194          2HD       LYS 194 -11.331 -11.899   4.169
  541   1HE   LYS 194          1HE       LYS 194 -13.228 -11.830   6.553
  542   2HE   LYS 194          2HE       LYS 194 -11.772 -12.816   6.416
  543   1HZ   LYS 194          1HZ       LYS 194 -11.680  -9.873   6.288
  544   2HZ   LYS 194          2HZ       LYS 194 -11.653 -10.688   7.704
  545   3HZ   LYS 194          3HZ       LYS 194 -10.434 -10.957   6.653
  546    H    GLY 195           H        GLY 195 -13.717 -15.650   1.066
  547   1HA   GLY 195          1HA       GLY 195 -15.578 -15.692  -0.256
  548   2HA   GLY 195          2HA       GLY 195 -16.597 -15.906   1.177
  549    H    GLU 196           H        GLU 196 -14.360 -13.134   1.128
  550    HA   GLU 196           HA       GLU 196 -16.619 -11.337   0.499
  551   1HB   GLU 196          1HB       GLU 196 -15.252 -11.214   2.739
  552   2HB   GLU 196          2HB       GLU 196 -14.004 -10.433   1.760
  553   1HG   GLU 196          1HG       GLU 196 -15.406  -8.613   1.236
  554   2HG   GLU 196          2HG       GLU 196 -16.883  -9.517   1.606
  555    H    ASN 197           H        ASN 197 -15.817  -9.385  -0.799
  556    HA   ASN 197           HA       ASN 197 -13.730  -9.955  -2.743
  557   1HB   ASN 197          1HB       ASN 197 -15.422  -9.879  -4.661
  558   2HB   ASN 197          2HB       ASN 197 -15.192 -11.379  -3.783
  559   2HD2  ASN 197          2HD2      ASN 197 -17.388  -8.531  -3.871
  560   1HD2  ASN 197          1HD2      ASN 197 -18.832  -9.449  -3.395
  561    H    PHE 198           H        PHE 198 -13.040  -8.058  -1.803
  562    HA   PHE 198           HA       PHE 198 -14.274  -5.476  -2.089
  563   1HB   PHE 198          1HB       PHE 198 -11.944  -4.670  -1.994
  564   2HB   PHE 198          2HB       PHE 198 -11.329  -6.278  -2.322
  565    HD1  PHE 198           HD1      PHE 198 -13.636  -4.525   0.106
  566    HD2  PHE 198           HD2      PHE 198 -10.516  -7.489  -0.433
  567    HE1  PHE 198           HE1      PHE 198 -13.684  -5.018   2.516
  568    HE2  PHE 198           HE2      PHE 198 -10.513  -7.896   2.020
  569    HZ   PHE 198           HZ       PHE 198 -12.107  -6.679   3.486
  570    H    THR 199           H        THR 199 -14.579  -4.255  -3.989
  571    HA   THR 199           HA       THR 199 -14.236  -5.758  -6.479
  572    HB   THR 199           HB       THR 199 -15.398  -3.658  -7.441
  573    HG1  THR 199           HG1      THR 199 -15.205  -2.644  -5.022
  574   1HG2  THR 199          1HG2      THR 199 -16.740  -5.486  -5.393
  575   2HG2  THR 199          2HG2      THR 199 -17.566  -4.527  -6.628
  576   3HG2  THR 199          3HG2      THR 199 -16.479  -5.844  -7.113
  577    H    GLU 200           H        GLU 200 -13.455  -4.601  -8.514
  578    HA   GLU 200           HA       GLU 200 -10.734  -3.941  -8.202
  579   1HB   GLU 200          1HB       GLU 200 -12.733  -3.695 -10.417
  580   2HB   GLU 200          2HB       GLU 200 -11.226  -2.818 -10.556
  581   1HG   GLU 200          1HG       GLU 200 -10.000  -5.019 -10.075
  582   2HG   GLU 200          2HG       GLU 200 -10.730  -4.762 -11.662
  583    H    THR 201           H        THR 201 -13.578  -1.983  -7.773
  584    HA   THR 201           HA       THR 201 -12.220   0.564  -8.200
  585    HB   THR 201           HB       THR 201 -14.812  -0.160  -8.076
  586    HG1  THR 201           HG1      THR 201 -13.574   2.362  -7.711
  587   1HG2  THR 201          1HG2      THR 201 -14.408   1.199  -5.389
  588   2HG2  THR 201          2HG2      THR 201 -15.956   0.970  -6.243
  589   3HG2  THR 201          3HG2      THR 201 -15.037  -0.429  -5.696
  590    H    ASP 202           H        ASP 202 -12.905  -1.556  -5.443
  591    HA   ASP 202           HA       ASP 202 -11.779   0.080  -3.385
  592   1HB   ASP 202          1HB       ASP 202 -11.769  -1.981  -2.043
  593   2HB   ASP 202          2HB       ASP 202 -12.054  -2.956  -3.464
  594    H    VAL 203           H        VAL 203 -10.470  -2.591  -5.427
  595    HA   VAL 203           HA       VAL 203  -7.819  -2.624  -4.488
  596    HB   VAL 203           HB       VAL 203  -9.144  -3.205  -7.148
  597   1HG1  VAL 203          1HG1      VAL 203  -6.232  -3.668  -6.468
  598   2HG1  VAL 203          2HG1      VAL 203  -7.093  -4.416  -7.837
  599   3HG1  VAL 203          3HG1      VAL 203  -6.894  -2.669  -7.773
  600   1HG2  VAL 203          1HG2      VAL 203  -9.605  -4.725  -5.175
  601   2HG2  VAL 203          2HG2      VAL 203  -8.826  -5.532  -6.537
  602   3HG2  VAL 203          3HG2      VAL 203  -7.852  -5.073  -5.132
  603    H    LYS 204           H        LYS 204  -9.252  -0.609  -7.170
  604    HA   LYS 204           HA       LYS 204  -6.836   0.727  -7.759
  605   1HB   LYS 204          1HB       LYS 204  -9.737   1.186  -8.334
  606   2HB   LYS 204          2HB       LYS 204  -8.795   2.659  -8.229
  607   1HG   LYS 204          1HG       LYS 204  -7.082   1.570  -9.799
  608   2HG   LYS 204          2HG       LYS 204  -8.607   2.120 -10.486
  609   1HD   LYS 204          1HD       LYS 204  -7.635  -0.256 -11.089
  610   2HD   LYS 204          2HD       LYS 204  -8.353  -0.766  -9.573
  611   1HE   LYS 204          1HE       LYS 204 -10.357  -0.927 -10.611
  612   2HE   LYS 204          2HE       LYS 204 -10.334   0.819 -10.857
  613   1HZ   LYS 204          1HZ       LYS 204  -8.901   0.248 -12.876
  614   2HZ   LYS 204          2HZ       LYS 204  -9.484  -1.281 -12.724
  615   3HZ   LYS 204          3HZ       LYS 204 -10.521  -0.032 -12.984
  616    H    MET 205           H        MET 205  -9.207   1.417  -5.210
  617    HA   MET 205           HA       MET 205  -7.961   3.905  -4.403
  618   1HB   MET 205          1HB       MET 205  -9.960   2.021  -3.099
  619   2HB   MET 205          2HB       MET 205  -9.255   3.382  -2.198
  620   1HG   MET 205          1HG       MET 205  -9.984   4.911  -3.907
  621   2HG   MET 205          2HG       MET 205 -10.522   3.624  -4.965
  622   1HE   MET 205          1HE       MET 205 -12.064   5.541  -5.244
  623   2HE   MET 205          2HE       MET 205 -13.578   5.730  -4.355
  624   3HE   MET 205          3HE       MET 205 -12.087   6.484  -3.748
  625    H    MET 206           H        MET 206  -7.792   0.532  -3.098
  626    HA   MET 206           HA       MET 206  -5.879   1.240  -1.122
  627   1HB   MET 206          1HB       MET 206  -6.572  -1.440  -2.374
  628   2HB   MET 206          2HB       MET 206  -5.478  -1.210  -0.977
  629   1HG   MET 206          1HG       MET 206  -7.160  -0.189   0.322
  630   2HG   MET 206          2HG       MET 206  -8.318  -0.258  -1.002
  631   1HE   MET 206          1HE       MET 206  -9.838  -1.809  -1.334
  632   2HE   MET 206          2HE       MET 206  -8.759  -2.932  -2.192
  633   3HE   MET 206          3HE       MET 206  -9.890  -3.537  -0.955
  634    H    GLU 207           H        GLU 207  -5.400   0.298  -4.536
  635    HA   GLU 207           HA       GLU 207  -2.616  -0.071  -4.591
  636   1HB   GLU 207          1HB       GLU 207  -4.648   1.034  -6.474
  637   2HB   GLU 207          2HB       GLU 207  -3.006   1.457  -6.857
  638   1HG   GLU 207          1HG       GLU 207  -3.744  -1.439  -6.402
  639   2HG   GLU 207          2HG       GLU 207  -4.096  -0.585  -7.898
  640    H    ARG 208           H        ARG 208  -4.405   3.054  -4.649
  641    HA   ARG 208           HA       ARG 208  -2.086   4.713  -4.491
  642   1HB   ARG 208          1HB       ARG 208  -5.026   5.071  -4.181
  643   2HB   ARG 208          2HB       ARG 208  -4.078   6.142  -3.140
  644   1HG   ARG 208          1HG       ARG 208  -3.750   5.845  -6.114
  645   2HG   ARG 208          2HG       ARG 208  -4.665   7.119  -5.325
  646   1HD   ARG 208          1HD       ARG 208  -2.842   8.326  -4.756
  647   2HD   ARG 208          2HD       ARG 208  -1.912   6.917  -4.265
  648    HE   ARG 208           HE       ARG 208  -1.090   6.576  -6.373
  649   1HH1  ARG 208          1HH1      ARG 208  -2.710   9.682  -6.195
  650   2HH1  ARG 208          2HH1      ARG 208  -2.571  10.088  -7.845
  651   1HH2  ARG 208          1HH2      ARG 208  -0.792   7.043  -8.594
  652   2HH2  ARG 208          2HH2      ARG 208  -1.174   8.618  -9.207
  653    H    VAL 209           H        VAL 209  -4.241   3.491  -1.857
  654    HA   VAL 209           HA       VAL 209  -2.857   4.921   0.154
  655    HB   VAL 209           HB       VAL 209  -4.364   2.313   0.552
  656   1HG1  VAL 209          1HG1      VAL 209  -3.715   4.666   2.388
  657   2HG1  VAL 209          2HG1      VAL 209  -4.794   3.327   2.819
  658   3HG1  VAL 209          3HG1      VAL 209  -3.079   3.010   2.496
  659   1HG2  VAL 209          1HG2      VAL 209  -5.423   5.173   0.479
  660   2HG2  VAL 209          2HG2      VAL 209  -5.854   3.849  -0.611
  661   3HG2  VAL 209          3HG2      VAL 209  -6.324   3.759   1.071
  662    H    VAL 210           H        VAL 210  -2.350   1.582  -1.041
  663    HA   VAL 210           HA       VAL 210  -0.273   0.870   0.783
  664    HB   VAL 210           HB       VAL 210  -1.083  -0.170  -1.957
  665   1HG1  VAL 210          1HG1      VAL 210   1.221  -0.968  -1.253
  666   2HG1  VAL 210          2HG1      VAL 210   0.470  -1.710   0.153
  667   3HG1  VAL 210          3HG1      VAL 210  -0.020  -2.241  -1.453
  668   1HG2  VAL 210          1HG2      VAL 210  -2.871  -0.415  -0.115
  669   2HG2  VAL 210          2HG2      VAL 210  -2.292  -1.905  -0.883
  670   3HG2  VAL 210          3HG2      VAL 210  -1.728  -1.437   0.747
  671    H    GLU 211           H        GLU 211  -0.210   2.647  -2.515
  672    HA   GLU 211           HA       GLU 211   2.557   2.553  -2.787
  673   1HB   GLU 211          1HB       GLU 211   1.254   2.988  -4.710
  674   2HB   GLU 211          2HB       GLU 211   0.107   3.978  -3.841
  675   1HG   GLU 211          1HG       GLU 211   1.967   5.632  -3.532
  676   2HG   GLU 211          2HG       GLU 211   2.772   4.794  -4.869
  677    H    GLN 212           H        GLN 212   0.227   4.824  -1.174
  678    HA   GLN 212           HA       GLN 212   2.247   6.746  -0.530
  679   1HB   GLN 212          1HB       GLN 212   0.788   7.798   0.922
  680   2HB   GLN 212          2HB       GLN 212  -0.081   6.339   1.340
  681   1HG   GLN 212          1HG       GLN 212  -1.485   6.483  -0.504
  682   2HG   GLN 212          2HG       GLN 212  -1.377   8.044   0.189
  683   2HE2  GLN 212          2HE2      GLN 212   1.092   6.784  -2.123
  684   1HE2  GLN 212          1HE2      GLN 212   0.603   7.786  -3.433
  685    H    MET 213           H        MET 213   1.016   3.959   1.283
  686    HA   MET 213           HA       MET 213   2.606   4.215   3.646
  687   1HB   MET 213          1HB       MET 213   1.591   1.751   2.172
  688   2HB   MET 213          2HB       MET 213   2.361   1.702   3.762
  689   1HG   MET 213          1HG       MET 213   0.590   2.908   4.769
  690   2HG   MET 213          2HG       MET 213  -0.086   3.365   3.190
  691   1HE   MET 213          1HE       MET 213  -2.450   2.691   4.467
  692   2HE   MET 213          2HE       MET 213  -2.775   1.023   4.993
  693   3HE   MET 213          3HE       MET 213  -1.590   2.035   5.857
  694    H    CYS 214           H        CYS 214   3.231   2.308   0.640
  695    HA   CYS 214           HA       CYS 214   5.724   1.370   1.513
  696   1HB   CYS 214          1HB       CYS 214   4.190   0.486  -0.299
  697   2HB   CYS 214          2HB       CYS 214   4.850   1.716  -1.369
  698    H    ILE 215           H        ILE 215   4.976   4.242  -0.522
  699    HA   ILE 215           HA       ILE 215   7.679   5.098  -0.888
  700    HB   ILE 215           HB       ILE 215   5.029   6.595  -0.884
  701   1HG1  ILE 215          1HG1      ILE 215   6.883   5.818  -3.194
  702   2HG1  ILE 215          2HG1      ILE 215   5.512   4.841  -2.688
  703   1HG2  ILE 215          1HG2      ILE 215   7.765   7.669  -1.739
  704   2HG2  ILE 215          2HG2      ILE 215   6.210   8.497  -1.972
  705   3HG2  ILE 215          3HG2      ILE 215   6.820   8.235  -0.351
  706   1HD1  ILE 215          1HD1      ILE 215   3.994   6.803  -3.133
  707   2HD1  ILE 215          2HD1      ILE 215   5.385   7.641  -3.857
  708   3HD1  ILE 215          3HD1      ILE 215   4.806   6.132  -4.566
  709    H    THR 216           H        THR 216   5.293   5.794   1.737
  710    HA   THR 216           HA       THR 216   6.966   7.640   3.138
  711    HB   THR 216           HB       THR 216   4.773   5.773   4.163
  712    HG1  THR 216           HG1      THR 216   3.899   7.112   2.747
  713   1HG2  THR 216          1HG2      THR 216   5.978   8.247   5.475
  714   2HG2  THR 216          2HG2      THR 216   4.537   7.355   6.035
  715   3HG2  THR 216          3HG2      THR 216   6.099   6.562   6.044
  716    H    GLN 217           H        GLN 217   6.711   4.047   3.299
  717    HA   GLN 217           HA       GLN 217   8.637   3.782   5.420
  718   1HB   GLN 217          1HB       GLN 217   7.378   1.925   3.403
  719   2HB   GLN 217          2HB       GLN 217   8.835   1.420   4.249
  720   1HG   GLN 217          1HG       GLN 217   7.061   0.581   5.529
  721   2HG   GLN 217          2HG       GLN 217   7.715   1.921   6.444
  722   2HE2  GLN 217          2HE2      GLN 217   6.362   3.879   6.687
  723   1HE2  GLN 217          1HE2      GLN 217   4.642   3.771   6.332
  724    H    TYR 218           H        TYR 218   9.010   3.476   1.829
  725    HA   TYR 218           HA       TYR 218  11.757   3.072   1.651
  726   1HB   TYR 218          1HB       TYR 218  10.273   3.046  -0.267
  727   2HB   TYR 218          2HB       TYR 218   9.922   4.754  -0.098
  728    HD1  TYR 218           HD1      TYR 218  11.608   6.503  -0.707
  729    HD2  TYR 218           HD2      TYR 218  12.380   2.284  -1.329
  730    HE1  TYR 218           HE1      TYR 218  13.512   7.061  -2.147
  731    HE2  TYR 218           HE2      TYR 218  14.252   2.849  -2.818
  732    HH   TYR 218           HH       TYR 218  15.822   5.544  -2.642
  733    H    GLU 219           H        GLU 219  10.110   6.308   1.798
  734    HA   GLU 219           HA       GLU 219  12.538   7.799   1.780
  735   1HB   GLU 219          1HB       GLU 219   9.704   8.397   2.688
  736   2HB   GLU 219          2HB       GLU 219  10.979   9.610   2.832
  737   1HG   GLU 219          1HG       GLU 219  10.286   8.238   0.194
  738   2HG   GLU 219          2HG       GLU 219   9.546   9.742   0.741
  739    H    ARG 220           H        ARG 220  10.592   6.574   4.543
  740    HA   ARG 220           HA       ARG 220  12.133   7.915   6.581
  741   1HB   ARG 220          1HB       ARG 220  10.512   5.335   6.609
  742   2HB   ARG 220          2HB       ARG 220  11.271   5.997   8.054
  743   1HG   ARG 220          1HG       ARG 220   9.921   7.969   8.024
  744   2HG   ARG 220          2HG       ARG 220   9.348   7.654   6.398
  745   1HD   ARG 220          1HD       ARG 220   8.407   5.400   7.389
  746   2HD   ARG 220          2HD       ARG 220   7.530   6.897   7.609
  747    HE   ARG 220           HE       ARG 220   8.826   5.305   9.679
  748   1HH1  ARG 220          1HH1      ARG 220   7.788   8.603   8.802
  749   2HH1  ARG 220          2HH1      ARG 220   7.334   9.021  10.420
  750   1HH2  ARG 220          1HH2      ARG 220   8.267   5.982  11.892
  751   2HH2  ARG 220          2HH2      ARG 220   7.738   7.628  12.146
  752    H    GLU 221           H        GLU 221  12.529   4.666   4.969
  753    HA   GLU 221           HA       GLU 221  14.668   3.947   6.719
  754   1HB   GLU 221          1HB       GLU 221  12.843   2.730   4.914
  755   2HB   GLU 221          2HB       GLU 221  14.392   2.464   4.179
  756   1HG   GLU 221          1HG       GLU 221  13.747   1.948   7.130
  757   2HG   GLU 221          2HG       GLU 221  13.459   0.788   5.852
  758    H    SER 222           H        SER 222  14.374   5.207   3.399
  759    HA   SER 222           HA       SER 222  16.989   5.370   2.546
  760   1HB   SER 222          1HB       SER 222  14.960   6.218   1.321
  761   2HB   SER 222          2HB       SER 222  14.941   7.615   2.393
  762    HG   SER 222           HG       SER 222  15.973   8.294   0.671
  763    H    GLN 223           H        GLN 223  15.448   7.492   5.023
  764    HA   GLN 223           HA       GLN 223  17.978   8.958   5.128
  765   1HB   GLN 223          1HB       GLN 223  15.298   9.501   6.545
  766   2HB   GLN 223          2HB       GLN 223  16.718  10.547   6.669
  767   1HG   GLN 223          1HG       GLN 223  15.082  10.029   4.163
  768   2HG   GLN 223          2HG       GLN 223  15.188  11.527   5.088
  769   2HE2  GLN 223          2HE2      GLN 223  16.377   9.981   2.357
  770   1HE2  GLN 223          1HE2      GLN 223  17.926  10.790   2.196
  771    H    ALA 224           H        ALA 224  17.205   6.221   6.245
  772    HA   ALA 224           HA       ALA 224  19.053   6.548   8.563
  773   1HB   ALA 224          1HB       ALA 224  16.869   4.442   8.317
  774   2HB   ALA 224          2HB       ALA 224  17.969   4.685   9.690
  775   3HB   ALA 224          3HB       ALA 224  16.750   5.917   9.310
  776    H    TYR 225           H        TYR 225  19.058   5.556   5.405
  777    HA   TYR 225           HA       TYR 225  20.920   3.280   5.874
  778   1HB   TYR 225          1HB       TYR 225  18.285   2.985   5.219
  779   2HB   TYR 225          2HB       TYR 225  18.938   3.182   3.622
  780    HD1  TYR 225           HD1      TYR 225  18.887   1.204   6.674
  781    HD2  TYR 225           HD2      TYR 225  20.278   1.406   2.628
  782    HE1  TYR 225           HE1      TYR 225  19.384  -1.278   6.725
  783    HE2  TYR 225           HE2      TYR 225  20.796  -1.009   2.673
  784    HH   TYR 225           HH       TYR 225  21.067  -2.862   4.023
  785    H    TYR 226           H        TYR 226  19.435   5.586   3.551
  786    HA   TYR 226           HA       TYR 226  21.682   5.378   1.671
  787   1HB   TYR 226          1HB       TYR 226  19.022   5.783   1.335
  788   2HB   TYR 226          2HB       TYR 226  19.486   7.457   1.550
  789    HD1  TYR 226           HD1      TYR 226  20.429   4.353  -0.325
  790    HD2  TYR 226           HD2      TYR 226  20.105   8.655  -0.420
  791    HE1  TYR 226           HE1      TYR 226  20.865   4.325  -2.765
  792    HE2  TYR 226           HE2      TYR 226  20.540   8.621  -2.870
  793    HH   TYR 226           HH       TYR 226  21.023   5.593  -4.704
  794    H    GLN 227           H        GLN 227  20.308   7.405   4.217
  795    HA   GLN 227           HA       GLN 227  22.150   9.641   3.701
  796   1HB   GLN 227          1HB       GLN 227  19.777   9.849   4.507
  797   2HB   GLN 227          2HB       GLN 227  20.290   9.190   6.068
  798   1HG   GLN 227          1HG       GLN 227  20.168  11.607   6.159
  799   2HG   GLN 227          2HG       GLN 227  21.844  11.107   6.327
  800   2HE2  GLN 227          2HE2      GLN 227  19.445  12.240   3.925
  801   1HE2  GLN 227          1HE2      GLN 227  20.564  13.292   3.068
  802    H    ARG 228           H        ARG 228  22.527   6.712   5.063
  803    HA   ARG 228           HA       ARG 228  24.603   7.208   7.065
  804   1HB   ARG 228          1HB       ARG 228  24.408   4.943   5.038
  805   2HB   ARG 228          2HB       ARG 228  25.476   4.969   6.425
  806   1HG   ARG 228          1HG       ARG 228  22.448   5.161   6.755
  807   2HG   ARG 228          2HG       ARG 228  23.272   3.619   6.594
  808   1HD   ARG 228          1HD       ARG 228  24.181   3.684   8.632
  809   2HD   ARG 228          2HD       ARG 228  24.482   5.427   8.626
  810    HE   ARG 228           HE       ARG 228  21.820   5.414   8.826
  811   1HH1  ARG 228          1HH1      ARG 228  24.164   3.426  10.632
  812   2HH1  ARG 228          2HH1      ARG 228  23.206   3.316  12.053
  813   1HH2  ARG 228          1HH2      ARG 228  20.548   5.329  10.814
  814   2HH2  ARG 228          2HH2      ARG 228  21.186   4.413  12.158

  No H/Q in entry =         814