*HEADER    VIRAL PROTEIN                           12-MAY-11   2LCZ              
*TITLE     NMR STRUCTURE OF THE COMPLETE INTERNAL FUSION LOOP FROM EBOLAVIRUS GP2
*TITLE    2 AT PH 7.0                                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VIRION SPIKE GLYCOPROTEIN;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SEQUENCE DATABASE RESIDUES 507-560;                        
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ZAIRE EBOLAVIRUS;                               
*SOURCE   3 ORGANISM_TAXID: 186538;                                              
*SOURCE   4 GENE: GP;                                                            
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PET41                                      
*KEYWDS    VIRAL PROTEIN                                                         
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    S.M.GREGORY, E.HARADA, B.LIANG, L.K.TAMM                              
*REVDAT   1   22-JUN-11 2LCZ    0                                                


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assign  (resid 558  and  name    HB#)  (resid 559   and  name      HN)   1.8 0.0  1.6
assign  (resid 558  and  name     HN)  (resid 559   and  name     HD#)   1.8 0.0  3.6
assign  (resid 558  and  name    HD#)  (resid 560   and  name      HN)   1.8 0.0  2.6
assign  (resid 558  and  name    HD#)  (resid 560   and  name    HE2#)   1.8 0.0  3.0
assign  (resid 558  and  name    HD#)  (resid 560   and  name      HA)   1.8 0.0  2.7
assign  (resid 559  and  name     HN)  (resid 559   and  name     HB#)   1.8 0.0  1.9
assign  (resid 559  and  name    HB#)  (resid 559   and  name     HD#)   1.8 0.0  1.8
assign  (resid 559  and  name     HN)  (resid 559   and  name     HD#)   1.8 0.0  2.8
assign  (resid 559  and  name     HA)  (resid 559   and  name     HD#)   1.8 0.0  2.4
assign  (resid 559  and  name    HG#)  (resid 560   and  name    HE2#)   1.8 0.0  3.0
assign  (resid 559  and  name     HA)  (resid 560   and  name    HE2#)   1.8 0.0  2.6
assign  (resid 559  and  name    HD#)  (resid 560   and  name      HN)   1.8 0.0  2.9
assign  (resid 559  and  name    HB#)  (resid 560   and  name    HE2#)   1.8 0.0  3.2
assign  (resid 559  and  name     HN)  (resid 560   and  name     HG#)   1.8 0.0  2.7
assign  (resid 559  and  name    HG#)  (resid 560   and  name      HN)   1.8 0.0  1.8
assign  (resid 559  and  name    HG#)  (resid 560   and  name      HA)   1.8 0.0  2.9
assign  (resid 559  and  name    HD#)  (resid 560   and  name     HB#)   1.8 0.0  3.2
assign  (resid 559  and  name     HA)  (resid 560   and  name      HN)   1.8 0.0  0.9
assign  (resid 559  and  name    HD#)  (resid 560   and  name    HE2#)   1.8 0.0  3.6
assign  (resid 560  and  name    HG#)  (resid 560   and  name    HE2#)   1.8 0.0  1.3
assign  (resid 560  and  name     HN)  (resid 560   and  name     HB#)   1.8 0.0  1.1
assign  (resid 560  and  name     HN)  (resid 560   and  name     HG#)   1.8 0.0  1.5
assign  (resid 560  and  name     HN)  (resid 560   and  name     HB1)   1.8 0.0  1.9
assign  (resid 560  and  name     HN)  (resid 560   and  name     HB2)   1.8 0.0  1.9
assign  (resid 560  and  name     HA)  (resid 560   and  name     HG#)   1.8 0.0  2.0
!remark phi angles

 assign (resid  534  and name c ) (resid  535  and name n )
        (resid  535  and name ca) (resid  535  and name c )   1.0  -90.0  30.0 2
 assign (resid  536  and name c ) (resid  537  and name n )
        (resid  537  and name ca) (resid  537  and name c )   1.0  -67.0  30.0 2
 assign (resid  537  and name c ) (resid  538  and name n )
        (resid  538  and name ca) (resid  538  and name c )   1.0  -72.0  30.0 2 
 assign (resid  538  and name c ) (resid  539  and name n )
        (resid  539  and name ca) (resid  539  and name c )   1.0  -70.0  30.0 2 

!remark psi angles

 assign (resid 534 and name n ) (resid 534 and name ca)
        (resid 534 and name c ) (resid 535 and name n )   1.0  -24.0 30.0 2
 assign (resid 535 and name n ) (resid 535 and name ca)
        (resid 535 and name c ) (resid 536 and name n )   1.0  -13.0 30.0 2
 assign (resid 537 and name n ) (resid 537 and name ca)
        (resid 537 and name c ) (resid 538 and name n )   1.0  -27.0 30.0 2
 assign (resid 538 and name n ) (resid 538 and name ca)
        (resid 538 and name c ) (resid 539 and name n )   1.0  -22.0 30.0 2 
 assign (resid 544 and name n ) (resid 544 and name ca)
        (resid 544 and name c ) (resid 545 and name n )   1.0  -46.2 30.0 2 

! from HNHA experiment
assign (resid  518  and  name  C)  (resid  519  and  name  n)
       (resid  519  and  name  Ca) (resid  519  and  name  c)  1   -64.54  30    2
assign (resid  520  and  name  C)  (resid  521  and  name  n)
       (resid  521  and  name  Ca) (resid  521  and  name  c)  1   -69.61  30    2
assign (resid  521  and  name  C)  (resid  522  and  name  n)
       (resid  522  and  name  Ca) (resid  522  and  name  c)  1   -72.63  30    2
assign (resid  529  and  name  C)  (resid  530  and  name  n)
       (resid  530  and  name  Ca) (resid  530  and  name  c)  1   -48.55  30    2




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA 507           1HT      ALA 507 -15.257 -12.658  -4.359
    2    H2   ALA 507           2HT      ALA 507 -13.546 -12.584  -4.488
    3    H3   ALA 507           3HT      ALA 507 -14.438 -13.661  -5.483
    4    HA   ALA 507           HA       ALA 507 -13.596 -11.547  -6.496
    5    HB1  ALA 507           1HB      ALA 507 -15.402 -11.504  -7.992
    6    HB2  ALA 507           2HB      ALA 507 -16.556 -11.982  -6.747
    7    HB3  ALA 507           3HB      ALA 507 -15.382 -13.149  -7.357
    8    H    GLN 508           H        GLN 508 -14.072 -10.821  -3.702
    9    HA   GLN 508           HA       GLN 508 -14.673  -8.081  -4.073
   10    HB2  GLN 508           2HB      GLN 508 -16.674  -8.100  -2.468
   11    HB3  GLN 508           1HB      GLN 508 -16.962  -8.589  -4.132
   12    HG2  GLN 508           2HG      GLN 508 -17.670 -10.591  -3.506
   13    HG3  GLN 508           1HG      GLN 508 -16.248 -10.853  -2.499
   14   HE21  GLN 508          1HE2      GLN 508 -16.402  -9.122  -0.532
   15   HE22  GLN 508          2HE2      GLN 508 -17.859  -9.298   0.378
   16    HA   PRO 509           HA       PRO 509 -12.125  -9.518  -0.361
   17    HB2  PRO 509           2HB      PRO 509 -10.307  -7.472  -1.497
   18    HB3  PRO 509           1HB      PRO 509  -9.944  -9.096  -0.904
   19    HG2  PRO 509           2HG      PRO 509  -9.938  -8.554  -3.518
   20    HG3  PRO 509           1HG      PRO 509 -10.540 -10.104  -2.902
   21    HD2  PRO 509           2HD      PRO 509 -12.072  -7.715  -3.852
   22    HD3  PRO 509           1HD      PRO 509 -12.403  -9.442  -4.104
   23    H    LYS 510           H        LYS 510 -11.148  -8.027   1.321
   24    HA   LYS 510           HA       LYS 510 -12.608  -5.473   1.444
   25    HB2  LYS 510           2HB      LYS 510 -12.772  -5.883   3.937
   26    HB3  LYS 510           1HB      LYS 510 -13.792  -6.897   2.927
   27    HG2  LYS 510           2HG      LYS 510 -11.311  -8.228   3.284
   28    HG3  LYS 510           1HG      LYS 510 -11.874  -7.676   4.862
   29    HD2  LYS 510           2HD      LYS 510 -12.962  -9.682   4.755
   30    HD3  LYS 510           1HD      LYS 510 -14.170  -8.655   3.980
   31    HE2  LYS 510           2HE      LYS 510 -12.672  -9.326   1.843
   32    HE3  LYS 510           1HE      LYS 510 -12.453 -10.764   2.838
   33    HZ1  LYS 510           3HZ      LYS 510 -14.499 -10.430   1.182
   34    HZ2  LYS 510           1HZ      LYS 510 -15.178  -9.789   2.592
   35    HZ3  LYS 510           2HZ      LYS 510 -14.590 -11.375   2.582
   36    H    CYS 511           H        CYS 511 -11.249  -3.824   1.564
   37    HA   CYS 511           HA       CYS 511  -9.413  -2.553   1.995
   38    HB2  CYS 511           2HB      CYS 511  -8.738  -4.446   4.240
   39    HB3  CYS 511           1HB      CYS 511  -8.401  -2.723   4.126
   40    H    ASN 512           H        ASN 512  -8.085  -2.830   0.289
   41    HA   ASN 512           HA       ASN 512  -6.451  -5.215   0.105
   42    HB2  ASN 512           2HB      ASN 512  -6.548  -2.919  -1.846
   43    HB3  ASN 512           1HB      ASN 512  -5.854  -4.509  -2.112
   44   HD21  ASN 512          1HD2      ASN 512  -8.933  -2.972  -1.226
   45   HD22  ASN 512          2HD2      ASN 512  -9.924  -4.067  -2.114
   46    HA   PRO 513           HA       PRO 513  -3.067  -2.027   0.872
   47    HB2  PRO 513           2HB      PRO 513  -3.556   0.562   0.311
   48    HB3  PRO 513           1HB      PRO 513  -3.301  -0.644  -0.956
   49    HG2  PRO 513           2HG      PRO 513  -5.737   0.785  -0.303
   50    HG3  PRO 513           1HG      PRO 513  -5.426  -0.301  -1.665
   51    HD2  PRO 513           2HD      PRO 513  -6.685  -0.881   0.951
   52    HD3  PRO 513           1HD      PRO 513  -6.867  -1.713  -0.605
   53    H    ASN 514           H        ASN 514  -5.613  -2.151   2.698
   54    HA   ASN 514           HA       ASN 514  -4.731  -0.069   4.586
   55    HB2  ASN 514           2HB      ASN 514  -7.423  -0.887   3.694
   56    HB3  ASN 514           1HB      ASN 514  -7.251  -0.698   5.436
   57   HD21  ASN 514          1HD2      ASN 514  -7.198   0.910   2.353
   58   HD22  ASN 514          2HD2      ASN 514  -7.228   2.521   2.970
   59    H    LEU 515           H        LEU 515  -3.320  -2.269   4.593
   60    HA   LEU 515           HA       LEU 515  -4.406  -4.037   6.665
   61    HB2  LEU 515           2HB      LEU 515  -1.860  -4.662   5.276
   62    HB3  LEU 515           1HB      LEU 515  -3.127  -5.738   5.824
   63    HG   LEU 515           HG       LEU 515  -3.223  -5.920   3.510
   64   HD11  LEU 515          1HD1      LEU 515  -5.183  -3.708   3.621
   65   HD12  LEU 515          2HD1      LEU 515  -5.387  -5.025   4.774
   66   HD13  LEU 515          3HD1      LEU 515  -5.369  -5.363   3.043
   67   HD21  LEU 515          3HD2      LEU 515  -2.276  -4.447   2.145
   68   HD22  LEU 515          1HD2      LEU 515  -1.990  -3.393   3.531
   69   HD23  LEU 515          2HD2      LEU 515  -3.466  -3.220   2.583
   70    H    HIS 516           H        HIS 516  -1.145  -2.871   5.777
   71    HA   HIS 516           HA       HIS 516  -0.735  -1.686   8.347
   72    HB2  HIS 516           2HB      HIS 516   0.655  -3.188   9.381
   73    HB3  HIS 516           1HB      HIS 516  -0.419  -4.296   8.534
   74    HD1  HIS 516           1HD      HIS 516   0.561  -5.624   6.571
   75    HD2  HIS 516           2HD      HIS 516   3.251  -3.031   8.372
   76    HE1  HIS 516           1HE      HIS 516   2.789  -6.178   5.568
   77    HE2  HIS 516           2HE      HIS 516   4.438  -4.728   6.813
   78    H    TYR 517           H        TYR 517   1.159  -3.134   5.680
   79    HA   TYR 517           HA       TYR 517   3.292  -1.364   5.724
   80    HB2  TYR 517           2HB      TYR 517   2.766  -1.990   2.984
   81    HB3  TYR 517           1HB      TYR 517   4.067  -2.548   4.009
   82    HD1  TYR 517           2HD      TYR 517   0.395  -3.435   4.130
   83    HD2  TYR 517           1HD      TYR 517   4.387  -4.730   3.403
   84    HE1  TYR 517           2HE      TYR 517  -0.405  -5.734   3.862
   85    HE2  TYR 517           1HE      TYR 517   3.585  -7.035   3.113
   86    HH   TYR 517           HH       TYR 517   1.455  -8.183   2.505
   87    H    TRP 518           H        TRP 518   0.118  -0.599   4.950
   88    HA   TRP 518           HA       TRP 518   0.988   1.758   3.416
   89    HB2  TRP 518           2HB      TRP 518  -1.765   0.597   3.214
   90    HB3  TRP 518           1HB      TRP 518  -0.898   1.556   2.038
   91    HD1  TRP 518           HD       TRP 518   0.326  -1.739   3.613
   92    HE1  TRP 518           1HE      TRP 518   0.723  -3.407   1.750
   93    HE3  TRP 518           3HE      TRP 518  -1.411   1.012  -0.321
   94    HZ2  TRP 518           2HZ      TRP 518   0.315  -3.608  -1.026
   95    HZ3  TRP 518           3HZ      TRP 518  -1.378  -0.009  -2.560
   96    HH2  TRP 518           HH       TRP 518  -0.530  -2.272  -2.905
   97    H    THR 519           H        THR 519  -1.378   0.440   5.625
   98    HA   THR 519           HA       THR 519  -2.702   2.830   6.284
   99    HB   THR 519           HB       THR 519  -3.593   0.578   6.761
  100    HG1  THR 519           1HG      THR 519  -4.370   1.093   8.855
  101   HG21  THR 519          3HG2      THR 519  -2.661  -0.923   8.126
  102   HG22  THR 519          1HG2      THR 519  -2.132   0.300   9.280
  103   HG23  THR 519          2HG2      THR 519  -1.177  -0.015   7.828
  104    H    THR 520           H        THR 520   0.259   1.437   7.420
  105    HA   THR 520           HA       THR 520   0.434   3.199   9.709
  106    HB   THR 520           HB       THR 520   1.825   0.821   8.769
  107    HG1  THR 520           1HG      THR 520   2.174   0.631  11.021
  108   HG21  THR 520          3HG2      THR 520   3.955   1.402  10.030
  109   HG22  THR 520          1HG2      THR 520   3.513   3.090   9.771
  110   HG23  THR 520          2HG2      THR 520   3.796   2.031   8.388
  111    H    GLN 521           H        GLN 521   2.615   2.622   6.961
  112    HA   GLN 521           HA       GLN 521   3.486   5.401   7.173
  113    HB2  GLN 521           2HB      GLN 521   5.480   4.759   6.083
  114    HB3  GLN 521           1HB      GLN 521   5.130   3.479   7.233
  115    HG2  GLN 521           2HG      GLN 521   4.574   1.964   5.585
  116    HG3  GLN 521           1HG      GLN 521   4.246   3.221   4.398
  117   HE21  GLN 521          1HE2      GLN 521   6.268   4.672   4.013
  118   HE22  GLN 521          2HE2      GLN 521   7.733   3.807   3.711
  119    H    ASP 522           H        ASP 522   4.549   5.520   4.528
  120    HA   ASP 522           HA       ASP 522   2.070   6.084   3.077
  121    HB2  ASP 522           2HB      ASP 522   4.886   7.061   2.714
  122    HB3  ASP 522           1HB      ASP 522   3.573   7.450   1.613
  123    H    GLU 523           H        GLU 523   2.990   3.426   3.223
  124    HA   GLU 523           HA       GLU 523   3.463   1.589   1.947
  125    HB2  GLU 523           2HB      GLU 523   2.664   3.134  -0.491
  126    HB3  GLU 523           1HB      GLU 523   2.337   1.455  -0.082
  127    HG2  GLU 523           2HG      GLU 523   0.701   2.080   1.510
  128    HG3  GLU 523           1HG      GLU 523   1.125   3.782   1.373
  129    H    GLY 524           H        GLY 524   5.558   3.418   2.419
  130    HA2  GLY 524           2HA      GLY 524   7.824   3.269   1.834
  131    HA3  GLY 524           1HA      GLY 524   7.353   2.597   0.282
  132    H    ALA 525           H        ALA 525   6.023   5.571   1.635
  133    HA   ALA 525           HA       ALA 525   7.454   7.027  -0.484
  134    HB1  ALA 525           1HB      ALA 525   4.781   6.664  -0.438
  135    HB2  ALA 525           2HB      ALA 525   5.582   8.038  -1.198
  136    HB3  ALA 525           3HB      ALA 525   4.920   8.193   0.428
  137    H    ALA 526           H        ALA 526   7.176   6.733   2.818
  138    HA   ALA 526           HA       ALA 526   7.559   9.522   3.378
  139    HB1  ALA 526           1HB      ALA 526   7.338   8.994   5.674
  140    HB2  ALA 526           2HB      ALA 526   7.627   7.281   5.369
  141    HB3  ALA 526           3HB      ALA 526   6.132   8.036   4.816
  142    H    ILE 527           H        ILE 527   9.542   7.614   2.006
  143    HA   ILE 527           HA       ILE 527  11.867   8.421   3.612
  144    HB   ILE 527           HB       ILE 527  12.553   6.107   2.107
  145   HG12  ILE 527          2HG1      ILE 527  11.023   4.498   3.387
  146   HG13  ILE 527          1HG1      ILE 527   9.977   5.878   3.662
  147   HG21  ILE 527          1HG2      ILE 527  12.131   6.034   5.055
  148   HG22  ILE 527          2HG2      ILE 527  13.335   7.136   4.387
  149   HG23  ILE 527          3HG2      ILE 527  13.466   5.403   4.089
  150   HD11  ILE 527          3HD1      ILE 527   9.152   5.783   1.601
  151   HD12  ILE 527          1HD1      ILE 527   9.862   4.170   1.533
  152   HD13  ILE 527          2HD1      ILE 527  10.742   5.550   0.876
  153    H    GLY 528           H        GLY 528  10.720   7.461   0.383
  154    HA2  GLY 528           2HA      GLY 528  11.356   9.286  -1.304
  155    HA3  GLY 528           1HA      GLY 528  12.995   8.926  -0.785
  156    H    LEU 529           H        LEU 529  11.985   6.045  -0.517
  157    HA   LEU 529           HA       LEU 529  11.796   4.134  -1.766
  158    HB2  LEU 529           2HB      LEU 529  10.440   5.852  -3.291
  159    HB3  LEU 529           1HB      LEU 529  11.789   5.526  -4.366
  160    HG   LEU 529           HG       LEU 529  11.246   3.036  -3.914
  161   HD11  LEU 529          1HD1      LEU 529   9.468   4.053  -2.160
  162   HD12  LEU 529          2HD1      LEU 529   9.327   2.465  -2.912
  163   HD13  LEU 529          3HD1      LEU 529   8.444   3.837  -3.582
  164   HD21  LEU 529          3HD2      LEU 529   9.054   3.976  -5.524
  165   HD22  LEU 529          1HD2      LEU 529  10.517   3.121  -6.005
  166   HD23  LEU 529          2HD2      LEU 529  10.529   4.879  -5.867
  167    H    ALA 530           H        ALA 530  13.733   6.542  -3.450
  168    HA   ALA 530           HA       ALA 530  15.576   4.557  -4.358
  169    HB1  ALA 530           1HB      ALA 530  16.912   6.624  -5.070
  170    HB2  ALA 530           2HB      ALA 530  15.487   7.536  -4.574
  171    HB3  ALA 530           3HB      ALA 530  15.358   6.321  -5.845
  172    H    TRP 531           H        TRP 531  15.485   4.280  -1.698
  173    HA   TRP 531           HA       TRP 531  18.101   5.274  -0.776
  174    HB2  TRP 531           2HB      TRP 531  17.106   4.977   1.565
  175    HB3  TRP 531           1HB      TRP 531  16.473   6.324   0.619
  176    HD1  TRP 531           HD       TRP 531  14.166   5.678  -0.793
  177    HE1  TRP 531           1HE      TRP 531  12.130   4.386   0.037
  178    HE3  TRP 531           3HE      TRP 531  16.285   3.334   3.212
  179    HZ2  TRP 531           2HZ      TRP 531  11.468   2.617   2.132
  180    HZ3  TRP 531           3HZ      TRP 531  14.876   1.862   4.593
  181    HH2  TRP 531           HH       TRP 531  12.515   1.513   4.066
  182    H    ILE 532           H        ILE 532  16.073   2.632  -1.489
  183    HA   ILE 532           HA       ILE 532  17.899   0.752  -0.149
  184    HB   ILE 532           HB       ILE 532  16.024  -0.882  -0.422
  185   HG12  ILE 532          2HG1      ILE 532  14.873   1.264  -1.858
  186   HG13  ILE 532          1HG1      ILE 532  14.231  -0.345  -1.595
  187   HG21  ILE 532          1HG2      ILE 532  15.084  -0.382   1.635
  188   HG22  ILE 532          2HG2      ILE 532  15.169   1.358   1.355
  189   HG23  ILE 532          3HG2      ILE 532  16.642   0.444   1.678
  190   HD11  ILE 532          3HD1      ILE 532  13.552   2.206  -0.282
  191   HD12  ILE 532          1HD1      ILE 532  13.468   0.743   0.699
  192   HD13  ILE 532          2HD1      ILE 532  12.516   0.871  -0.779
  193    HA   PRO 533           HA       PRO 533  18.650  -0.921  -4.186
  194    HB2  PRO 533           2HB      PRO 533  19.601  -3.339  -3.569
  195    HB3  PRO 533           1HB      PRO 533  20.431  -1.865  -3.060
  196    HG2  PRO 533           2HG      PRO 533  18.831  -3.775  -1.463
  197    HG3  PRO 533           1HG      PRO 533  20.155  -2.716  -0.956
  198    HD2  PRO 533           2HD      PRO 533  17.343  -2.267  -0.680
  199    HD3  PRO 533           1HD      PRO 533  18.668  -1.176  -0.226
  200    H    TYR 534           H        TYR 534  15.935  -2.014  -2.536
  201    HA   TYR 534           HA       TYR 534  14.775  -3.129  -4.840
  202    HB2  TYR 534           2HB      TYR 534  14.612  -5.504  -4.142
  203    HB3  TYR 534           1HB      TYR 534  16.257  -4.996  -4.508
  204    HD1  TYR 534           2HD      TYR 534  13.926  -5.356  -1.615
  205    HD2  TYR 534           1HD      TYR 534  17.945  -5.497  -3.001
  206    HE1  TYR 534           2HE      TYR 534  14.654  -6.151   0.595
  207    HE2  TYR 534           1HE      TYR 534  18.686  -6.293  -0.796
  208    HH   TYR 534           HH       TYR 534  16.483  -7.342   1.613
  209    H    PHE 535           H        PHE 535  14.630  -2.551  -1.413
  210    HA   PHE 535           HA       PHE 535  12.140  -3.674  -0.824
  211    HB2  PHE 535           2HB      PHE 535  13.339  -1.149   0.318
  212    HB3  PHE 535           1HB      PHE 535  11.997  -2.036   1.016
  213    HD1  PHE 535           1HD      PHE 535  15.582  -2.258   0.177
  214    HD2  PHE 535           2HD      PHE 535  12.372  -3.823   2.475
  215    HE1  PHE 535           1HE      PHE 535  17.180  -3.554   1.499
  216    HE2  PHE 535           2HE      PHE 535  13.968  -5.139   3.806
  217    HZ   PHE 535           HZ       PHE 535  16.379  -5.000   3.319
  218    H    GLY 536           H        GLY 536  12.940  -0.690  -2.468
  219    HA2  GLY 536           2HA      GLY 536  10.073  -0.023  -2.585
  220    HA3  GLY 536           1HA      GLY 536  11.378   1.142  -2.742
  221    HA   PRO 537           HA       PRO 537  11.586   1.012  -7.127
  222    HB2  PRO 537           2HB      PRO 537  14.162  -0.489  -7.009
  223    HB3  PRO 537           1HB      PRO 537  13.760   0.991  -7.888
  224    HG2  PRO 537           2HG      PRO 537  15.205   1.067  -5.644
  225    HG3  PRO 537           1HG      PRO 537  14.022   2.333  -6.020
  226    HD2  PRO 537           2HD      PRO 537  13.871   0.120  -4.044
  227    HD3  PRO 537           1HD      PRO 537  13.149   1.739  -3.987
  228    H    ALA 538           H        ALA 538  12.673  -2.015  -5.629
  229    HA   ALA 538           HA       ALA 538  11.768  -3.604  -7.868
  230    HB1  ALA 538           1HB      ALA 538  12.427  -4.880  -5.272
  231    HB2  ALA 538           2HB      ALA 538  13.720  -4.042  -6.129
  232    HB3  ALA 538           3HB      ALA 538  12.854  -5.361  -6.913
  233    H    ALA 539           H        ALA 539  10.583  -2.672  -4.713
  234    HA   ALA 539           HA       ALA 539   8.602  -4.549  -4.260
  235    HB1  ALA 539           1HB      ALA 539   7.400  -2.373  -3.279
  236    HB2  ALA 539           2HB      ALA 539   9.033  -1.734  -3.471
  237    HB3  ALA 539           3HB      ALA 539   8.757  -3.166  -2.479
  238    H    GLU 540           H        GLU 540   6.283  -4.424  -4.562
  239    HA   GLU 540           HA       GLU 540   5.375  -2.813  -6.830
  240    HB2  GLU 540           2HB      GLU 540   4.897  -5.792  -6.679
  241    HB3  GLU 540           1HB      GLU 540   4.399  -4.707  -7.969
  242    HG2  GLU 540           2HG      GLU 540   7.106  -4.305  -7.865
  243    HG3  GLU 540           1HG      GLU 540   6.954  -6.025  -7.506
  244    H    GLY 541           H        GLY 541   4.541  -5.050  -4.228
  245    HA2  GLY 541           2HA      GLY 541   1.874  -3.788  -4.063
  246    HA3  GLY 541           1HA      GLY 541   2.236  -5.420  -3.514
  247    H    ILE 542           H        ILE 542   4.278  -2.639  -2.989
  248    HA   ILE 542           HA       ILE 542   3.428  -2.378  -0.214
  249    HB   ILE 542           HB       ILE 542   6.364  -2.643  -0.671
  250   HG12  ILE 542          2HG1      ILE 542   6.055  -5.113   0.024
  251   HG13  ILE 542          1HG1      ILE 542   4.409  -4.924  -0.577
  252   HG21  ILE 542          1HG2      ILE 542   4.446  -2.921   1.599
  253   HG22  ILE 542          2HG2      ILE 542   5.930  -1.974   1.488
  254   HG23  ILE 542          3HG2      ILE 542   6.013  -3.726   1.683
  255   HD11  ILE 542          3HD1      ILE 542   5.284  -5.570  -2.530
  256   HD12  ILE 542          1HD1      ILE 542   6.931  -5.188  -2.031
  257   HD13  ILE 542          2HD1      ILE 542   5.876  -3.910  -2.642
  258    H    TYR 543           H        TYR 543   5.420  -1.359  -2.912
  259    HA   TYR 543           HA       TYR 543   5.787   1.258  -1.749
  260    HB2  TYR 543           2HB      TYR 543   7.716   1.318  -2.902
  261    HB3  TYR 543           1HB      TYR 543   7.504  -0.416  -2.996
  262    HD1  TYR 543           2HD      TYR 543   5.811  -1.059  -5.053
  263    HD2  TYR 543           1HD      TYR 543   8.399   2.298  -4.844
  264    HE1  TYR 543           2HE      TYR 543   5.828  -0.924  -7.505
  265    HE2  TYR 543           1HE      TYR 543   8.445   2.447  -7.282
  266    HH   TYR 543           HH       TYR 543   6.285   0.629  -9.270
  267    H    ILE 544           H        ILE 544   4.165  -0.470  -4.274
  268    HA   ILE 544           HA       ILE 544   2.950   0.196  -6.123
  269    HB   ILE 544           HB       ILE 544   1.499   1.830  -4.067
  270   HG12  ILE 544          2HG1      ILE 544   0.308  -0.511  -3.763
  271   HG13  ILE 544          1HG1      ILE 544   1.895  -1.120  -4.215
  272   HG21  ILE 544          1HG2      ILE 544   0.442   2.025  -6.134
  273   HG22  ILE 544          2HG2      ILE 544  -0.453   0.736  -5.329
  274   HG23  ILE 544          3HG2      ILE 544   0.751   0.340  -6.556
  275   HD11  ILE 544          3HD1      ILE 544   1.823  -1.047  -1.856
  276   HD12  ILE 544          1HD1      ILE 544   1.180   0.593  -1.857
  277   HD13  ILE 544          2HD1      ILE 544   2.840   0.297  -2.367
  278    H    GLU 545           H        GLU 545   2.828   3.126  -4.155
  279    HA   GLU 545           HA       GLU 545   3.270   5.301  -4.600
  280    HB2  GLU 545           2HB      GLU 545   4.761   4.239  -7.000
  281    HB3  GLU 545           1HB      GLU 545   4.886   5.865  -6.336
  282    HG2  GLU 545           2HG      GLU 545   5.423   4.414  -4.141
  283    HG3  GLU 545           1HG      GLU 545   6.055   3.334  -5.385
  284    H    GLY 546           H        GLY 546   1.164   5.850  -4.922
  285    HA2  GLY 546           2HA      GLY 546   0.302   7.255  -6.992
  286    HA3  GLY 546           1HA      GLY 546   0.017   5.628  -7.591
  287    H    LEU 547           H        LEU 547  -0.458   5.142  -4.448
  288    HA   LEU 547           HA       LEU 547  -3.249   6.108  -4.503
  289    HB2  LEU 547           2HB      LEU 547  -4.066   4.047  -3.692
  290    HB3  LEU 547           1HB      LEU 547  -3.035   3.686  -5.064
  291    HG   LEU 547           HG       LEU 547  -2.096   3.471  -2.211
  292   HD11  LEU 547          1HD1      LEU 547  -2.747   1.052  -3.788
  293   HD12  LEU 547          2HD1      LEU 547  -4.093   1.958  -3.098
  294   HD13  LEU 547          3HD1      LEU 547  -2.823   1.331  -2.048
  295   HD21  LEU 547          3HD2      LEU 547  -0.584   1.771  -3.583
  296   HD22  LEU 547          1HD2      LEU 547  -0.173   3.479  -3.422
  297   HD23  LEU 547          2HD2      LEU 547  -0.962   2.896  -4.888
  298    H    MET 548           H        MET 548  -0.373   5.956  -2.760
  299    HA   MET 548           HA       MET 548  -1.297   5.830  -0.108
  300    HB2  MET 548           2HB      MET 548   1.075   7.510  -0.857
  301    HB3  MET 548           1HB      MET 548   0.835   6.508   0.563
  302    HG2  MET 548           2HG      MET 548   1.863   4.810  -0.390
  303    HG3  MET 548           1HG      MET 548   0.796   4.870  -1.788
  304    HE1  MET 548           3HE      MET 548   1.988   8.241  -2.590
  305    HE2  MET 548           1HE      MET 548   0.993   7.003  -3.354
  306    HE3  MET 548           2HE      MET 548   2.538   7.457  -4.071
  307    H    HIS 549           H        HIS 549  -3.219   7.128  -0.231
  308    HA   HIS 549           HA       HIS 549  -2.639   9.976   0.194
  309    HB2  HIS 549           2HB      HIS 549  -5.163   9.080  -1.168
  310    HB3  HIS 549           1HB      HIS 549  -4.425  10.679  -1.159
  311    HD1  HIS 549           1HD      HIS 549  -5.179   8.478  -3.574
  312    HD2  HIS 549           2HD      HIS 549  -1.490   9.933  -2.340
  313    HE1  HIS 549           1HE      HIS 549  -3.636   8.142  -5.527
  314    HE2  HIS 549           2HE      HIS 549  -1.440   9.135  -4.800
  315    H    ASN 550           H        ASN 550  -3.031   7.729   2.020
  316    HA   ASN 550           HA       ASN 550  -4.169   7.160   3.909
  317    HB2  ASN 550           2HB      ASN 550  -4.771  10.112   3.738
  318    HB3  ASN 550           1HB      ASN 550  -5.236   9.120   5.116
  319   HD21  ASN 550          1HD2      ASN 550  -3.362  11.389   4.873
  320   HD22  ASN 550          2HD2      ASN 550  -1.859  10.809   5.499
  321    H    GLN 551           H        GLN 551  -5.506   6.163   1.921
  322    HA   GLN 551           HA       GLN 551  -8.276   7.094   2.039
  323    HB2  GLN 551           2HB      GLN 551  -8.031   4.794   0.366
  324    HB3  GLN 551           1HB      GLN 551  -8.411   6.446  -0.091
  325    HG2  GLN 551           2HG      GLN 551  -6.583   6.118  -1.377
  326    HG3  GLN 551           1HG      GLN 551  -5.789   6.718   0.075
  327   HE21  GLN 551          1HE2      GLN 551  -6.138   4.314   1.612
  328   HE22  GLN 551          2HE2      GLN 551  -5.070   3.132   0.952
  329    H    ASP 552           H        ASP 552  -9.921   5.253   1.962
  330    HA   ASP 552           HA       ASP 552  -9.470   2.766   3.124
  331    HB2  ASP 552           2HB      ASP 552  -8.818   4.139   5.115
  332    HB3  ASP 552           1HB      ASP 552 -10.451   4.794   5.152
  333    H    GLY 553           H        GLY 553 -11.080   4.141   1.159
  334    HA2  GLY 553           2HA      GLY 553 -13.720   3.122   1.976
  335    HA3  GLY 553           1HA      GLY 553 -13.582   4.698   1.201
  336    H    LEU 554           H        LEU 554 -11.509   4.033  -0.580
  337    HA   LEU 554           HA       LEU 554 -13.012   2.789  -2.685
  338    HB2  LEU 554           2HB      LEU 554 -10.919   3.218  -3.999
  339    HB3  LEU 554           1HB      LEU 554 -11.641   4.642  -3.274
  340    HG   LEU 554           HG       LEU 554  -9.772   3.702  -1.383
  341   HD11  LEU 554          1HD1      LEU 554  -8.979   2.500  -3.618
  342   HD12  LEU 554          2HD1      LEU 554  -7.844   3.151  -2.436
  343   HD13  LEU 554          3HD1      LEU 554  -8.235   4.075  -3.886
  344   HD21  LEU 554          3HD2      LEU 554  -9.912   5.958  -1.405
  345   HD22  LEU 554          1HD2      LEU 554 -10.143   6.040  -3.151
  346   HD23  LEU 554          2HD2      LEU 554  -8.527   5.805  -2.487
  347    H    ILE 555           H        ILE 555 -11.233   1.571  -0.171
  348    HA   ILE 555           HA       ILE 555 -10.803  -0.963  -1.555
  349    HB   ILE 555           HB       ILE 555  -8.605  -1.233  -0.484
  350   HG12  ILE 555          2HG1      ILE 555  -8.904   0.359   1.375
  351   HG13  ILE 555          1HG1      ILE 555  -7.440   0.680   0.472
  352   HG21  ILE 555          1HG2      ILE 555  -8.100   1.233  -1.942
  353   HG22  ILE 555          2HG2      ILE 555  -9.178   0.113  -2.779
  354   HG23  ILE 555          3HG2      ILE 555  -7.571  -0.420  -2.276
  355   HD11  ILE 555          3HD1      ILE 555  -9.216   2.279  -0.790
  356   HD12  ILE 555          1HD1      ILE 555  -8.105   2.785   0.479
  357   HD13  ILE 555          2HD1      ILE 555  -9.768   2.356   0.882
  358    H    CYS 556           H        CYS 556 -10.757   0.817   1.496
  359    HA   CYS 556           HA       CYS 556 -11.553  -1.640   2.878
  360    HB2  CYS 556           2HB      CYS 556  -9.353  -0.431   3.471
  361    HB3  CYS 556           1HB      CYS 556 -10.377   0.795   4.205
  362    H    GLY 557           H        GLY 557 -13.697  -0.740   1.809
  363    HA2  GLY 557           2HA      GLY 557 -14.950   1.237   3.582
  364    HA3  GLY 557           1HA      GLY 557 -15.574   0.712   2.025
  365    H    LEU 558           H        LEU 558 -15.856  -1.866   2.074
  366    HA   LEU 558           HA       LEU 558 -16.997  -2.723   4.603
  367    HB2  LEU 558           2HB      LEU 558 -19.158  -3.241   3.713
  368    HB3  LEU 558           1HB      LEU 558 -18.816  -1.549   3.418
  369    HG   LEU 558           HG       LEU 558 -18.404  -3.641   1.296
  370   HD11  LEU 558          1HD1      LEU 558 -20.759  -3.633   2.179
  371   HD12  LEU 558          2HD1      LEU 558 -20.585  -3.253   0.465
  372   HD13  LEU 558          3HD1      LEU 558 -20.873  -1.961   1.630
  373   HD21  LEU 558          3HD2      LEU 558 -18.852  -1.562  -0.122
  374   HD22  LEU 558          1HD2      LEU 558 -17.303  -1.662   0.714
  375   HD23  LEU 558          2HD2      LEU 558 -18.590  -0.648   1.364
  376    H    ARG 559           H        ARG 559 -16.439  -3.547   1.183
  377    HA   ARG 559           HA       ARG 559 -14.905  -5.797   1.675
  378    HB2  ARG 559           2HB      ARG 559 -16.442  -7.646   1.260
  379    HB3  ARG 559           1HB      ARG 559 -16.944  -6.747   2.685
  380    HG2  ARG 559           2HG      ARG 559 -18.142  -5.765   0.222
  381    HG3  ARG 559           1HG      ARG 559 -18.553  -7.445   0.583
  382    HD2  ARG 559           2HD      ARG 559 -18.851  -5.131   2.496
  383    HD3  ARG 559           1HD      ARG 559 -20.158  -5.827   1.541
  384    HE   ARG 559           HE       ARG 559 -18.998  -6.903   3.939
  385   HH11  ARG 559          1HH1      ARG 559 -20.743  -7.671   1.017
  386   HH12  ARG 559          2HH1      ARG 559 -21.435  -9.121   1.662
  387   HH21  ARG 559          1HH2      ARG 559 -19.904  -8.813   4.789
  388   HH22  ARG 559          2HH2      ARG 559 -20.957  -9.772   3.803
  389    H    GLN 560           H        GLN 560 -15.043  -3.678  -0.152
  390    HA   GLN 560           HA       GLN 560 -15.634  -5.000  -2.702
  391    HB2  GLN 560           2HB      GLN 560 -15.755  -2.871  -3.709
  392    HB3  GLN 560           1HB      GLN 560 -16.585  -2.711  -2.169
  393    HG2  GLN 560           2HG      GLN 560 -13.810  -2.062  -1.852
  394    HG3  GLN 560           1HG      GLN 560 -14.506  -1.130  -3.179
  395   HE21  GLN 560          1HE2      GLN 560 -14.719  -1.873   0.224
  396   HE22  GLN 560          2HE2      GLN 560 -15.643  -0.485   0.668
  Start of MODEL    2
    1    H1   ALA 507           1HT      ALA 507 -12.187 -11.286  -7.790
    2    H2   ALA 507           2HT      ALA 507 -10.645 -11.150  -7.050
    3    H3   ALA 507           3HT      ALA 507 -10.769 -11.357  -8.749
    4    HA   ALA 507           HA       ALA 507 -10.276  -9.076  -7.858
    5    HB1  ALA 507           1HB      ALA 507 -12.661  -8.989  -9.614
    6    HB2  ALA 507           2HB      ALA 507 -11.276  -9.931 -10.167
    7    HB3  ALA 507           3HB      ALA 507 -11.087  -8.216  -9.799
    8    H    GLN 508           H        GLN 508 -11.298  -9.595  -5.547
    9    HA   GLN 508           HA       GLN 508 -13.129  -7.466  -5.054
   10    HB2  GLN 508           2HB      GLN 508 -14.847  -8.987  -3.937
   11    HB3  GLN 508           1HB      GLN 508 -14.860  -8.932  -5.694
   12    HG2  GLN 508           2HG      GLN 508 -13.764 -11.040  -5.845
   13    HG3  GLN 508           1HG      GLN 508 -13.456 -11.065  -4.109
   14   HE21  GLN 508          1HE2      GLN 508 -15.754 -10.484  -2.956
   15   HE22  GLN 508          2HE2      GLN 508 -16.994 -11.607  -3.387
   16    HA   PRO 509           HA       PRO 509 -10.440  -9.038  -1.519
   17    HB2  PRO 509           2HB      PRO 509  -8.447  -7.244  -1.600
   18    HB3  PRO 509           1HB      PRO 509  -8.432  -8.691  -2.616
   19    HG2  PRO 509           2HG      PRO 509  -9.175  -5.882  -3.332
   20    HG3  PRO 509           1HG      PRO 509  -8.213  -7.054  -4.251
   21    HD2  PRO 509           2HD      PRO 509 -10.863  -6.541  -4.732
   22    HD3  PRO 509           1HD      PRO 509 -10.067  -8.080  -5.116
   23    H    LYS 510           H        LYS 510 -10.798  -8.287   0.502
   24    HA   LYS 510           HA       LYS 510 -12.134  -5.708   0.770
   25    HB2  LYS 510           2HB      LYS 510 -12.792  -6.476   2.980
   26    HB3  LYS 510           1HB      LYS 510 -13.168  -7.705   1.780
   27    HG2  LYS 510           2HG      LYS 510 -10.942  -8.772   2.429
   28    HG3  LYS 510           1HG      LYS 510 -10.984  -7.702   3.832
   29    HD2  LYS 510           2HD      LYS 510 -12.094  -9.426   4.778
   30    HD3  LYS 510           1HD      LYS 510 -13.477  -8.727   3.933
   31    HE2  LYS 510           2HE      LYS 510 -12.519 -10.270   1.973
   32    HE3  LYS 510           1HE      LYS 510 -11.938 -11.192   3.359
   33    HZ1  LYS 510           3HZ      LYS 510 -14.129 -11.925   2.617
   34    HZ2  LYS 510           1HZ      LYS 510 -14.760 -10.382   2.908
   35    HZ3  LYS 510           2HZ      LYS 510 -14.187 -11.319   4.194
   36    H    CYS 511           H        CYS 511 -11.134  -3.953   1.488
   37    HA   CYS 511           HA       CYS 511  -9.494  -2.576   2.266
   38    HB2  CYS 511           2HB      CYS 511  -8.961  -4.602   4.420
   39    HB3  CYS 511           1HB      CYS 511  -8.938  -2.846   4.527
   40    H    ASN 512           H        ASN 512  -8.016  -2.729   0.610
   41    HA   ASN 512           HA       ASN 512  -5.952  -4.764   0.741
   42    HB2  ASN 512           2HB      ASN 512  -6.249  -2.627  -1.359
   43    HB3  ASN 512           1HB      ASN 512  -5.307  -4.108  -1.460
   44   HD21  ASN 512          1HD2      ASN 512  -8.625  -2.928  -1.067
   45   HD22  ASN 512          2HD2      ASN 512  -9.371  -4.242  -1.900
   46    HA   PRO 513           HA       PRO 513  -3.313  -0.927   1.497
   47    HB2  PRO 513           2HB      PRO 513  -4.356   1.512   0.911
   48    HB3  PRO 513           1HB      PRO 513  -3.735   0.414  -0.321
   49    HG2  PRO 513           2HG      PRO 513  -6.464   1.235   0.125
   50    HG3  PRO 513           1HG      PRO 513  -5.810   0.241  -1.183
   51    HD2  PRO 513           2HD      PRO 513  -7.122  -0.592   1.327
   52    HD3  PRO 513           1HD      PRO 513  -6.969  -1.452  -0.216
   53    H    ASN 514           H        ASN 514  -5.912  -1.548   3.204
   54    HA   ASN 514           HA       ASN 514  -5.423   0.570   5.187
   55    HB2  ASN 514           2HB      ASN 514  -7.957  -0.495   4.092
   56    HB3  ASN 514           1HB      ASN 514  -7.918  -0.275   5.839
   57   HD21  ASN 514          1HD2      ASN 514  -7.810   1.299   2.741
   58   HD22  ASN 514          2HD2      ASN 514  -8.023   2.907   3.331
   59    H    LEU 515           H        LEU 515  -3.763  -1.308   5.463
   60    HA   LEU 515           HA       LEU 515  -4.850  -3.220   7.421
   61    HB2  LEU 515           2HB      LEU 515  -2.217  -3.801   6.235
   62    HB3  LEU 515           1HB      LEU 515  -3.552  -4.875   6.581
   63    HG   LEU 515           HG       LEU 515  -3.212  -4.939   4.242
   64   HD11  LEU 515          1HD1      LEU 515  -5.418  -5.004   4.073
   65   HD12  LEU 515          2HD1      LEU 515  -5.373  -3.292   3.660
   66   HD13  LEU 515          3HD1      LEU 515  -5.619  -3.789   5.333
   67   HD21  LEU 515          3HD2      LEU 515  -2.314  -2.303   4.531
   68   HD22  LEU 515          1HD2      LEU 515  -3.720  -2.212   3.471
   69   HD23  LEU 515          2HD2      LEU 515  -2.365  -3.261   3.049
   70    H    HIS 516           H        HIS 516  -1.616  -2.053   6.592
   71    HA   HIS 516           HA       HIS 516  -1.304  -0.716   9.148
   72    HB2  HIS 516           2HB      HIS 516   0.560  -1.930   9.908
   73    HB3  HIS 516           1HB      HIS 516  -0.578  -3.175   9.407
   74    HD1  HIS 516           1HD      HIS 516   0.100  -4.659   7.431
   75    HD2  HIS 516           2HD      HIS 516   2.803  -1.615   8.242
   76    HE1  HIS 516           1HE      HIS 516   2.101  -5.140   5.989
   77    HE2  HIS 516           2HE      HIS 516   3.787  -3.371   6.608
   78    H    TYR 517           H        TYR 517   0.463  -1.872   6.286
   79    HA   TYR 517           HA       TYR 517   2.075   0.455   6.111
   80    HB2  TYR 517           2HB      TYR 517   2.016  -0.443   3.525
   81    HB3  TYR 517           1HB      TYR 517   3.163  -0.970   4.741
   82    HD1  TYR 517           1HD      TYR 517  -0.406  -2.034   4.687
   83    HD2  TYR 517           2HD      TYR 517   3.622  -3.079   3.798
   84    HE1  TYR 517           1HE      TYR 517  -1.094  -4.364   4.315
   85    HE2  TYR 517           2HE      TYR 517   2.941  -5.408   3.421
   86    HH   TYR 517           HH       TYR 517   0.704  -6.585   2.733
   87    H    TRP 518           H        TRP 518   1.792   1.702   3.788
   88    HA   TRP 518           HA       TRP 518   0.527   3.222   2.664
   89    HB2  TRP 518           2HB      TRP 518  -2.025   1.787   3.203
   90    HB3  TRP 518           1HB      TRP 518  -1.465   2.538   1.729
   91    HD1  TRP 518           HD       TRP 518  -0.060  -0.464   3.712
   92    HE1  TRP 518           1HE      TRP 518   0.228  -2.398   2.120
   93    HE3  TRP 518           3HE      TRP 518  -1.870   1.736  -0.509
   94    HZ2  TRP 518           2HZ      TRP 518  -0.303  -2.993  -0.581
   95    HZ3  TRP 518           3HZ      TRP 518  -1.959   0.397  -2.573
   96    HH2  TRP 518           HH       TRP 518  -1.185  -1.920  -2.611
   97    H    THR 519           H        THR 519  -1.072   2.075   5.584
   98    HA   THR 519           HA       THR 519  -2.191   4.717   6.101
   99    HB   THR 519           HB       THR 519  -3.631   2.738   6.414
  100    HG1  THR 519           1HG      THR 519  -4.262   3.229   8.568
  101   HG21  THR 519          3HG2      THR 519  -1.667   1.944   8.557
  102   HG22  THR 519          1HG2      THR 519  -1.982   1.075   7.055
  103   HG23  THR 519          2HG2      THR 519  -3.245   1.205   8.281
  104    H    THR 520           H        THR 520   0.425   2.694   6.918
  105    HA   THR 520           HA       THR 520   0.985   3.970   9.458
  106    HB   THR 520           HB       THR 520   2.145   1.731   7.867
  107    HG1  THR 520           1HG      THR 520   1.673   2.024  10.642
  108   HG21  THR 520          3HG2      THR 520   3.985   1.607   9.647
  109   HG22  THR 520          1HG2      THR 520   3.723   3.342   9.825
  110   HG23  THR 520          2HG2      THR 520   4.221   2.682   8.266
  111    H    GLN 521           H        GLN 521   3.218   3.381   6.792
  112    HA   GLN 521           HA       GLN 521   4.301   6.065   7.186
  113    HB2  GLN 521           2HB      GLN 521   6.319   5.249   6.160
  114    HB3  GLN 521           1HB      GLN 521   5.809   4.096   7.383
  115    HG2  GLN 521           2HG      GLN 521   5.513   2.457   5.901
  116    HG3  GLN 521           1HG      GLN 521   4.775   3.521   4.711
  117   HE21  GLN 521          1HE2      GLN 521   6.412   5.098   3.678
  118   HE22  GLN 521          2HE2      GLN 521   7.933   4.429   3.224
  119    H    ASP 522           H        ASP 522   5.620   6.271   4.751
  120    HA   ASP 522           HA       ASP 522   3.428   7.086   3.018
  121    HB2  ASP 522           2HB      ASP 522   5.757   8.315   3.741
  122    HB3  ASP 522           1HB      ASP 522   6.148   7.682   2.147
  123    H    GLU 523           H        GLU 523   4.420   4.254   3.287
  124    HA   GLU 523           HA       GLU 523   4.942   2.455   1.978
  125    HB2  GLU 523           2HB      GLU 523   3.401   4.150   0.014
  126    HB3  GLU 523           1HB      GLU 523   3.821   2.463  -0.249
  127    HG2  GLU 523           2HG      GLU 523   2.691   2.242   2.137
  128    HG3  GLU 523           1HG      GLU 523   1.821   3.655   1.539
  129    H    GLY 524           H        GLY 524   7.152   3.069   2.144
  130    HA2  GLY 524           2HA      GLY 524   9.250   3.449   1.304
  131    HA3  GLY 524           1HA      GLY 524   8.584   2.840  -0.204
  132    H    ALA 525           H        ALA 525   7.106   5.703   1.129
  133    HA   ALA 525           HA       ALA 525   8.423   7.216  -1.014
  134    HB1  ALA 525           1HB      ALA 525   5.881   6.887  -0.941
  135    HB2  ALA 525           2HB      ALA 525   6.515   8.497  -1.282
  136    HB3  ALA 525           3HB      ALA 525   5.912   8.110   0.328
  137    H    ALA 526           H        ALA 526   8.023   7.076   2.401
  138    HA   ALA 526           HA       ALA 526   8.924   9.767   2.808
  139    HB1  ALA 526           1HB      ALA 526   7.994   7.582   4.599
  140    HB2  ALA 526           2HB      ALA 526   7.408   9.239   4.453
  141    HB3  ALA 526           3HB      ALA 526   8.934   8.913   5.274
  142    H    ILE 527           H        ILE 527  10.576   7.599   1.513
  143    HA   ILE 527           HA       ILE 527  12.979   7.955   3.154
  144    HB   ILE 527           HB       ILE 527  13.335   5.549   1.792
  145   HG12  ILE 527          2HG1      ILE 527  10.825   5.597   1.470
  146   HG13  ILE 527          1HG1      ILE 527  11.454   4.164   2.266
  147   HG21  ILE 527          1HG2      ILE 527  14.307   5.442   3.810
  148   HG22  ILE 527          2HG2      ILE 527  12.770   4.750   4.326
  149   HG23  ILE 527          3HG2      ILE 527  13.086   6.468   4.564
  150   HD11  ILE 527          3HD1      ILE 527  10.825   6.042   4.275
  151   HD12  ILE 527          1HD1      ILE 527  10.048   4.497   3.932
  152   HD13  ILE 527          2HD1      ILE 527   9.467   5.970   3.155
  153    H    GLY 528           H        GLY 528  11.696   7.005  -0.025
  154    HA2  GLY 528           2HA      GLY 528  12.590   8.657  -1.793
  155    HA3  GLY 528           1HA      GLY 528  14.154   8.056  -1.267
  156    H    LEU 529           H        LEU 529  12.494   5.382  -0.934
  157    HA   LEU 529           HA       LEU 529  12.106   3.491  -2.138
  158    HB2  LEU 529           2HB      LEU 529  11.441   5.638  -3.974
  159    HB3  LEU 529           1HB      LEU 529  12.073   4.244  -4.824
  160    HG   LEU 529           HG       LEU 529   9.608   4.412  -3.111
  161   HD11  LEU 529          1HD1      LEU 529   9.096   3.062  -5.468
  162   HD12  LEU 529          2HD1      LEU 529  10.217   4.339  -5.943
  163   HD13  LEU 529          3HD1      LEU 529   8.712   4.748  -5.119
  164   HD21  LEU 529          3HD2      LEU 529   9.462   1.908  -3.725
  165   HD22  LEU 529          1HD2      LEU 529  10.476   2.395  -2.362
  166   HD23  LEU 529          2HD2      LEU 529  11.211   2.024  -3.922
  167    H    ALA 530           H        ALA 530  14.210   5.566  -4.039
  168    HA   ALA 530           HA       ALA 530  15.803   3.340  -4.869
  169    HB1  ALA 530           1HB      ALA 530  16.309   6.277  -5.264
  170    HB2  ALA 530           2HB      ALA 530  15.430   5.221  -6.369
  171    HB3  ALA 530           3HB      ALA 530  17.148   4.955  -6.074
  172    H    TRP 531           H        TRP 531  15.855   3.339  -2.176
  173    HA   TRP 531           HA       TRP 531  18.601   4.184  -1.526
  174    HB2  TRP 531           2HB      TRP 531  17.763   4.167   0.891
  175    HB3  TRP 531           1HB      TRP 531  17.154   5.471  -0.128
  176    HD1  TRP 531           HD       TRP 531  14.715   4.833  -1.338
  177    HE1  TRP 531           1HE      TRP 531  12.663   3.790  -0.246
  178    HE3  TRP 531           3HE      TRP 531  16.957   2.803   2.766
  179    HZ2  TRP 531           2HZ      TRP 531  12.040   2.308   2.096
  180    HZ3  TRP 531           3HZ      TRP 531  15.563   1.594   4.396
  181    HH2  TRP 531           HH       TRP 531  13.156   1.354   4.068
  182    H    ILE 532           H        ILE 532  16.312   1.653  -1.821
  183    HA   ILE 532           HA       ILE 532  18.103  -0.210  -0.405
  184    HB   ILE 532           HB       ILE 532  16.104  -1.744  -0.456
  185   HG12  ILE 532          2HG1      ILE 532  15.047   0.111  -2.168
  186   HG13  ILE 532          1HG1      ILE 532  14.132  -1.125  -1.320
  187   HG21  ILE 532          1HG2      ILE 532  16.582  -0.896   1.630
  188   HG22  ILE 532          2HG2      ILE 532  14.919  -0.362   1.386
  189   HG23  ILE 532          3HG2      ILE 532  16.251   0.766   1.140
  190   HD11  ILE 532          3HD1      ILE 532  12.991   0.920  -1.058
  191   HD12  ILE 532          1HD1      ILE 532  14.468   1.752  -0.573
  192   HD13  ILE 532          2HD1      ILE 532  13.744   0.548   0.495
  193    HA   PRO 533           HA       PRO 533  19.145  -2.373  -4.085
  194    HB2  PRO 533           2HB      PRO 533  18.756  -4.999  -3.376
  195    HB3  PRO 533           1HB      PRO 533  20.164  -4.040  -2.910
  196    HG2  PRO 533           2HG      PRO 533  17.695  -4.666  -1.343
  197    HG3  PRO 533           1HG      PRO 533  19.386  -4.638  -0.807
  198    HD2  PRO 533           2HD      PRO 533  17.710  -2.615  -0.270
  199    HD3  PRO 533           1HD      PRO 533  19.424  -2.328  -0.633
  200    H    TYR 534           H        TYR 534  16.210  -3.803  -2.602
  201    HA   TYR 534           HA       TYR 534  14.798  -3.468  -5.110
  202    HB2  TYR 534           2HB      TYR 534  14.166  -5.883  -5.234
  203    HB3  TYR 534           1HB      TYR 534  15.867  -5.564  -5.563
  204    HD1  TYR 534           2HD      TYR 534  13.494  -6.878  -3.058
  205    HD2  TYR 534           1HD      TYR 534  17.580  -6.460  -4.167
  206    HE1  TYR 534           2HE      TYR 534  14.125  -8.499  -1.320
  207    HE2  TYR 534           1HE      TYR 534  18.223  -8.081  -2.433
  208    HH   TYR 534           HH       TYR 534  16.464  -8.893   0.067
  209    H    PHE 535           H        PHE 535  14.689  -3.195  -1.880
  210    HA   PHE 535           HA       PHE 535  12.171  -4.380  -1.259
  211    HB2  PHE 535           2HB      PHE 535  13.291  -2.030   0.234
  212    HB3  PHE 535           1HB      PHE 535  12.355  -3.383   0.848
  213    HD1  PHE 535           1HD      PHE 535  14.155  -5.453  -0.721
  214    HD2  PHE 535           2HD      PHE 535  14.932  -2.255   1.973
  215    HE1  PHE 535           1HE      PHE 535  16.236  -6.558  -0.016
  216    HE2  PHE 535           2HE      PHE 535  17.015  -3.344   2.677
  217    HZ   PHE 535           HZ       PHE 535  17.672  -5.503   1.687
  218    H    GLY 536           H        GLY 536  13.169  -1.384  -2.669
  219    HA2  GLY 536           2HA      GLY 536  10.422  -0.341  -2.471
  220    HA3  GLY 536           1HA      GLY 536  11.856   0.638  -2.738
  221    HA   PRO 537           HA       PRO 537  11.675   0.572  -7.147
  222    HB2  PRO 537           2HB      PRO 537  13.825  -1.495  -7.302
  223    HB3  PRO 537           1HB      PRO 537  13.693   0.054  -8.142
  224    HG2  PRO 537           2HG      PRO 537  15.343  -0.236  -6.073
  225    HG3  PRO 537           1HG      PRO 537  14.426   1.263  -6.305
  226    HD2  PRO 537           2HD      PRO 537  13.999  -0.941  -4.352
  227    HD3  PRO 537           1HD      PRO 537  13.688   0.798  -4.180
  228    H    ALA 538           H        ALA 538  12.220  -2.670  -5.820
  229    HA   ALA 538           HA       ALA 538  10.745  -3.969  -7.925
  230    HB1  ALA 538           1HB      ALA 538  12.669  -4.862  -6.318
  231    HB2  ALA 538           2HB      ALA 538  11.465  -5.934  -7.031
  232    HB3  ALA 538           3HB      ALA 538  11.275  -5.378  -5.368
  233    H    ALA 539           H        ALA 539  10.032  -2.542  -4.873
  234    HA   ALA 539           HA       ALA 539   7.792  -3.883  -3.998
  235    HB1  ALA 539           1HB      ALA 539   9.066  -1.839  -3.020
  236    HB2  ALA 539           2HB      ALA 539   7.350  -2.047  -2.672
  237    HB3  ALA 539           3HB      ALA 539   7.866  -0.898  -3.905
  238    H    GLU 540           H        GLU 540   5.512  -3.241  -4.135
  239    HA   GLU 540           HA       GLU 540   4.575  -1.729  -6.372
  240    HB2  GLU 540           2HB      GLU 540   3.318  -3.852  -7.248
  241    HB3  GLU 540           1HB      GLU 540   4.963  -3.518  -7.772
  242    HG2  GLU 540           2HG      GLU 540   5.737  -5.037  -5.923
  243    HG3  GLU 540           1HG      GLU 540   4.050  -5.506  -5.719
  244    H    GLY 541           H        GLY 541   3.837  -4.207  -3.964
  245    HA2  GLY 541           2HA      GLY 541   1.184  -2.975  -3.587
  246    HA3  GLY 541           1HA      GLY 541   1.587  -4.634  -3.167
  247    H    ILE 542           H        ILE 542   3.726  -1.968  -2.488
  248    HA   ILE 542           HA       ILE 542   2.877  -1.826   0.295
  249    HB   ILE 542           HB       ILE 542   5.792  -2.252  -0.164
  250   HG12  ILE 542          2HG1      ILE 542   5.325  -4.726   0.398
  251   HG13  ILE 542          1HG1      ILE 542   3.689  -4.401  -0.170
  252   HG21  ILE 542          1HG2      ILE 542   5.659  -1.882   2.034
  253   HG22  ILE 542          2HG2      ILE 542   5.036  -3.529   2.146
  254   HG23  ILE 542          3HG2      ILE 542   3.919  -2.166   2.067
  255   HD11  ILE 542          3HD1      ILE 542   4.435  -4.896  -2.202
  256   HD12  ILE 542          1HD1      ILE 542   6.116  -4.857  -1.671
  257   HD13  ILE 542          2HD1      ILE 542   5.311  -3.363  -2.158
  258    H    TYR 543           H        TYR 543   4.802  -0.659  -2.386
  259    HA   TYR 543           HA       TYR 543   5.457   1.760  -0.939
  260    HB2  TYR 543           2HB      TYR 543   7.264   1.905  -2.288
  261    HB3  TYR 543           1HB      TYR 543   6.971   0.195  -2.510
  262    HD1  TYR 543           2HD      TYR 543   5.792  -0.597  -4.567
  263    HD2  TYR 543           1HD      TYR 543   7.077   3.434  -4.075
  264    HE1  TYR 543           2HE      TYR 543   5.594  -0.237  -6.984
  265    HE2  TYR 543           1HE      TYR 543   6.883   3.803  -6.489
  266    HH   TYR 543           HH       TYR 543   5.338   1.552  -8.577
  267    H    ILE 544           H        ILE 544   3.934   0.700  -3.957
  268    HA   ILE 544           HA       ILE 544   2.686   1.818  -5.527
  269    HB   ILE 544           HB       ILE 544   1.168   2.631  -3.052
  270   HG12  ILE 544          2HG1      ILE 544  -0.045   0.436  -3.485
  271   HG13  ILE 544          1HG1      ILE 544   1.310   0.004  -4.521
  272   HG21  ILE 544          1HG2      ILE 544   0.108   3.661  -4.827
  273   HG22  ILE 544          2HG2      ILE 544  -0.755   2.128  -4.721
  274   HG23  ILE 544          3HG2      ILE 544   0.490   2.355  -5.949
  275   HD11  ILE 544          3HD1      ILE 544   1.934   0.900  -1.774
  276   HD12  ILE 544          1HD1      ILE 544   2.713  -0.320  -2.779
  277   HD13  ILE 544          2HD1      ILE 544   1.191  -0.687  -1.970
  278    H    GLU 545           H        GLU 545   2.321   4.058  -2.826
  279    HA   GLU 545           HA       GLU 545   2.692   6.286  -2.606
  280    HB2  GLU 545           2HB      GLU 545   4.406   6.147  -5.076
  281    HB3  GLU 545           1HB      GLU 545   4.528   7.273  -3.725
  282    HG2  GLU 545           2HG      GLU 545   5.018   5.265  -2.279
  283    HG3  GLU 545           1HG      GLU 545   5.211   4.352  -3.773
  284    H    GLY 546           H        GLY 546   0.541   6.680  -3.067
  285    HA2  GLY 546           2HA      GLY 546  -0.084   8.643  -4.842
  286    HA3  GLY 546           1HA      GLY 546  -0.365   7.165  -5.751
  287    H    LEU 547           H        LEU 547  -1.081   5.927  -2.981
  288    HA   LEU 547           HA       LEU 547  -3.747   7.159  -2.719
  289    HB2  LEU 547           2HB      LEU 547  -4.892   5.140  -2.905
  290    HB3  LEU 547           1HB      LEU 547  -3.714   5.097  -4.202
  291    HG   LEU 547           HG       LEU 547  -3.431   3.677  -1.554
  292   HD11  LEU 547          1HD1      LEU 547  -5.197   2.716  -2.939
  293   HD12  LEU 547          2HD1      LEU 547  -3.804   1.639  -2.833
  294   HD13  LEU 547          3HD1      LEU 547  -4.072   2.593  -4.292
  295   HD21  LEU 547          3HD2      LEU 547  -1.602   2.492  -2.930
  296   HD22  LEU 547          1HD2      LEU 547  -1.257   4.091  -2.268
  297   HD23  LEU 547          2HD2      LEU 547  -1.679   3.913  -3.971
  298    H    MET 548           H        MET 548  -1.027   5.887  -1.190
  299    HA   MET 548           HA       MET 548  -2.206   4.963   1.213
  300    HB2  MET 548           2HB      MET 548   0.217   5.422   2.104
  301    HB3  MET 548           1HB      MET 548  -0.093   4.097   0.998
  302    HG2  MET 548           2HG      MET 548   1.910   5.196   0.339
  303    HG3  MET 548           1HG      MET 548   0.684   5.537  -0.869
  304    HE1  MET 548           3HE      MET 548   0.344   9.179  -1.015
  305    HE2  MET 548           1HE      MET 548  -0.238   7.576  -1.459
  306    HE3  MET 548           2HE      MET 548   1.379   8.089  -1.935
  307    H    HIS 549           H        HIS 549  -3.667   6.975   1.203
  308    HA   HIS 549           HA       HIS 549  -2.383   9.063   2.837
  309    HB2  HIS 549           2HB      HIS 549  -4.965   9.628   1.471
  310    HB3  HIS 549           1HB      HIS 549  -3.615  10.700   1.811
  311    HD1  HIS 549           1HD      HIS 549  -5.222   9.966  -0.988
  312    HD2  HIS 549           2HD      HIS 549  -1.309   9.093   0.102
  313    HE1  HIS 549           1HE      HIS 549  -3.987   9.624  -3.148
  314    HE2  HIS 549           2HE      HIS 549  -1.585   9.277  -2.463
  315    H    ASN 550           H        ASN 550  -5.781   8.156   2.257
  316    HA   ASN 550           HA       ASN 550  -6.312   6.892   4.657
  317    HB2  ASN 550           2HB      ASN 550  -5.726   9.553   5.173
  318    HB3  ASN 550           1HB      ASN 550  -7.484   9.517   5.161
  319   HD21  ASN 550          1HD2      ASN 550  -7.485   9.968   7.386
  320   HD22  ASN 550          2HD2      ASN 550  -7.135   8.741   8.551
  321    H    GLN 551           H        GLN 551  -7.422   5.956   2.756
  322    HA   GLN 551           HA       GLN 551  -9.911   7.315   2.050
  323    HB2  GLN 551           2HB      GLN 551  -9.483   4.766   0.717
  324    HB3  GLN 551           1HB      GLN 551  -9.781   6.350   0.029
  325    HG2  GLN 551           2HG      GLN 551  -7.715   6.261  -0.761
  326    HG3  GLN 551           1HG      GLN 551  -7.160   6.509   0.891
  327   HE21  GLN 551          1HE2      GLN 551  -7.300   4.306   2.184
  328   HE22  GLN 551          2HE2      GLN 551  -6.529   2.980   1.397
  329    H    ASP 552           H        ASP 552  -9.215   3.889   2.334
  330    HA   ASP 552           HA       ASP 552 -10.202   2.184   3.463
  331    HB2  ASP 552           2HB      ASP 552  -9.761   3.837   5.402
  332    HB3  ASP 552           1HB      ASP 552 -11.487   4.173   5.319
  333    H    GLY 553           H        GLY 553 -11.721   4.094   1.494
  334    HA2  GLY 553           2HA      GLY 553 -14.385   2.920   2.019
  335    HA3  GLY 553           1HA      GLY 553 -14.166   4.515   1.309
  336    H    LEU 554           H        LEU 554 -11.918   3.674  -0.319
  337    HA   LEU 554           HA       LEU 554 -13.415   2.463  -2.507
  338    HB2  LEU 554           2HB      LEU 554 -11.449   3.145  -3.852
  339    HB3  LEU 554           1HB      LEU 554 -12.242   4.477  -3.036
  340    HG   LEU 554           HG       LEU 554 -10.279   3.739  -1.235
  341   HD11  LEU 554          1HD1      LEU 554  -8.784   3.921  -3.784
  342   HD12  LEU 554          2HD1      LEU 554  -9.483   2.360  -3.353
  343   HD13  LEU 554          3HD1      LEU 554  -8.346   3.150  -2.260
  344   HD21  LEU 554          3HD2      LEU 554 -10.801   6.006  -1.665
  345   HD22  LEU 554          1HD2      LEU 554 -10.351   5.862  -3.364
  346   HD23  LEU 554          2HD2      LEU 554  -9.109   5.789  -2.112
  347    H    ILE 555           H        ILE 555 -11.880   1.191  -0.042
  348    HA   ILE 555           HA       ILE 555 -10.931  -1.112  -1.551
  349    HB   ILE 555           HB       ILE 555  -8.878  -1.216  -0.117
  350   HG12  ILE 555          2HG1      ILE 555  -9.639   0.384   1.620
  351   HG13  ILE 555          1HG1      ILE 555  -8.082   0.815   0.951
  352   HG21  ILE 555          1HG2      ILE 555  -7.663  -0.239  -1.734
  353   HG22  ILE 555          2HG2      ILE 555  -8.558   1.281  -1.636
  354   HG23  ILE 555          3HG2      ILE 555  -9.234  -0.086  -2.524
  355   HD11  ILE 555          3HD1      ILE 555 -10.567   2.289   0.948
  356   HD12  ILE 555          1HD1      ILE 555  -9.803   2.201  -0.639
  357   HD13  ILE 555          2HD1      ILE 555  -8.908   2.848   0.733
  358    H    CYS 556           H        CYS 556 -11.504   0.355   1.614
  359    HA   CYS 556           HA       CYS 556 -12.006  -2.305   2.712
  360    HB2  CYS 556           2HB      CYS 556 -10.333  -0.622   3.752
  361    HB3  CYS 556           1HB      CYS 556 -11.766   0.214   4.335
  362    H    GLY 557           H        GLY 557 -14.062  -2.918   2.754
  363    HA2  GLY 557           2HA      GLY 557 -16.079  -1.191   3.885
  364    HA3  GLY 557           1HA      GLY 557 -16.310  -1.527   2.175
  365    H    LEU 558           H        LEU 558 -16.307  -3.872   1.567
  366    HA   LEU 558           HA       LEU 558 -17.201  -5.634   3.716
  367    HB2  LEU 558           2HB      LEU 558 -19.154  -6.351   2.408
  368    HB3  LEU 558           1HB      LEU 558 -19.241  -4.670   2.892
  369    HG   LEU 558           HG       LEU 558 -18.228  -5.370   0.164
  370   HD11  LEU 558          1HD1      LEU 558 -20.179  -6.502  -0.107
  371   HD12  LEU 558          2HD1      LEU 558 -20.758  -4.866  -0.418
  372   HD13  LEU 558          3HD1      LEU 558 -21.009  -5.603   1.164
  373   HD21  LEU 558          3HD2      LEU 558 -18.435  -3.178  -0.239
  374   HD22  LEU 558          1HD2      LEU 558 -18.494  -3.011   1.516
  375   HD23  LEU 558          2HD2      LEU 558 -19.991  -3.077   0.586
  376    H    ARG 559           H        ARG 559 -16.309  -5.279   0.314
  377    HA   ARG 559           HA       ARG 559 -14.439  -7.306   0.250
  378    HB2  ARG 559           2HB      ARG 559 -15.766  -9.035  -1.082
  379    HB3  ARG 559           1HB      ARG 559 -16.086  -8.968   0.649
  380    HG2  ARG 559           2HG      ARG 559 -18.236  -8.862   0.062
  381    HG3  ARG 559           1HG      ARG 559 -17.886  -7.175  -0.327
  382    HD2  ARG 559           2HD      ARG 559 -18.272  -7.524  -2.479
  383    HD3  ARG 559           1HD      ARG 559 -17.131  -8.868  -2.518
  384    HE   ARG 559           HE       ARG 559 -19.944  -9.057  -2.546
  385   HH11  ARG 559          1HH1      ARG 559 -17.140 -10.594  -1.147
  386   HH12  ARG 559          2HH1      ARG 559 -17.906 -12.140  -1.000
  387   HH21  ARG 559          1HH2      ARG 559 -20.953 -11.090  -2.353
  388   HH22  ARG 559          2HH2      ARG 559 -20.070 -12.422  -1.685
  389    H    GLN 560           H        GLN 560 -15.054  -4.752  -0.812
  390    HA   GLN 560           HA       GLN 560 -15.288  -5.145  -3.685
  391    HB2  GLN 560           2HB      GLN 560 -15.656  -2.833  -3.878
  392    HB3  GLN 560           1HB      GLN 560 -16.474  -3.281  -2.391
  393    HG2  GLN 560           2HG      GLN 560 -13.691  -2.148  -2.416
  394    HG3  GLN 560           1HG      GLN 560 -15.132  -1.138  -2.370
  395   HE21  GLN 560          1HE2      GLN 560 -13.373  -3.659  -0.673
  396   HE22  GLN 560          2HE2      GLN 560 -14.009  -3.309   0.893
  Start of MODEL    3
    1    H1   ALA 507           1HT      ALA 507  -7.362  -9.250  -6.209
    2    H2   ALA 507           2HT      ALA 507  -6.672 -10.541  -7.107
    3    H3   ALA 507           3HT      ALA 507  -7.473 -10.857  -5.623
    4    HA   ALA 507           HA       ALA 507  -8.578 -10.122  -8.223
    5    HB1  ALA 507           1HB      ALA 507  -8.755 -12.378  -6.310
    6    HB2  ALA 507           2HB      ALA 507  -8.713 -12.384  -8.073
    7    HB3  ALA 507           3HB      ALA 507 -10.206 -11.975  -7.228
    8    H    GLN 508           H        GLN 508  -9.371 -10.259  -4.755
    9    HA   GLN 508           HA       GLN 508 -10.872  -7.867  -4.817
   10    HB2  GLN 508           2HB      GLN 508 -13.118  -8.828  -4.388
   11    HB3  GLN 508           1HB      GLN 508 -12.526  -9.167  -6.009
   12    HG2  GLN 508           2HG      GLN 508 -12.038 -11.418  -5.456
   13    HG3  GLN 508           1HG      GLN 508 -12.287 -11.117  -3.737
   14   HE21  GLN 508          1HE2      GLN 508 -14.360 -11.005  -2.924
   15   HE22  GLN 508          2HE2      GLN 508 -15.745 -11.502  -3.828
   16    HA   PRO 509           HA       PRO 509  -9.661  -9.719  -0.667
   17    HB2  PRO 509           2HB      PRO 509  -7.484  -8.246  -0.122
   18    HB3  PRO 509           1HB      PRO 509  -7.392  -9.709  -1.111
   19    HG2  PRO 509           2HG      PRO 509  -7.455  -6.842  -1.970
   20    HG3  PRO 509           1HG      PRO 509  -6.452  -8.171  -2.579
   21    HD2  PRO 509           2HD      PRO 509  -8.728  -7.286  -3.821
   22    HD3  PRO 509           1HD      PRO 509  -8.101  -8.939  -3.970
   23    H    LYS 510           H        LYS 510 -10.189  -8.811   1.298
   24    HA   LYS 510           HA       LYS 510 -11.650  -6.356   1.243
   25    HB2  LYS 510           2HB      LYS 510 -10.801  -7.885   3.702
   26    HB3  LYS 510           1HB      LYS 510 -12.173  -6.798   3.533
   27    HG2  LYS 510           2HG      LYS 510 -13.479  -8.371   2.573
   28    HG3  LYS 510           1HG      LYS 510 -12.129  -9.137   1.734
   29    HD2  LYS 510           2HD      LYS 510 -11.380  -9.979   4.006
   30    HD3  LYS 510           1HD      LYS 510 -12.950  -9.450   4.612
   31    HE2  LYS 510           2HE      LYS 510 -14.098 -11.055   3.434
   32    HE3  LYS 510           1HE      LYS 510 -12.849 -11.192   2.197
   33    HZ1  LYS 510           3HZ      LYS 510 -13.047 -13.120   3.762
   34    HZ2  LYS 510           1HZ      LYS 510 -12.455 -12.112   4.986
   35    HZ3  LYS 510           2HZ      LYS 510 -11.497 -12.456   3.637
   36    H    CYS 511           H        CYS 511 -10.773  -4.400   1.325
   37    HA   CYS 511           HA       CYS 511  -9.393  -2.661   1.825
   38    HB2  CYS 511           2HB      CYS 511  -8.430  -4.280   4.183
   39    HB3  CYS 511           1HB      CYS 511  -8.472  -2.527   4.018
   40    H    ASN 512           H        ASN 512  -7.745  -2.302   0.514
   41    HA   ASN 512           HA       ASN 512  -5.674  -4.314   0.226
   42    HB2  ASN 512           2HB      ASN 512  -6.042  -1.818  -1.425
   43    HB3  ASN 512           1HB      ASN 512  -5.009  -3.191  -1.794
   44   HD21  ASN 512          1HD2      ASN 512  -8.405  -2.395  -1.139
   45   HD22  ASN 512          2HD2      ASN 512  -9.060  -3.527  -2.261
   46    HA   PRO 513           HA       PRO 513  -3.057  -0.736   1.765
   47    HB2  PRO 513           2HB      PRO 513  -3.886   1.778   1.355
   48    HB3  PRO 513           1HB      PRO 513  -3.382   0.740   0.020
   49    HG2  PRO 513           2HG      PRO 513  -6.053   1.723   0.636
   50    HG3  PRO 513           1HG      PRO 513  -5.482   0.894  -0.820
   51    HD2  PRO 513           2HD      PRO 513  -6.810  -0.225   1.573
   52    HD3  PRO 513           1HD      PRO 513  -6.707  -0.876  -0.076
   53    H    ASN 514           H        ASN 514  -5.818  -1.351   3.256
   54    HA   ASN 514           HA       ASN 514  -5.358   0.593   5.419
   55    HB2  ASN 514           2HB      ASN 514  -7.850  -0.400   4.162
   56    HB3  ASN 514           1HB      ASN 514  -7.877  -0.272   5.919
   57   HD21  ASN 514          1HD2      ASN 514  -7.968   1.414   2.945
   58   HD22  ASN 514          2HD2      ASN 514  -8.084   3.010   3.593
   59    H    LEU 515           H        LEU 515  -3.735  -1.451   5.496
   60    HA   LEU 515           HA       LEU 515  -4.897  -3.291   7.478
   61    HB2  LEU 515           2HB      LEU 515  -2.476  -4.191   6.072
   62    HB3  LEU 515           1HB      LEU 515  -3.904  -5.089   6.539
   63    HG   LEU 515           HG       LEU 515  -3.793  -5.173   4.183
   64   HD11  LEU 515          1HD1      LEU 515  -5.981  -4.871   4.078
   65   HD12  LEU 515          2HD1      LEU 515  -5.731  -3.137   3.895
   66   HD13  LEU 515          3HD1      LEU 515  -5.928  -3.833   5.501
   67   HD21  LEU 515          3HD2      LEU 515  -3.970  -2.472   3.346
   68   HD22  LEU 515          1HD2      LEU 515  -2.690  -3.643   3.022
   69   HD23  LEU 515          2HD2      LEU 515  -2.598  -2.607   4.446
   70    H    HIS 516           H        HIS 516  -1.670  -2.208   6.367
   71    HA   HIS 516           HA       HIS 516  -0.991  -1.043   8.854
   72    HB2  HIS 516           2HB      HIS 516   0.279  -2.641   9.920
   73    HB3  HIS 516           1HB      HIS 516  -0.981  -3.648   9.209
   74    HD1  HIS 516           1HD      HIS 516  -0.308  -5.156   7.221
   75    HD2  HIS 516           2HD      HIS 516   2.798  -2.908   8.802
   76    HE1  HIS 516           1HE      HIS 516   1.763  -6.010   6.097
   77    HE2  HIS 516           2HE      HIS 516   3.643  -4.625   7.048
   78    H    TYR 517           H        TYR 517   0.602  -2.859   6.218
   79    HA   TYR 517           HA       TYR 517   2.962  -1.442   6.102
   80    HB2  TYR 517           2HB      TYR 517   2.306  -2.048   3.404
   81    HB3  TYR 517           1HB      TYR 517   3.449  -2.848   4.457
   82    HD1  TYR 517           1HD      TYR 517  -0.313  -2.948   4.706
   83    HD2  TYR 517           2HD      TYR 517   3.280  -5.036   3.771
   84    HE1  TYR 517           1HE      TYR 517  -1.585  -5.028   4.486
   85    HE2  TYR 517           2HE      TYR 517   2.006  -7.125   3.555
   86    HH   TYR 517           HH       TYR 517  -1.255  -7.409   4.570
   87    H    TRP 518           H        TRP 518  -0.080  -0.183   5.404
   88    HA   TRP 518           HA       TRP 518   1.152   1.987   3.850
   89    HB2  TRP 518           2HB      TRP 518  -1.767   1.368   3.602
   90    HB3  TRP 518           1HB      TRP 518  -0.684   2.098   2.438
   91    HD1  TRP 518           HD       TRP 518  -0.085  -1.322   4.064
   92    HE1  TRP 518           1HE      TRP 518  -0.066  -3.080   2.258
   93    HE3  TRP 518           3HE      TRP 518  -1.442   1.580   0.095
   94    HZ2  TRP 518           2HZ      TRP 518  -0.582  -3.286  -0.507
   95    HZ3  TRP 518           3HZ      TRP 518  -1.668   0.515  -2.107
   96    HH2  TRP 518           HH       TRP 518  -1.245  -1.872  -2.404
   97    H    THR 519           H        THR 519  -1.091   1.041   6.331
   98    HA   THR 519           HA       THR 519  -1.916   3.737   6.947
   99    HB   THR 519           HB       THR 519  -3.457   1.850   7.239
  100    HG1  THR 519           1HG      THR 519  -4.065   2.349   9.405
  101   HG21  THR 519          3HG2      THR 519  -1.255   0.792   8.886
  102   HG22  THR 519          1HG2      THR 519  -2.471  -0.052   7.927
  103   HG23  THR 519          2HG2      THR 519  -2.888   0.574   9.522
  104    H    THR 520           H        THR 520   0.703   1.707   7.787
  105    HA   THR 520           HA       THR 520   1.136   2.959  10.366
  106    HB   THR 520           HB       THR 520   1.714   0.480   9.520
  107    HG1  THR 520           1HG      THR 520   3.090   0.377  11.339
  108   HG21  THR 520          3HG2      THR 520   4.171   0.228   9.392
  109   HG22  THR 520          1HG2      THR 520   4.305   1.972   9.167
  110   HG23  THR 520          2HG2      THR 520   3.465   0.987   7.968
  111    H    GLN 521           H        GLN 521   3.014   2.701   7.345
  112    HA   GLN 521           HA       GLN 521   4.492   5.078   8.177
  113    HB2  GLN 521           2HB      GLN 521   6.229   4.417   6.736
  114    HB3  GLN 521           1HB      GLN 521   5.676   2.937   7.506
  115    HG2  GLN 521           2HG      GLN 521   4.699   2.143   5.563
  116    HG3  GLN 521           1HG      GLN 521   4.639   3.738   4.826
  117   HE21  GLN 521          1HE2      GLN 521   6.757   4.746   4.312
  118   HE22  GLN 521          2HE2      GLN 521   8.027   3.710   3.767
  119    H    ASP 522           H        ASP 522   5.351   5.751   5.528
  120    HA   ASP 522           HA       ASP 522   2.927   7.123   4.628
  121    HB2  ASP 522           2HB      ASP 522   5.839   7.737   4.454
  122    HB3  ASP 522           1HB      ASP 522   4.714   8.491   3.331
  123    H    GLU 523           H        GLU 523   3.474   4.399   3.923
  124    HA   GLU 523           HA       GLU 523   3.661   2.978   2.134
  125    HB2  GLU 523           2HB      GLU 523   1.830   5.135   1.495
  126    HB3  GLU 523           1HB      GLU 523   2.544   4.442   0.043
  127    HG2  GLU 523           2HG      GLU 523   1.884   2.205   0.859
  128    HG3  GLU 523           1HG      GLU 523   1.047   2.991   2.196
  129    H    GLY 524           H        GLY 524   6.016   3.467   2.301
  130    HA2  GLY 524           2HA      GLY 524   7.894   3.425   0.862
  131    HA3  GLY 524           1HA      GLY 524   6.976   4.365  -0.311
  132    H    ALA 525           H        ALA 525   6.007   6.168   1.829
  133    HA   ALA 525           HA       ALA 525   6.546   8.227   2.592
  134    HB1  ALA 525           1HB      ALA 525   8.062   6.393   3.952
  135    HB2  ALA 525           2HB      ALA 525   7.807   8.076   4.416
  136    HB3  ALA 525           3HB      ALA 525   9.231   7.626   3.478
  137    H    ALA 526           H        ALA 526   7.790   7.259  -0.142
  138    HA   ALA 526           HA       ALA 526   9.187   8.094  -1.728
  139    HB1  ALA 526           1HB      ALA 526   7.347   9.927  -1.156
  140    HB2  ALA 526           2HB      ALA 526   8.613  10.204  -2.352
  141    HB3  ALA 526           3HB      ALA 526   8.785  10.850  -0.719
  142    H    ILE 527           H        ILE 527  10.229   7.704   1.144
  143    HA   ILE 527           HA       ILE 527  12.224   9.546   1.712
  144    HB   ILE 527           HB       ILE 527  13.402   7.355   2.652
  145   HG12  ILE 527          2HG1      ILE 527  11.858   5.614   3.238
  146   HG13  ILE 527          1HG1      ILE 527  10.508   6.508   2.555
  147   HG21  ILE 527          1HG2      ILE 527  11.038   7.931   4.241
  148   HG22  ILE 527          2HG2      ILE 527  11.872   9.377   3.673
  149   HG23  ILE 527          3HG2      ILE 527  12.745   8.170   4.616
  150   HD11  ILE 527          3HD1      ILE 527  11.086   5.989   0.399
  151   HD12  ILE 527          1HD1      ILE 527  11.585   4.531   1.256
  152   HD13  ILE 527          2HD1      ILE 527  12.785   5.741   0.799
  153    H    GLY 528           H        GLY 528  12.085   7.182  -0.790
  154    HA2  GLY 528           2HA      GLY 528  14.137   8.140  -2.309
  155    HA3  GLY 528           1HA      GLY 528  14.929   7.021  -1.212
  156    H    LEU 529           H        LEU 529  12.692   5.187  -1.097
  157    HA   LEU 529           HA       LEU 529  11.855   3.364  -2.143
  158    HB2  LEU 529           2HB      LEU 529  11.753   5.445  -4.114
  159    HB3  LEU 529           1HB      LEU 529  12.084   3.906  -4.886
  160    HG   LEU 529           HG       LEU 529   9.685   4.683  -3.252
  161   HD11  LEU 529          1HD1      LEU 529   8.940   3.343  -5.557
  162   HD12  LEU 529          2HD1      LEU 529  10.310   4.334  -6.060
  163   HD13  LEU 529          3HD1      LEU 529   8.908   5.088  -5.299
  164   HD21  LEU 529          3HD2      LEU 529  10.768   1.972  -3.883
  165   HD22  LEU 529          1HD2      LEU 529   9.026   2.229  -3.763
  166   HD23  LEU 529          2HD2      LEU 529  10.068   2.577  -2.379
  167    H    ALA 530           H        ALA 530  14.527   4.580  -4.095
  168    HA   ALA 530           HA       ALA 530  15.334   1.978  -4.864
  169    HB1  ALA 530           1HB      ALA 530  16.751   4.623  -5.104
  170    HB2  ALA 530           2HB      ALA 530  15.795   3.804  -6.338
  171    HB3  ALA 530           3HB      ALA 530  17.332   3.117  -5.814
  172    H    TRP 531           H        TRP 531  16.037   3.915  -2.129
  173    HA   TRP 531           HA       TRP 531  18.529   3.262  -1.291
  174    HB2  TRP 531           2HB      TRP 531  17.564   3.289   1.061
  175    HB3  TRP 531           1HB      TRP 531  17.183   4.691   0.067
  176    HD1  TRP 531           HD       TRP 531  14.724   4.200  -1.372
  177    HE1  TRP 531           1HE      TRP 531  12.511   3.545  -0.313
  178    HE3  TRP 531           3HE      TRP 531  16.484   2.316   3.029
  179    HZ2  TRP 531           2HZ      TRP 531  11.584   2.382   2.097
  180    HZ3  TRP 531           3HZ      TRP 531  14.863   1.455   4.670
  181    HH2  TRP 531           HH       TRP 531  12.464   1.489   4.211
  182    H    ILE 532           H        ILE 532  15.766   1.144  -1.501
  183    HA   ILE 532           HA       ILE 532  17.262  -1.019  -0.207
  184    HB   ILE 532           HB       ILE 532  15.122  -2.194  -0.142
  185   HG12  ILE 532          2HG1      ILE 532  14.393  -0.270  -2.102
  186   HG13  ILE 532          1HG1      ILE 532  13.453  -1.629  -1.505
  187   HG21  ILE 532          1HG2      ILE 532  13.981  -0.625   1.448
  188   HG22  ILE 532          2HG2      ILE 532  15.179   0.586   0.984
  189   HG23  ILE 532          3HG2      ILE 532  15.693  -0.910   1.770
  190   HD11  ILE 532          3HD1      ILE 532  12.638  -0.154   0.334
  191   HD12  ILE 532          1HD1      ILE 532  12.140   0.336  -1.283
  192   HD13  ILE 532          2HD1      ILE 532  13.449   1.189  -0.471
  193    HA   PRO 533           HA       PRO 533  18.246  -3.207  -3.887
  194    HB2  PRO 533           2HB      PRO 533  16.954  -5.562  -2.595
  195    HB3  PRO 533           1HB      PRO 533  18.567  -5.411  -3.301
  196    HG2  PRO 533           2HG      PRO 533  18.248  -5.431  -0.663
  197    HG3  PRO 533           1HG      PRO 533  19.432  -4.353  -1.425
  198    HD2  PRO 533           2HD      PRO 533  16.744  -3.720  -0.289
  199    HD3  PRO 533           1HD      PRO 533  18.236  -2.757  -0.265
  200    H    TYR 534           H        TYR 534  15.095  -4.240  -2.552
  201    HA   TYR 534           HA       TYR 534  13.766  -3.505  -5.004
  202    HB2  TYR 534           2HB      TYR 534  12.887  -5.750  -5.489
  203    HB3  TYR 534           1HB      TYR 534  14.641  -5.683  -5.632
  204    HD1  TYR 534           1HD      TYR 534  11.852  -6.857  -3.514
  205    HD2  TYR 534           2HD      TYR 534  16.040  -7.017  -4.242
  206    HE1  TYR 534           1HE      TYR 534  12.042  -8.754  -1.961
  207    HE2  TYR 534           2HE      TYR 534  16.242  -8.916  -2.692
  208    HH   TYR 534           HH       TYR 534  15.073  -9.925  -0.854
  209    H    PHE 535           H        PHE 535  13.668  -3.579  -1.762
  210    HA   PHE 535           HA       PHE 535  11.112  -4.572  -1.140
  211    HB2  PHE 535           2HB      PHE 535  12.317  -2.227   0.303
  212    HB3  PHE 535           1HB      PHE 535  11.333  -3.531   0.949
  213    HD1  PHE 535           1HD      PHE 535  13.117  -5.646  -0.665
  214    HD2  PHE 535           2HD      PHE 535  13.893  -2.531   2.130
  215    HE1  PHE 535           1HE      PHE 535  15.161  -6.808   0.060
  216    HE2  PHE 535           2HE      PHE 535  15.938  -3.687   2.857
  217    HZ   PHE 535           HZ       PHE 535  16.574  -5.825   1.822
  218    H    GLY 536           H        GLY 536  12.169  -1.610  -2.591
  219    HA2  GLY 536           2HA      GLY 536   9.452  -0.500  -2.390
  220    HA3  GLY 536           1HA      GLY 536  10.905   0.437  -2.685
  221    HA   PRO 537           HA       PRO 537  10.679   0.170  -7.085
  222    HB2  PRO 537           2HB      PRO 537  12.778  -1.925  -7.308
  223    HB3  PRO 537           1HB      PRO 537  12.696  -0.330  -8.064
  224    HG2  PRO 537           2HG      PRO 537  14.355  -0.781  -6.030
  225    HG3  PRO 537           1HG      PRO 537  13.480   0.756  -6.166
  226    HD2  PRO 537           2HD      PRO 537  12.936  -1.586  -4.389
  227    HD3  PRO 537           1HD      PRO 537  12.803   0.148  -4.040
  228    H    ALA 538           H        ALA 538  11.154  -3.067  -5.708
  229    HA   ALA 538           HA       ALA 538   9.438  -4.234  -7.759
  230    HB1  ALA 538           1HB      ALA 538  11.608  -5.298  -7.021
  231    HB2  ALA 538           2HB      ALA 538  10.194  -6.351  -7.029
  232    HB3  ALA 538           3HB      ALA 538  10.795  -5.694  -5.507
  233    H    ALA 539           H        ALA 539   9.085  -2.835  -4.743
  234    HA   ALA 539           HA       ALA 539   7.322  -4.439  -3.347
  235    HB1  ALA 539           1HB      ALA 539   8.272  -1.820  -3.159
  236    HB2  ALA 539           2HB      ALA 539   7.314  -2.696  -1.969
  237    HB3  ALA 539           3HB      ALA 539   6.515  -1.680  -3.169
  238    H    GLU 540           H        GLU 540   6.149  -1.589  -5.106
  239    HA   GLU 540           HA       GLU 540   4.401  -1.257  -6.508
  240    HB2  GLU 540           2HB      GLU 540   3.931  -4.221  -6.486
  241    HB3  GLU 540           1HB      GLU 540   3.409  -3.061  -7.695
  242    HG2  GLU 540           2HG      GLU 540   6.229  -2.887  -7.463
  243    HG3  GLU 540           1HG      GLU 540   5.791  -4.589  -7.609
  244    H    GLY 541           H        GLY 541   3.767  -3.675  -3.981
  245    HA2  GLY 541           2HA      GLY 541   1.127  -2.418  -3.581
  246    HA3  GLY 541           1HA      GLY 541   1.500  -4.087  -3.182
  247    H    ILE 542           H        ILE 542   3.562  -1.332  -2.471
  248    HA   ILE 542           HA       ILE 542   2.745  -1.301   0.316
  249    HB   ILE 542           HB       ILE 542   5.669  -1.632  -0.159
  250   HG12  ILE 542          2HG1      ILE 542   5.331  -4.121   0.336
  251   HG13  ILE 542          1HG1      ILE 542   3.654  -3.875  -0.138
  252   HG21  ILE 542          1HG2      ILE 542   4.248  -1.097   2.046
  253   HG22  ILE 542          2HG2      ILE 542   5.782  -1.967   2.075
  254   HG23  ILE 542          3HG2      ILE 542   4.262  -2.859   2.129
  255   HD11  ILE 542          3HD1      ILE 542   4.314  -4.325  -2.205
  256   HD12  ILE 542          1HD1      ILE 542   6.018  -4.184  -1.771
  257   HD13  ILE 542          2HD1      ILE 542   5.095  -2.742  -2.202
  258    H    TYR 543           H        TYR 543   4.725  -0.079  -2.308
  259    HA   TYR 543           HA       TYR 543   5.306   2.353  -0.865
  260    HB2  TYR 543           2HB      TYR 543   7.095   2.531  -2.242
  261    HB3  TYR 543           1HB      TYR 543   6.809   0.821  -2.493
  262    HD1  TYR 543           1HD      TYR 543   5.458   0.111  -4.501
  263    HD2  TYR 543           2HD      TYR 543   7.004   4.043  -4.044
  264    HE1  TYR 543           1HE      TYR 543   5.197   0.486  -6.910
  265    HE2  TYR 543           2HE      TYR 543   6.744   4.436  -6.454
  266    HH   TYR 543           HH       TYR 543   4.993   2.293  -8.487
  267    H    ILE 544           H        ILE 544   3.710   1.273  -3.829
  268    HA   ILE 544           HA       ILE 544   2.429   2.367  -5.384
  269    HB   ILE 544           HB       ILE 544   0.959   3.286  -2.928
  270   HG12  ILE 544          2HG1      ILE 544  -0.261   1.086  -3.161
  271   HG13  ILE 544          1HG1      ILE 544   1.037   0.566  -4.227
  272   HG21  ILE 544          1HG2      ILE 544  -0.799   2.364  -4.888
  273   HG22  ILE 544          2HG2      ILE 544   0.415   3.306  -5.754
  274   HG23  ILE 544          3HG2      ILE 544  -0.490   4.039  -4.431
  275   HD11  ILE 544          3HD1      ILE 544   1.777   1.614  -1.557
  276   HD12  ILE 544          1HD1      ILE 544   2.522   0.345  -2.528
  277   HD13  ILE 544          2HD1      ILE 544   1.032   0.019  -1.648
  278    H    GLU 545           H        GLU 545   2.160   4.651  -2.706
  279    HA   GLU 545           HA       GLU 545   2.531   6.884  -2.537
  280    HB2  GLU 545           2HB      GLU 545   4.161   6.728  -5.059
  281    HB3  GLU 545           1HB      GLU 545   4.338   7.846  -3.711
  282    HG2  GLU 545           2HG      GLU 545   4.908   5.838  -2.293
  283    HG3  GLU 545           1HG      GLU 545   5.022   4.924  -3.795
  284    H    GLY 546           H        GLY 546   0.308   5.804  -4.004
  285    HA2  GLY 546           2HA      GLY 546  -0.339   8.191  -5.592
  286    HA3  GLY 546           1HA      GLY 546  -0.646   6.598  -6.265
  287    H    LEU 547           H        LEU 547  -1.234   6.055  -3.136
  288    HA   LEU 547           HA       LEU 547  -3.947   7.183  -3.161
  289    HB2  LEU 547           2HB      LEU 547  -5.045   5.193  -2.988
  290    HB3  LEU 547           1HB      LEU 547  -3.721   4.744  -4.044
  291    HG   LEU 547           HG       LEU 547  -3.779   4.243  -1.067
  292   HD11  LEU 547          1HD1      LEU 547  -5.298   2.694  -1.686
  293   HD12  LEU 547          2HD1      LEU 547  -3.857   1.802  -2.174
  294   HD13  LEU 547          3HD1      LEU 547  -4.785   2.704  -3.373
  295   HD21  LEU 547          3HD2      LEU 547  -1.911   3.269  -3.222
  296   HD22  LEU 547          1HD2      LEU 547  -1.864   2.801  -1.523
  297   HD23  LEU 547          2HD2      LEU 547  -1.531   4.470  -1.989
  298    H    MET 548           H        MET 548  -1.159   6.569  -1.431
  299    HA   MET 548           HA       MET 548  -2.255   6.159   1.157
  300    HB2  MET 548           2HB      MET 548   0.126   7.140   1.817
  301    HB3  MET 548           1HB      MET 548  -0.065   5.507   1.214
  302    HG2  MET 548           2HG      MET 548   1.824   6.520   0.161
  303    HG3  MET 548           1HG      MET 548   0.562   6.306  -1.045
  304    HE1  MET 548           3HE      MET 548   1.077   9.013  -2.889
  305    HE2  MET 548           1HE      MET 548  -0.559   9.255  -2.278
  306    HE3  MET 548           2HE      MET 548   0.057   7.623  -2.523
  307    H    HIS 549           H        HIS 549  -3.904   7.914   0.683
  308    HA   HIS 549           HA       HIS 549  -2.880  10.532   1.551
  309    HB2  HIS 549           2HB      HIS 549  -5.596  10.176   0.345
  310    HB3  HIS 549           1HB      HIS 549  -4.537  11.581   0.308
  311    HD1  HIS 549           1HD      HIS 549  -5.925  10.080  -2.184
  312    HD2  HIS 549           2HD      HIS 549  -1.945   9.851  -1.014
  313    HE1  HIS 549           1HE      HIS 549  -4.658   9.377  -4.240
  314    HE2  HIS 549           2HE      HIS 549  -2.240   9.351  -3.534
  315    H    ASN 550           H        ASN 550  -5.957   8.738   1.715
  316    HA   ASN 550           HA       ASN 550  -6.127   8.284   4.401
  317    HB2  ASN 550           2HB      ASN 550  -6.502  11.119   3.785
  318    HB3  ASN 550           1HB      ASN 550  -7.848  10.427   4.682
  319   HD21  ASN 550          1HD2      ASN 550  -7.068   8.947   6.532
  320   HD22  ASN 550          2HD2      ASN 550  -5.830   9.616   7.535
  321    H    GLN 551           H        GLN 551  -7.060   6.732   2.664
  322    HA   GLN 551           HA       GLN 551  -9.950   7.245   2.436
  323    HB2  GLN 551           2HB      GLN 551  -9.526   5.227   0.649
  324    HB3  GLN 551           1HB      GLN 551  -9.608   6.933   0.243
  325    HG2  GLN 551           2HG      GLN 551  -7.693   6.338  -0.822
  326    HG3  GLN 551           1HG      GLN 551  -7.037   6.859   0.724
  327   HE21  GLN 551          1HE2      GLN 551  -7.037   4.969   2.385
  328   HE22  GLN 551          2HE2      GLN 551  -6.362   3.492   1.806
  329    H    ASP 552           H        ASP 552 -11.053   4.948   2.004
  330    HA   ASP 552           HA       ASP 552 -10.144   2.684   3.354
  331    HB2  ASP 552           2HB      ASP 552 -11.408   2.772   5.435
  332    HB3  ASP 552           1HB      ASP 552 -10.291   4.129   5.350
  333    H    GLY 553           H        GLY 553 -12.685   4.592   2.042
  334    HA2  GLY 553           2HA      GLY 553 -14.615   2.416   2.078
  335    HA3  GLY 553           1HA      GLY 553 -14.874   4.027   1.427
  336    H    LEU 554           H        LEU 554 -12.368   3.899  -0.130
  337    HA   LEU 554           HA       LEU 554 -13.473   2.608  -2.462
  338    HB2  LEU 554           2HB      LEU 554 -11.474   3.544  -3.596
  339    HB3  LEU 554           1HB      LEU 554 -12.458   4.741  -2.776
  340    HG   LEU 554           HG       LEU 554 -10.547   4.003  -0.878
  341   HD11  LEU 554          1HD1      LEU 554  -8.499   3.813  -1.839
  342   HD12  LEU 554          2HD1      LEU 554  -8.965   4.710  -3.285
  343   HD13  LEU 554          3HD1      LEU 554  -9.462   3.029  -3.091
  344   HD21  LEU 554          3HD2      LEU 554  -9.569   6.309  -1.724
  345   HD22  LEU 554          1HD2      LEU 554 -11.105   6.213  -0.863
  346   HD23  LEU 554          2HD2      LEU 554 -11.087   6.348  -2.621
  347    H    ILE 555           H        ILE 555 -11.693   1.487   0.079
  348    HA   ILE 555           HA       ILE 555 -10.687  -0.750  -1.502
  349    HB   ILE 555           HB       ILE 555  -8.576  -0.761  -0.203
  350   HG12  ILE 555          2HG1      ILE 555  -9.370   0.640   1.686
  351   HG13  ILE 555          1HG1      ILE 555  -7.863   1.211   1.002
  352   HG21  ILE 555          1HG2      ILE 555  -7.516   0.396  -1.801
  353   HG22  ILE 555          2HG2      ILE 555  -8.457   1.863  -1.510
  354   HG23  ILE 555          3HG2      ILE 555  -9.135   0.559  -2.487
  355   HD11  ILE 555          3HD1      ILE 555 -10.455   2.513   1.142
  356   HD12  ILE 555          1HD1      ILE 555  -9.649   2.641  -0.418
  357   HD13  ILE 555          2HD1      ILE 555  -8.835   3.200   1.042
  358    H    CYS 556           H        CYS 556 -11.291   0.632   1.691
  359    HA   CYS 556           HA       CYS 556 -11.523  -2.053   2.795
  360    HB2  CYS 556           2HB      CYS 556 -10.206   0.072   3.787
  361    HB3  CYS 556           1HB      CYS 556 -11.771   0.344   4.532
  362    H    GLY 557           H        GLY 557 -13.593  -2.239   1.541
  363    HA2  GLY 557           2HA      GLY 557 -15.807  -1.061   3.106
  364    HA3  GLY 557           1HA      GLY 557 -15.887  -1.250   1.363
  365    H    LEU 558           H        LEU 558 -15.480  -3.594   0.620
  366    HA   LEU 558           HA       LEU 558 -16.666  -5.489   2.515
  367    HB2  LEU 558           2HB      LEU 558 -18.181  -6.348   0.856
  368    HB3  LEU 558           1HB      LEU 558 -18.447  -4.627   1.051
  369    HG   LEU 558           HG       LEU 558 -16.855  -5.836  -1.210
  370   HD11  LEU 558          1HD1      LEU 558 -18.739  -5.685  -2.587
  371   HD12  LEU 558          2HD1      LEU 558 -19.636  -4.731  -1.405
  372   HD13  LEU 558          3HD1      LEU 558 -19.326  -6.442  -1.107
  373   HD21  LEU 558          3HD2      LEU 558 -16.187  -3.727  -1.483
  374   HD22  LEU 558          1HD2      LEU 558 -17.328  -3.130  -0.279
  375   HD23  LEU 558          2HD2      LEU 558 -17.848  -3.361  -1.948
  376    H    ARG 559           H        ARG 559 -15.083  -5.135  -0.662
  377    HA   ARG 559           HA       ARG 559 -13.004  -6.901  -0.110
  378    HB2  ARG 559           2HB      ARG 559 -13.621  -8.912  -1.279
  379    HB3  ARG 559           1HB      ARG 559 -14.851  -8.580  -0.068
  380    HG2  ARG 559           2HG      ARG 559 -15.460  -7.357  -2.626
  381    HG3  ARG 559           1HG      ARG 559 -15.289  -9.113  -2.734
  382    HD2  ARG 559           2HD      ARG 559 -16.892  -7.993  -0.495
  383    HD3  ARG 559           1HD      ARG 559 -17.592  -7.953  -2.113
  384    HE   ARG 559           HE       ARG 559 -16.533 -10.520  -1.353
  385   HH11  ARG 559          1HH1      ARG 559 -19.330  -8.434  -1.284
  386   HH12  ARG 559          2HH1      ARG 559 -20.454  -9.739  -1.107
  387   HH21  ARG 559          1HH2      ARG 559 -18.010 -12.236  -1.122
  388   HH22  ARG 559          2HH2      ARG 559 -19.704 -11.898  -1.016
  389    H    GLN 560           H        GLN 560 -13.412  -4.456  -1.413
  390    HA   GLN 560           HA       GLN 560 -12.872  -5.043  -4.230
  391    HB2  GLN 560           2HB      GLN 560 -13.387  -2.785  -4.719
  392    HB3  GLN 560           1HB      GLN 560 -14.595  -3.317  -3.559
  393    HG2  GLN 560           2HG      GLN 560 -12.423  -2.215  -2.108
  394    HG3  GLN 560           1HG      GLN 560 -12.838  -1.097  -3.407
  395   HE21  GLN 560          1HE2      GLN 560 -14.075  -2.837  -0.628
  396   HE22  GLN 560          2HE2      GLN 560 -15.415  -1.791  -0.334
  Start of MODEL    4
    1    H1   ALA 507           1HT      ALA 507 -11.406  -9.844  -5.812
    2    H2   ALA 507           2HT      ALA 507 -10.920 -11.405  -6.334
    3    H3   ALA 507           3HT      ALA 507 -11.096 -11.075  -4.660
    4    HA   ALA 507           HA       ALA 507 -13.159 -11.334  -6.722
    5    HB1  ALA 507           1HB      ALA 507 -14.085 -12.892  -4.967
    6    HB2  ALA 507           2HB      ALA 507 -12.551 -12.709  -4.117
    7    HB3  ALA 507           3HB      ALA 507 -12.584 -13.405  -5.737
    8    H    GLN 508           H        GLN 508 -12.981 -10.806  -3.200
    9    HA   GLN 508           HA       GLN 508 -14.356  -8.327  -3.272
   10    HB2  GLN 508           2HB      GLN 508 -16.477  -9.050  -2.255
   11    HB3  GLN 508           1HB      GLN 508 -16.265  -9.718  -3.866
   12    HG2  GLN 508           2HG      GLN 508 -15.995 -11.857  -3.098
   13    HG3  GLN 508           1HG      GLN 508 -15.402 -11.333  -1.523
   14   HE21  GLN 508          1HE2      GLN 508 -17.014 -10.253  -0.120
   15   HE22  GLN 508          2HE2      GLN 508 -18.634 -10.852  -0.142
   16    HA   PRO 509           HA       PRO 509 -12.269  -9.679   0.719
   17    HB2  PRO 509           2HB      PRO 509  -9.952  -8.342   0.513
   18    HB3  PRO 509           1HB      PRO 509 -10.178  -9.923  -0.244
   19    HG2  PRO 509           2HG      PRO 509 -10.298  -7.199  -1.475
   20    HG3  PRO 509           1HG      PRO 509  -9.545  -8.678  -2.100
   21    HD2  PRO 509           2HD      PRO 509 -12.010  -7.762  -2.885
   22    HD3  PRO 509           1HD      PRO 509 -11.519  -9.466  -2.948
   23    H    LYS 510           H        LYS 510 -10.882  -7.861   2.150
   24    HA   LYS 510           HA       LYS 510 -12.416  -5.361   2.068
   25    HB2  LYS 510           2HB      LYS 510 -11.961  -7.023   4.554
   26    HB3  LYS 510           1HB      LYS 510 -12.739  -5.447   4.501
   27    HG2  LYS 510           2HG      LYS 510 -14.700  -6.309   3.880
   28    HG3  LYS 510           1HG      LYS 510 -13.955  -7.392   2.703
   29    HD2  LYS 510           2HD      LYS 510 -13.316  -8.239   5.378
   30    HD3  LYS 510           1HD      LYS 510 -15.062  -8.065   5.193
   31    HE2  LYS 510           2HE      LYS 510 -14.832  -9.419   3.064
   32    HE3  LYS 510           1HE      LYS 510 -13.183  -9.772   3.578
   33    HZ1  LYS 510           3HZ      LYS 510 -14.101 -10.717   5.633
   34    HZ2  LYS 510           1HZ      LYS 510 -14.647 -11.535   4.257
   35    HZ3  LYS 510           2HZ      LYS 510 -15.668 -10.449   5.055
   36    H    CYS 511           H        CYS 511 -11.036  -3.717   1.983
   37    HA   CYS 511           HA       CYS 511  -9.189  -2.417   2.273
   38    HB2  CYS 511           2HB      CYS 511  -9.616  -3.767   4.804
   39    HB3  CYS 511           1HB      CYS 511  -7.907  -3.440   4.545
   40    H    ASN 512           H        ASN 512  -8.085  -3.139   0.450
   41    HA   ASN 512           HA       ASN 512  -6.343  -5.437   0.660
   42    HB2  ASN 512           2HB      ASN 512  -6.643  -3.566  -1.687
   43    HB3  ASN 512           1HB      ASN 512  -5.920  -5.169  -1.690
   44   HD21  ASN 512          1HD2      ASN 512  -8.938  -3.415  -1.248
   45   HD22  ASN 512          2HD2      ASN 512  -9.973  -4.723  -1.688
   46    HA   PRO 513           HA       PRO 513  -3.010  -2.103   0.479
   47    HB2  PRO 513           2HB      PRO 513  -3.716   0.410  -0.285
   48    HB3  PRO 513           1HB      PRO 513  -3.446  -0.911  -1.424
   49    HG2  PRO 513           2HG      PRO 513  -5.927   0.425  -0.813
   50    HG3  PRO 513           1HG      PRO 513  -5.627  -0.846  -2.007
   51    HD2  PRO 513           2HD      PRO 513  -6.681  -1.068   0.750
   52    HD3  PRO 513           1HD      PRO 513  -6.925  -2.133  -0.648
   53    H    ASN 514           H        ASN 514  -5.398  -2.016   2.551
   54    HA   ASN 514           HA       ASN 514  -4.256   0.154   4.177
   55    HB2  ASN 514           2HB      ASN 514  -7.075  -0.527   3.546
   56    HB3  ASN 514           1HB      ASN 514  -6.739  -0.093   5.220
   57   HD21  ASN 514          1HD2      ASN 514  -6.994   1.012   1.966
   58   HD22  ASN 514          2HD2      ASN 514  -6.795   2.693   2.297
   59    H    LEU 515           H        LEU 515  -2.941  -1.968   4.467
   60    HA   LEU 515           HA       LEU 515  -4.135  -3.569   6.621
   61    HB2  LEU 515           2HB      LEU 515  -1.655  -4.476   5.286
   62    HB3  LEU 515           1HB      LEU 515  -3.019  -5.406   5.868
   63    HG   LEU 515           HG       LEU 515  -3.018  -5.684   3.535
   64   HD11  LEU 515          1HD1      LEU 515  -5.221  -5.442   3.602
   65   HD12  LEU 515          2HD1      LEU 515  -4.989  -3.797   3.014
   66   HD13  LEU 515          3HD1      LEU 515  -5.110  -4.104   4.745
   67   HD21  LEU 515          3HD2      LEU 515  -2.109  -4.244   2.104
   68   HD22  LEU 515          1HD2      LEU 515  -1.733  -3.206   3.480
   69   HD23  LEU 515          2HD2      LEU 515  -3.232  -2.972   2.583
   70    H    HIS 516           H        HIS 516  -1.101  -2.002   5.604
   71    HA   HIS 516           HA       HIS 516  -0.529  -0.987   8.151
   72    HB2  HIS 516           2HB      HIS 516   0.897  -2.472   9.160
   73    HB3  HIS 516           1HB      HIS 516  -0.165  -3.605   8.332
   74    HD1  HIS 516           1HD      HIS 516   0.824  -4.954   6.397
   75    HD2  HIS 516           2HD      HIS 516   3.450  -2.199   8.041
   76    HE1  HIS 516           1HE      HIS 516   3.040  -5.425   5.319
   77    HE2  HIS 516           2HE      HIS 516   4.662  -3.867   6.467
   78    H    TYR 517           H        TYR 517   1.296  -2.447   5.448
   79    HA   TYR 517           HA       TYR 517   3.421  -0.681   5.442
   80    HB2  TYR 517           2HB      TYR 517   2.979  -1.321   2.723
   81    HB3  TYR 517           1HB      TYR 517   4.174  -1.983   3.815
   82    HD1  TYR 517           1HD      TYR 517   0.459  -2.587   3.882
   83    HD2  TYR 517           2HD      TYR 517   4.337  -4.159   3.084
   84    HE1  TYR 517           1HE      TYR 517  -0.507  -4.822   3.577
   85    HE2  TYR 517           2HE      TYR 517   3.370  -6.396   2.777
   86    HH   TYR 517           HH       TYR 517   1.214  -7.408   2.212
   87    H    TRP 518           H        TRP 518   0.213  -0.065   4.390
   88    HA   TRP 518           HA       TRP 518   1.166   2.410   3.110
   89    HB2  TRP 518           2HB      TRP 518  -1.520   1.414   2.372
   90    HB3  TRP 518           1HB      TRP 518  -0.301   2.180   1.383
   91    HD1  TRP 518           HD       TRP 518   0.881  -0.986   3.052
   92    HE1  TRP 518           1HE      TRP 518   1.021  -2.837   1.350
   93    HE3  TRP 518           3HE      TRP 518  -1.524   1.319  -0.815
   94    HZ2  TRP 518           2HZ      TRP 518   0.183  -3.333  -1.303
   95    HZ3  TRP 518           3HZ      TRP 518  -1.810   0.073  -2.917
   96    HH2  TRP 518           HH       TRP 518  -0.966  -2.206  -3.157
   97    H    THR 519           H        THR 519  -1.429   0.909   4.933
   98    HA   THR 519           HA       THR 519  -3.017   3.111   5.464
   99    HB   THR 519           HB       THR 519  -3.663   0.832   6.052
  100    HG1  THR 519           1HG      THR 519  -4.456   1.291   8.164
  101   HG21  THR 519          3HG2      THR 519  -2.016   0.853   8.511
  102   HG22  THR 519          1HG2      THR 519  -1.236   0.399   6.996
  103   HG23  THR 519          2HG2      THR 519  -2.641  -0.500   7.572
  104    H    THR 520           H        THR 520   0.005   2.167   6.884
  105    HA   THR 520           HA       THR 520  -0.172   4.229   8.937
  106    HB   THR 520           HB       THR 520   1.395   1.782   8.541
  107    HG1  THR 520           1HG      THR 520   0.835   3.288  10.872
  108   HG21  THR 520          3HG2      THR 520   3.366   3.020   8.397
  109   HG22  THR 520          1HG2      THR 520   3.216   2.652  10.117
  110   HG23  THR 520          2HG2      THR 520   2.783   4.252   9.517
  111    H    GLN 521           H        GLN 521   2.424   3.242   6.719
  112    HA   GLN 521           HA       GLN 521   3.237   6.039   6.549
  113    HB2  GLN 521           2HB      GLN 521   5.384   5.244   5.857
  114    HB3  GLN 521           1HB      GLN 521   4.881   4.290   7.241
  115    HG2  GLN 521           2HG      GLN 521   4.883   2.387   6.095
  116    HG3  GLN 521           1HG      GLN 521   4.126   3.113   4.683
  117   HE21  GLN 521          1HE2      GLN 521   6.051   5.110   4.147
  118   HE22  GLN 521          2HE2      GLN 521   7.499   4.340   3.617
  119    H    ASP 522           H        ASP 522   4.615   6.107   4.263
  120    HA   ASP 522           HA       ASP 522   2.501   6.217   2.284
  121    HB2  ASP 522           2HB      ASP 522   5.355   7.176   2.206
  122    HB3  ASP 522           1HB      ASP 522   4.172   7.448   0.932
  123    H    GLU 523           H        GLU 523   3.854   3.654   3.136
  124    HA   GLU 523           HA       GLU 523   4.338   1.655   2.163
  125    HB2  GLU 523           2HB      GLU 523   3.932   2.978  -0.512
  126    HB3  GLU 523           1HB      GLU 523   3.785   1.271  -0.120
  127    HG2  GLU 523           2HG      GLU 523   1.766   1.592   1.024
  128    HG3  GLU 523           1HG      GLU 523   2.000   3.337   1.114
  129    H    GLY 524           H        GLY 524   6.178   4.278   2.064
  130    HA2  GLY 524           2HA      GLY 524   8.614   3.608   2.146
  131    HA3  GLY 524           1HA      GLY 524   8.336   3.022   0.512
  132    H    ALA 525           H        ALA 525   6.662   5.897   1.459
  133    HA   ALA 525           HA       ALA 525   8.359   7.396  -0.372
  134    HB1  ALA 525           1HB      ALA 525   5.690   7.243  -0.305
  135    HB2  ALA 525           2HB      ALA 525   6.566   8.637  -0.938
  136    HB3  ALA 525           3HB      ALA 525   5.932   8.667   0.707
  137    H    ALA 526           H        ALA 526   7.538   7.226   2.983
  138    HA   ALA 526           HA       ALA 526   8.581   9.820   3.587
  139    HB1  ALA 526           1HB      ALA 526   8.310   8.799   6.004
  140    HB2  ALA 526           2HB      ALA 526   7.296   7.649   5.135
  141    HB3  ALA 526           3HB      ALA 526   6.921   9.372   5.080
  142    H    ILE 527           H        ILE 527  10.284   7.672   2.365
  143    HA   ILE 527           HA       ILE 527  12.467   7.775   4.322
  144    HB   ILE 527           HB       ILE 527  12.930   5.501   2.781
  145   HG12  ILE 527          2HG1      ILE 527  10.493   5.686   2.129
  146   HG13  ILE 527          1HG1      ILE 527  10.962   4.157   2.860
  147   HG21  ILE 527          1HG2      ILE 527  13.614   5.171   4.894
  148   HG22  ILE 527          2HG2      ILE 527  12.009   4.474   5.114
  149   HG23  ILE 527          3HG2      ILE 527  12.315   6.149   5.575
  150   HD11  ILE 527          3HD1      ILE 527   8.925   5.959   3.642
  151   HD12  ILE 527          1HD1      ILE 527  10.117   5.870   4.938
  152   HD13  ILE 527          2HD1      ILE 527   9.348   4.397   4.344
  153    H    GLY 528           H        GLY 528  11.573   7.265   0.920
  154    HA2  GLY 528           2HA      GLY 528  12.810   9.053  -0.489
  155    HA3  GLY 528           1HA      GLY 528  14.237   8.235   0.125
  156    H    LEU 529           H        LEU 529  12.352   5.725  -0.086
  157    HA   LEU 529           HA       LEU 529  11.970   4.047  -1.529
  158    HB2  LEU 529           2HB      LEU 529  11.270   6.325  -2.929
  159    HB3  LEU 529           1HB      LEU 529  12.320   5.455  -4.033
  160    HG   LEU 529           HG       LEU 529   9.673   4.635  -2.915
  161   HD11  LEU 529          1HD1      LEU 529  10.844   4.404  -5.679
  162   HD12  LEU 529          2HD1      LEU 529   9.900   5.784  -5.116
  163   HD13  LEU 529          3HD1      LEU 529   9.158   4.186  -5.206
  164   HD21  LEU 529          3HD2      LEU 529  10.194   2.356  -3.918
  165   HD22  LEU 529          1HD2      LEU 529  10.920   2.738  -2.353
  166   HD23  LEU 529          2HD2      LEU 529  11.890   2.837  -3.824
  167    H    ALA 530           H        ALA 530  14.569   6.125  -2.706
  168    HA   ALA 530           HA       ALA 530  15.867   3.969  -4.029
  169    HB1  ALA 530           1HB      ALA 530  16.392   5.945  -5.053
  170    HB2  ALA 530           2HB      ALA 530  17.815   5.735  -4.034
  171    HB3  ALA 530           3HB      ALA 530  16.524   6.826  -3.531
  172    H    TRP 531           H        TRP 531  15.905   5.110  -0.814
  173    HA   TRP 531           HA       TRP 531  18.398   4.572   0.164
  174    HB2  TRP 531           2HB      TRP 531  17.195   3.905   2.305
  175    HB3  TRP 531           1HB      TRP 531  16.747   5.469   1.637
  176    HD1  TRP 531           HD       TRP 531  14.511   5.127  -0.186
  177    HE1  TRP 531           1HE      TRP 531  12.310   3.994   0.391
  178    HE3  TRP 531           3HE      TRP 531  16.074   2.360   3.809
  179    HZ2  TRP 531           2HZ      TRP 531  11.323   2.154   2.309
  180    HZ3  TRP 531           3HZ      TRP 531  14.433   0.940   4.969
  181    HH2  TRP 531           HH       TRP 531  12.105   0.840   4.235
  182    H    ILE 532           H        ILE 532  16.036   2.320  -0.999
  183    HA   ILE 532           HA       ILE 532  17.709   0.067  -0.135
  184    HB   ILE 532           HB       ILE 532  15.684  -1.298  -0.384
  185   HG12  ILE 532          2HG1      ILE 532  14.700   1.169  -1.589
  186   HG13  ILE 532          1HG1      ILE 532  14.106  -0.471  -1.754
  187   HG21  ILE 532          1HG2      ILE 532  15.570   1.088   1.433
  188   HG22  ILE 532          2HG2      ILE 532  16.206  -0.518   1.794
  189   HG23  ILE 532          3HG2      ILE 532  14.471  -0.285   1.581
  190   HD11  ILE 532          3HD1      ILE 532  12.285   0.403  -0.773
  191   HD12  ILE 532          1HD1      ILE 532  13.189   1.711  -0.020
  192   HD13  ILE 532          2HD1      ILE 532  13.190   0.106   0.709
  193    HA   PRO 533           HA       PRO 533  18.272  -0.880  -4.421
  194    HB2  PRO 533           2HB      PRO 533  19.228  -3.352  -4.251
  195    HB3  PRO 533           1HB      PRO 533  20.087  -1.996  -3.511
  196    HG2  PRO 533           2HG      PRO 533  18.393  -4.092  -2.235
  197    HG3  PRO 533           1HG      PRO 533  19.865  -3.314  -1.629
  198    HD2  PRO 533           2HD      PRO 533  17.220  -2.635  -0.954
  199    HD3  PRO 533           1HD      PRO 533  18.670  -1.671  -0.618
  200    H    TYR 534           H        TYR 534  16.054  -2.954  -2.614
  201    HA   TYR 534           HA       TYR 534  14.569  -3.417  -5.064
  202    HB2  TYR 534           2HB      TYR 534  14.542  -5.872  -4.799
  203    HB3  TYR 534           1HB      TYR 534  16.149  -5.243  -5.147
  204    HD1  TYR 534           1HD      TYR 534  13.996  -6.180  -2.241
  205    HD2  TYR 534           2HD      TYR 534  17.927  -5.967  -3.855
  206    HE1  TYR 534           1HE      TYR 534  14.869  -7.329  -0.249
  207    HE2  TYR 534           2HE      TYR 534  18.811  -7.117  -1.868
  208    HH   TYR 534           HH       TYR 534  16.850  -8.712   0.358
  209    H    PHE 535           H        PHE 535  14.396  -2.582  -1.941
  210    HA   PHE 535           HA       PHE 535  12.157  -4.190  -1.100
  211    HB2  PHE 535           2HB      PHE 535  13.290  -1.631   0.026
  212    HB3  PHE 535           1HB      PHE 535  12.008  -2.558   0.779
  213    HD1  PHE 535           2HD      PHE 535  15.412  -3.227  -0.612
  214    HD2  PHE 535           1HD      PHE 535  12.652  -3.791   2.572
  215    HE1  PHE 535           2HE      PHE 535  17.103  -4.503   0.617
  216    HE2  PHE 535           1HE      PHE 535  14.344  -5.067   3.813
  217    HZ   PHE 535           HZ       PHE 535  16.575  -5.427   2.836
  218    H    GLY 536           H        GLY 536  12.654  -0.919  -2.302
  219    HA2  GLY 536           2HA      GLY 536   9.747  -0.565  -2.533
  220    HA3  GLY 536           1HA      GLY 536  10.920   0.736  -2.439
  221    HA   PRO 537           HA       PRO 537  11.574   1.142  -6.792
  222    HB2  PRO 537           2HB      PRO 537  14.038  -0.544  -6.745
  223    HB3  PRO 537           1HB      PRO 537  13.787   1.062  -7.443
  224    HG2  PRO 537           2HG      PRO 537  15.101   0.768  -5.146
  225    HG3  PRO 537           1HG      PRO 537  13.992   2.129  -5.393
  226    HD2  PRO 537           2HD      PRO 537  13.630  -0.351  -3.786
  227    HD3  PRO 537           1HD      PRO 537  13.018   1.288  -3.486
  228    H    ALA 538           H        ALA 538  12.434  -2.114  -5.688
  229    HA   ALA 538           HA       ALA 538  11.504  -3.345  -8.131
  230    HB1  ALA 538           1HB      ALA 538  12.102  -4.882  -5.638
  231    HB2  ALA 538           2HB      ALA 538  13.415  -4.132  -6.546
  232    HB3  ALA 538           3HB      ALA 538  12.376  -5.327  -7.322
  233    H    ALA 539           H        ALA 539  10.299  -2.688  -4.931
  234    HA   ALA 539           HA       ALA 539   8.176  -4.493  -4.778
  235    HB1  ALA 539           1HB      ALA 539   8.281  -3.503  -2.777
  236    HB2  ALA 539           2HB      ALA 539   7.223  -2.280  -3.482
  237    HB3  ALA 539           3HB      ALA 539   8.966  -2.022  -3.444
  238    H    GLU 540           H        GLU 540   5.990  -4.333  -5.279
  239    HA   GLU 540           HA       GLU 540   5.234  -2.206  -7.167
  240    HB2  GLU 540           2HB      GLU 540   4.544  -5.139  -7.424
  241    HB3  GLU 540           1HB      GLU 540   3.991  -3.857  -8.493
  242    HG2  GLU 540           2HG      GLU 540   6.624  -3.463  -8.683
  243    HG3  GLU 540           1HG      GLU 540   6.618  -5.189  -8.324
  244    H    GLY 541           H        GLY 541   4.242  -4.564  -4.769
  245    HA2  GLY 541           2HA      GLY 541   1.681  -3.126  -4.475
  246    HA3  GLY 541           1HA      GLY 541   1.898  -4.830  -4.102
  247    H    ILE 542           H        ILE 542   4.321  -2.485  -3.262
  248    HA   ILE 542           HA       ILE 542   3.395  -2.403  -0.486
  249    HB   ILE 542           HB       ILE 542   6.298  -2.866  -0.860
  250   HG12  ILE 542          2HG1      ILE 542   5.769  -5.391  -0.671
  251   HG13  ILE 542          1HG1      ILE 542   4.193  -4.952  -1.333
  252   HG21  ILE 542          1HG2      ILE 542   4.759  -4.345   1.157
  253   HG22  ILE 542          2HG2      ILE 542   4.669  -2.589   1.291
  254   HG23  ILE 542          3HG2      ILE 542   6.236  -3.397   1.325
  255   HD11  ILE 542          3HD1      ILE 542   5.196  -5.299  -3.306
  256   HD12  ILE 542          1HD1      ILE 542   6.815  -5.101  -2.634
  257   HD13  ILE 542          2HD1      ILE 542   5.856  -3.677  -3.056
  258    H    TYR 543           H        TYR 543   4.659  -0.799  -3.154
  259    HA   TYR 543           HA       TYR 543   5.568   1.381  -1.465
  260    HB2  TYR 543           2HB      TYR 543   7.492   1.549  -2.620
  261    HB3  TYR 543           1HB      TYR 543   7.185  -0.127  -3.008
  262    HD1  TYR 543           2HD      TYR 543   5.986  -0.644  -5.185
  263    HD2  TYR 543           1HD      TYR 543   7.687   3.156  -4.313
  264    HE1  TYR 543           2HE      TYR 543   5.984  -0.100  -7.576
  265    HE2  TYR 543           1HE      TYR 543   7.697   3.713  -6.700
  266    HH   TYR 543           HH       TYR 543   7.081   1.367  -9.139
  267    H    ILE 544           H        ILE 544   4.155   0.428  -4.554
  268    HA   ILE 544           HA       ILE 544   3.072   1.622  -6.193
  269    HB   ILE 544           HB       ILE 544   1.422   2.545  -3.858
  270   HG12  ILE 544          2HG1      ILE 544   0.194   0.287  -4.486
  271   HG13  ILE 544          1HG1      ILE 544   1.812  -0.185  -4.994
  272   HG21  ILE 544          1HG2      ILE 544  -0.419   2.103  -5.540
  273   HG22  ILE 544          2HG2      ILE 544   0.859   1.975  -6.750
  274   HG23  ILE 544          3HG2      ILE 544   0.631   3.484  -5.864
  275   HD11  ILE 544          3HD1      ILE 544   0.936   0.664  -2.249
  276   HD12  ILE 544          1HD1      ILE 544   2.616   0.406  -2.713
  277   HD13  ILE 544          2HD1      ILE 544   1.473  -0.934  -2.761
  278    H    GLU 545           H        GLU 545   2.702   3.848  -3.472
  279    HA   GLU 545           HA       GLU 545   3.162   6.052  -3.208
  280    HB2  GLU 545           2HB      GLU 545   4.955   5.780  -5.619
  281    HB3  GLU 545           1HB      GLU 545   5.023   7.027  -4.378
  282    HG2  GLU 545           2HG      GLU 545   5.405   5.098  -2.742
  283    HG3  GLU 545           1HG      GLU 545   5.765   4.136  -4.173
  284    H    GLY 546           H        GLY 546   1.107   6.683  -3.661
  285    HA2  GLY 546           2HA      GLY 546   0.553   8.663  -5.379
  286    HA3  GLY 546           1HA      GLY 546   0.281   7.245  -6.382
  287    H    LEU 547           H        LEU 547  -0.519   5.912  -3.671
  288    HA   LEU 547           HA       LEU 547  -3.238   7.055  -3.525
  289    HB2  LEU 547           2HB      LEU 547  -4.242   4.987  -3.715
  290    HB3  LEU 547           1HB      LEU 547  -2.917   4.859  -4.854
  291    HG   LEU 547           HG       LEU 547  -2.943   3.724  -2.054
  292   HD11  LEU 547          1HD1      LEU 547  -2.750   2.062  -4.512
  293   HD12  LEU 547          2HD1      LEU 547  -4.330   2.695  -4.051
  294   HD13  LEU 547          3HD1      LEU 547  -3.429   1.674  -2.931
  295   HD21  LEU 547          3HD2      LEU 547  -0.856   3.725  -4.222
  296   HD22  LEU 547          1HD2      LEU 547  -0.851   2.580  -2.880
  297   HD23  LEU 547          2HD2      LEU 547  -0.710   4.311  -2.564
  298    H    MET 548           H        MET 548  -0.492   6.353  -1.867
  299    HA   MET 548           HA       MET 548  -1.691   5.392   0.562
  300    HB2  MET 548           2HB      MET 548   0.852   6.300   1.258
  301    HB3  MET 548           1HB      MET 548   0.379   4.650   0.911
  302    HG2  MET 548           2HG      MET 548   2.175   4.866  -0.452
  303    HG3  MET 548           1HG      MET 548   0.910   5.343  -1.568
  304    HE1  MET 548           3HE      MET 548   0.067   8.042  -0.991
  305    HE2  MET 548           1HE      MET 548   0.802   8.025  -2.588
  306    HE3  MET 548           2HE      MET 548   1.248   9.271  -1.425
  307    H    HIS 549           H        HIS 549  -3.229   7.085   0.880
  308    HA   HIS 549           HA       HIS 549  -2.044   9.405   2.242
  309    HB2  HIS 549           2HB      HIS 549  -4.613   9.782   0.767
  310    HB3  HIS 549           1HB      HIS 549  -3.363  10.957   1.156
  311    HD1  HIS 549           1HD      HIS 549  -4.781   9.854  -1.707
  312    HD2  HIS 549           2HD      HIS 549  -0.840   9.710  -0.405
  313    HE1  HIS 549           1HE      HIS 549  -3.393   9.629  -3.794
  314    HE2  HIS 549           2HE      HIS 549  -1.018   9.448  -2.972
  315    H    ASN 550           H        ASN 550  -5.306   8.166   1.582
  316    HA   ASN 550           HA       ASN 550  -5.947   6.991   3.954
  317    HB2  ASN 550           2HB      ASN 550  -5.808   9.910   4.231
  318    HB3  ASN 550           1HB      ASN 550  -7.341   9.224   4.760
  319   HD21  ASN 550          1HD2      ASN 550  -5.575  10.478   6.487
  320   HD22  ASN 550          2HD2      ASN 550  -4.949   9.308   7.594
  321    H    GLN 551           H        GLN 551  -6.857   6.170   1.820
  322    HA   GLN 551           HA       GLN 551  -9.297   7.479   0.967
  323    HB2  GLN 551           2HB      GLN 551  -8.677   4.817  -0.133
  324    HB3  GLN 551           1HB      GLN 551  -9.145   6.295  -0.956
  325    HG2  GLN 551           2HG      GLN 551  -7.055   6.411  -1.681
  326    HG3  GLN 551           1HG      GLN 551  -6.595   6.840  -0.037
  327   HE21  GLN 551          1HE2      GLN 551  -7.001   4.407   1.233
  328   HE22  GLN 551          2HE2      GLN 551  -5.854   3.264   0.637
  329    H    ASP 552           H        ASP 552  -8.690   4.067   1.573
  330    HA   ASP 552           HA       ASP 552  -9.899   2.444   2.596
  331    HB2  ASP 552           2HB      ASP 552  -9.722   4.535   4.413
  332    HB3  ASP 552           1HB      ASP 552 -11.442   4.155   4.392
  333    H    GLY 553           H        GLY 553 -11.044   4.156   0.374
  334    HA2  GLY 553           2HA      GLY 553 -13.867   3.370   0.758
  335    HA3  GLY 553           1HA      GLY 553 -13.400   4.836  -0.096
  336    H    LEU 554           H        LEU 554 -11.194   3.746  -1.496
  337    HA   LEU 554           HA       LEU 554 -12.603   2.436  -3.651
  338    HB2  LEU 554           2HB      LEU 554 -10.493   2.689  -4.869
  339    HB3  LEU 554           1HB      LEU 554 -11.035   4.202  -4.170
  340    HG   LEU 554           HG       LEU 554  -9.362   3.246  -2.207
  341   HD11  LEU 554          1HD1      LEU 554  -7.869   2.753  -4.754
  342   HD12  LEU 554          2HD1      LEU 554  -8.766   1.452  -3.974
  343   HD13  LEU 554          3HD1      LEU 554  -7.466   2.269  -3.106
  344   HD21  LEU 554          3HD2      LEU 554  -8.068   4.837  -4.325
  345   HD22  LEU 554          1HD2      LEU 554  -8.250   5.165  -2.602
  346   HD23  LEU 554          2HD2      LEU 554  -9.588   5.481  -3.704
  347    H    ILE 555           H        ILE 555 -11.232   1.343  -0.889
  348    HA   ILE 555           HA       ILE 555 -10.752  -1.304  -2.028
  349    HB   ILE 555           HB       ILE 555  -8.785  -1.615  -0.561
  350   HG12  ILE 555          2HG1      ILE 555  -9.321   0.179   1.070
  351   HG13  ILE 555          1HG1      ILE 555  -7.684   0.289   0.455
  352   HG21  ILE 555          1HG2      ILE 555  -7.743   0.611  -2.043
  353   HG22  ILE 555          2HG2      ILE 555  -8.926  -0.275  -3.006
  354   HG23  ILE 555          3HG2      ILE 555  -7.537  -1.120  -2.320
  355   HD11  ILE 555          3HD1      ILE 555  -9.061   1.878  -1.273
  356   HD12  ILE 555          1HD1      ILE 555  -8.126   2.428   0.116
  357   HD13  ILE 555          2HD1      ILE 555  -9.867   2.181   0.265
  358    H    CYS 556           H        CYS 556 -11.195   0.701   0.838
  359    HA   CYS 556           HA       CYS 556 -12.224  -1.623   2.280
  360    HB2  CYS 556           2HB      CYS 556 -10.457   0.356   3.064
  361    HB3  CYS 556           1HB      CYS 556 -11.975   0.862   3.802
  362    H    GLY 557           H        GLY 557 -14.271  -1.649   3.169
  363    HA2  GLY 557           2HA      GLY 557 -16.017   0.537   3.350
  364    HA3  GLY 557           1HA      GLY 557 -16.294  -0.257   1.806
  365    H    LEU 558           H        LEU 558 -16.649  -2.662   1.934
  366    HA   LEU 558           HA       LEU 558 -17.811  -3.542   4.455
  367    HB2  LEU 558           2HB      LEU 558 -19.889  -4.249   3.361
  368    HB3  LEU 558           1HB      LEU 558 -19.666  -2.512   3.328
  369    HG   LEU 558           HG       LEU 558 -18.866  -4.149   0.954
  370   HD11  LEU 558          1HD1      LEU 558 -20.986  -4.326   0.117
  371   HD12  LEU 558          2HD1      LEU 558 -21.605  -3.002   1.104
  372   HD13  LEU 558          3HD1      LEU 558 -21.300  -4.579   1.834
  373   HD21  LEU 558          3HD2      LEU 558 -18.681  -2.171  -0.075
  374   HD22  LEU 558          1HD2      LEU 558 -18.674  -1.487   1.550
  375   HD23  LEU 558          2HD2      LEU 558 -20.177  -1.558   0.630
  376    H    ARG 559           H        ARG 559 -16.959  -4.348   1.113
  377    HA   ARG 559           HA       ARG 559 -15.486  -6.610   1.728
  378    HB2  ARG 559           2HB      ARG 559 -17.106  -8.376   0.870
  379    HB3  ARG 559           1HB      ARG 559 -17.435  -7.744   2.481
  380    HG2  ARG 559           2HG      ARG 559 -19.516  -7.453   1.724
  381    HG3  ARG 559           1HG      ARG 559 -18.845  -6.027   0.925
  382    HD2  ARG 559           2HD      ARG 559 -19.471  -6.891  -1.015
  383    HD3  ARG 559           1HD      ARG 559 -18.279  -8.169  -0.777
  384    HE   ARG 559           HE       ARG 559 -20.664  -8.796   0.600
  385   HH11  ARG 559          1HH1      ARG 559 -19.350  -8.627  -2.629
  386   HH12  ARG 559          2HH1      ARG 559 -20.413  -9.840  -3.259
  387   HH21  ARG 559          1HH2      ARG 559 -22.062 -10.392  -0.228
  388   HH22  ARG 559          2HH2      ARG 559 -21.952 -10.842  -1.896
  389    H    GLN 560           H        GLN 560 -15.587  -4.396  -0.037
  390    HA   GLN 560           HA       GLN 560 -16.080  -5.308  -2.702
  391    HB2  GLN 560           2HB      GLN 560 -15.237  -3.177  -3.422
  392    HB3  GLN 560           1HB      GLN 560 -16.236  -2.916  -2.000
  393    HG2  GLN 560           2HG      GLN 560 -13.287  -3.232  -1.681
  394    HG3  GLN 560           1HG      GLN 560 -13.948  -1.702  -2.254
  395   HE21  GLN 560          1HE2      GLN 560 -13.623  -3.862   0.420
  396   HE22  GLN 560          2HE2      GLN 560 -14.283  -2.814   1.623
  Start of MODEL    5
    1    H1   ALA 507           1HT      ALA 507  -9.430  -7.612  -6.904
    2    H2   ALA 507           2HT      ALA 507  -8.930  -8.591  -8.223
    3    H3   ALA 507           3HT      ALA 507  -9.608  -9.315  -6.822
    4    HA   ALA 507           HA       ALA 507 -10.887  -7.803  -8.959
    5    HB1  ALA 507           1HB      ALA 507 -12.122 -10.107  -7.572
    6    HB2  ALA 507           2HB      ALA 507 -10.686 -10.430  -8.542
    7    HB3  ALA 507           3HB      ALA 507 -12.103  -9.689  -9.285
    8    H    GLN 508           H        GLN 508 -11.723  -9.095  -5.737
    9    HA   GLN 508           HA       GLN 508 -12.917  -6.581  -4.972
   10    HB2  GLN 508           2HB      GLN 508 -15.136  -7.683  -4.461
   11    HB3  GLN 508           1HB      GLN 508 -14.794  -7.407  -6.164
   12    HG2  GLN 508           2HG      GLN 508 -15.308  -9.535  -6.498
   13    HG3  GLN 508           1HG      GLN 508 -13.795  -9.940  -5.688
   14   HE21  GLN 508          1HE2      GLN 508 -17.088  -8.949  -4.798
   15   HE22  GLN 508          2HE2      GLN 508 -17.282 -10.114  -3.538
   16    HA   PRO 509           HA       PRO 509 -11.428  -9.428  -1.535
   17    HB2  PRO 509           2HB      PRO 509  -9.019  -8.392  -1.008
   18    HB3  PRO 509           1HB      PRO 509  -9.248  -9.559  -2.318
   19    HG2  PRO 509           2HG      PRO 509  -9.010  -6.578  -2.458
   20    HG3  PRO 509           1HG      PRO 509  -8.278  -7.809  -3.504
   21    HD2  PRO 509           2HD      PRO 509 -10.553  -6.401  -4.137
   22    HD3  PRO 509           1HD      PRO 509 -10.158  -8.003  -4.790
   23    H    LYS 510           H        LYS 510 -11.087  -8.838   0.716
   24    HA   LYS 510           HA       LYS 510 -12.421  -6.363   1.385
   25    HB2  LYS 510           2HB      LYS 510 -11.294  -8.513   3.188
   26    HB3  LYS 510           1HB      LYS 510 -12.341  -7.193   3.691
   27    HG2  LYS 510           2HG      LYS 510 -14.144  -8.373   3.191
   28    HG3  LYS 510           1HG      LYS 510 -13.576  -8.613   1.538
   29    HD2  LYS 510           2HD      LYS 510 -12.191 -10.266   3.515
   30    HD3  LYS 510           1HD      LYS 510 -13.921 -10.590   3.403
   31    HE2  LYS 510           2HE      LYS 510 -13.581 -10.708   0.887
   32    HE3  LYS 510           1HE      LYS 510 -11.851 -10.744   1.228
   33    HZ1  LYS 510           3HZ      LYS 510 -13.466 -12.908   1.103
   34    HZ2  LYS 510           1HZ      LYS 510 -13.365 -12.641   2.772
   35    HZ3  LYS 510           2HZ      LYS 510 -11.955 -12.865   1.864
   36    H    CYS 511           H        CYS 511 -11.214  -4.567   1.259
   37    HA   CYS 511           HA       CYS 511  -9.589  -3.037   1.701
   38    HB2  CYS 511           2HB      CYS 511  -8.467  -4.852   3.822
   39    HB3  CYS 511           1HB      CYS 511  -8.503  -3.093   3.784
   40    H    ASN 512           H        ASN 512  -7.916  -2.696   0.396
   41    HA   ASN 512           HA       ASN 512  -6.162  -4.952  -0.230
   42    HB2  ASN 512           2HB      ASN 512  -6.473  -2.426  -1.846
   43    HB3  ASN 512           1HB      ASN 512  -5.627  -3.892  -2.315
   44   HD21  ASN 512          1HD2      ASN 512  -8.834  -2.791  -1.275
   45   HD22  ASN 512          2HD2      ASN 512  -9.717  -3.835  -2.326
   46    HA   PRO 513           HA       PRO 513  -3.049  -1.624   0.921
   47    HB2  PRO 513           2HB      PRO 513  -3.809   0.991   0.796
   48    HB3  PRO 513           1HB      PRO 513  -3.385   0.035  -0.624
   49    HG2  PRO 513           2HG      PRO 513  -5.963   1.106   0.081
   50    HG3  PRO 513           1HG      PRO 513  -5.518   0.178  -1.360
   51    HD2  PRO 513           2HD      PRO 513  -6.740  -0.755   1.180
   52    HD3  PRO 513           1HD      PRO 513  -6.887  -1.416  -0.459
   53    H    ASN 514           H        ASN 514  -5.834  -1.864   2.682
   54    HA   ASN 514           HA       ASN 514  -4.744  -0.289   4.918
   55    HB2  ASN 514           2HB      ASN 514  -7.536  -0.765   3.971
   56    HB3  ASN 514           1HB      ASN 514  -7.269  -0.608   5.704
   57   HD21  ASN 514          1HD2      ASN 514  -7.409   1.015   2.675
   58   HD22  ASN 514          2HD2      ASN 514  -7.165   2.614   3.276
   59    H    LEU 515           H        LEU 515  -3.511  -2.522   4.751
   60    HA   LEU 515           HA       LEU 515  -4.863  -4.374   6.597
   61    HB2  LEU 515           2HB      LEU 515  -2.716  -5.667   5.205
   62    HB3  LEU 515           1HB      LEU 515  -4.407  -6.104   5.286
   63    HG   LEU 515           HG       LEU 515  -3.757  -5.947   3.000
   64   HD11  LEU 515          1HD1      LEU 515  -5.774  -5.165   2.598
   65   HD12  LEU 515          2HD1      LEU 515  -5.143  -3.527   2.714
   66   HD13  LEU 515          3HD1      LEU 515  -5.794  -4.320   4.145
   67   HD21  LEU 515          3HD2      LEU 515  -2.070  -4.619   2.442
   68   HD22  LEU 515          1HD2      LEU 515  -2.242  -3.674   3.919
   69   HD23  LEU 515          2HD2      LEU 515  -3.203  -3.267   2.501
   70    H    HIS 516           H        HIS 516  -1.801  -2.902   5.659
   71    HA   HIS 516           HA       HIS 516  -0.840  -2.923   8.359
   72    HB2  HIS 516           2HB      HIS 516   1.303  -4.206   7.434
   73    HB3  HIS 516           1HB      HIS 516  -0.046  -5.071   8.161
   74    HD1  HIS 516           1HD      HIS 516   0.557  -7.193   6.721
   75    HD2  HIS 516           2HD      HIS 516  -0.477  -3.830   4.513
   76    HE1  HIS 516           1HE      HIS 516   0.158  -8.010   4.372
   77    HE2  HIS 516           2HE      HIS 516  -0.549  -5.978   3.081
   78    H    TYR 517           H        TYR 517   1.170  -3.189   5.469
   79    HA   TYR 517           HA       TYR 517   2.656  -0.925   5.984
   80    HB2  TYR 517           2HB      TYR 517   2.115  -1.683   3.141
   81    HB3  TYR 517           1HB      TYR 517   3.631  -1.203   3.894
   82    HD1  TYR 517           2HD      TYR 517   4.975  -2.852   5.138
   83    HD2  TYR 517           1HD      TYR 517   1.384  -3.966   3.161
   84    HE1  TYR 517           2HE      TYR 517   5.613  -5.222   5.318
   85    HE2  TYR 517           1HE      TYR 517   1.998  -6.328   3.330
   86    HH   TYR 517           HH       TYR 517   3.938  -7.710   3.631
   87    H    TRP 518           H        TRP 518   1.969   0.214   3.108
   88    HA   TRP 518           HA       TRP 518   0.994   2.307   2.710
   89    HB2  TRP 518           2HB      TRP 518  -1.671   1.174   2.805
   90    HB3  TRP 518           1HB      TRP 518  -0.739   1.694   1.426
   91    HD1  TRP 518           HD       TRP 518  -0.130  -1.372   3.711
   92    HE1  TRP 518           1HE      TRP 518  -0.020  -3.416   2.219
   93    HE3  TRP 518           3HE      TRP 518  -1.237   0.810  -0.772
   94    HZ2  TRP 518           2HZ      TRP 518  -0.398  -4.091  -0.499
   95    HZ3  TRP 518           3HZ      TRP 518  -1.360  -0.614  -2.772
   96    HH2  TRP 518           HH       TRP 518  -0.950  -3.016  -2.638
   97    H    THR 519           H        THR 519  -1.243   0.717   4.959
   98    HA   THR 519           HA       THR 519  -2.252   3.182   5.952
   99    HB   THR 519           HB       THR 519  -3.620   1.169   5.989
  100    HG1  THR 519           1HG      THR 519  -3.901   2.785   7.647
  101   HG21  THR 519          3HG2      THR 519  -1.873  -0.495   6.413
  102   HG22  THR 519          1HG2      THR 519  -3.231  -0.646   7.528
  103   HG23  THR 519          2HG2      THR 519  -1.726   0.101   8.067
  104    H    THR 520           H        THR 520   0.417   1.163   6.797
  105    HA   THR 520           HA       THR 520   0.718   2.281   9.440
  106    HB   THR 520           HB       THR 520   1.725   0.027   8.122
  107    HG1  THR 520           1HG      THR 520   2.502   1.046  10.641
  108   HG21  THR 520          3HG2      THR 520   3.710   0.932   7.305
  109   HG22  THR 520          1HG2      THR 520   4.156   0.173   8.832
  110   HG23  THR 520          2HG2      THR 520   3.959   1.923   8.743
  111    H    GLN 521           H        GLN 521   2.839   2.419   6.569
  112    HA   GLN 521           HA       GLN 521   3.841   4.986   7.551
  113    HB2  GLN 521           2HB      GLN 521   5.777   4.637   6.197
  114    HB3  GLN 521           1HB      GLN 521   5.454   3.134   7.046
  115    HG2  GLN 521           2HG      GLN 521   4.699   2.063   5.118
  116    HG3  GLN 521           1HG      GLN 521   4.463   3.581   4.262
  117   HE21  GLN 521          1HE2      GLN 521   6.439   4.849   3.783
  118   HE22  GLN 521          2HE2      GLN 521   7.880   3.979   3.394
  119    H    ASP 522           H        ASP 522   4.851   5.715   4.903
  120    HA   ASP 522           HA       ASP 522   2.352   6.771   3.791
  121    HB2  ASP 522           2HB      ASP 522   5.174   7.724   3.843
  122    HB3  ASP 522           1HB      ASP 522   4.103   8.273   2.560
  123    H    GLU 523           H        GLU 523   3.297   4.101   3.240
  124    HA   GLU 523           HA       GLU 523   3.761   2.663   1.518
  125    HB2  GLU 523           2HB      GLU 523   1.708   4.494   0.750
  126    HB3  GLU 523           1HB      GLU 523   2.669   4.110  -0.670
  127    HG2  GLU 523           2HG      GLU 523   2.295   1.768  -0.347
  128    HG3  GLU 523           1HG      GLU 523   1.453   2.074   1.167
  129    H    GLY 524           H        GLY 524   6.041   3.388   1.845
  130    HA2  GLY 524           2HA      GLY 524   8.026   3.549   0.587
  131    HA3  GLY 524           1HA      GLY 524   7.109   4.304  -0.711
  132    H    ALA 525           H        ALA 525   5.762   6.073   1.292
  133    HA   ALA 525           HA       ALA 525   5.998   8.216   1.965
  134    HB1  ALA 525           1HB      ALA 525   7.642   6.656   3.503
  135    HB2  ALA 525           2HB      ALA 525   7.164   8.317   3.856
  136    HB3  ALA 525           3HB      ALA 525   8.683   7.994   3.019
  137    H    ALA 526           H        ALA 526   7.479   7.289  -0.649
  138    HA   ALA 526           HA       ALA 526   8.853   8.199  -2.212
  139    HB1  ALA 526           1HB      ALA 526   6.800   9.845  -1.816
  140    HB2  ALA 526           2HB      ALA 526   8.083  10.198  -2.972
  141    HB3  ALA 526           3HB      ALA 526   8.110  10.939  -1.372
  142    H    ILE 527           H        ILE 527   9.783   8.058   0.719
  143    HA   ILE 527           HA       ILE 527  11.552  10.136   1.258
  144    HB   ILE 527           HB       ILE 527  12.863   8.178   2.447
  145   HG12  ILE 527          2HG1      ILE 527  11.520   6.280   3.022
  146   HG13  ILE 527          1HG1      ILE 527  10.120   6.951   2.197
  147   HG21  ILE 527          1HG2      ILE 527  10.397   9.633   3.143
  148   HG22  ILE 527          2HG2      ILE 527  11.979   9.642   3.921
  149   HG23  ILE 527          3HG2      ILE 527  10.865   8.305   4.205
  150   HD11  ILE 527          3HD1      ILE 527  10.917   6.397   0.119
  151   HD12  ILE 527          1HD1      ILE 527  11.529   5.064   1.099
  152   HD13  ILE 527          2HD1      ILE 527  12.600   6.392   0.648
  153    H    GLY 528           H        GLY 528  11.758   7.646  -1.104
  154    HA2  GLY 528           2HA      GLY 528  13.793   8.664  -2.575
  155    HA3  GLY 528           1HA      GLY 528  14.635   7.733  -1.347
  156    H    LEU 529           H        LEU 529  12.989   5.551  -1.085
  157    HA   LEU 529           HA       LEU 529  12.434   3.537  -1.981
  158    HB2  LEU 529           2HB      LEU 529  12.281   5.168  -4.496
  159    HB3  LEU 529           1HB      LEU 529  11.987   3.443  -4.484
  160    HG   LEU 529           HG       LEU 529  10.036   3.679  -3.160
  161   HD11  LEU 529          1HD1      LEU 529   9.339   5.990  -2.367
  162   HD12  LEU 529          2HD1      LEU 529  11.008   6.476  -2.666
  163   HD13  LEU 529          3HD1      LEU 529  10.655   5.209  -1.489
  164   HD21  LEU 529          3HD2      LEU 529  10.373   5.292  -5.552
  165   HD22  LEU 529          1HD2      LEU 529   9.069   5.876  -4.519
  166   HD23  LEU 529          2HD2      LEU 529   9.060   4.209  -5.093
  167    H    ALA 530           H        ALA 530  15.000   5.289  -3.599
  168    HA   ALA 530           HA       ALA 530  16.180   2.905  -4.635
  169    HB1  ALA 530           1HB      ALA 530  16.393   5.115  -5.747
  170    HB2  ALA 530           2HB      ALA 530  17.938   4.308  -5.475
  171    HB3  ALA 530           3HB      ALA 530  17.438   5.633  -4.424
  172    H    TRP 531           H        TRP 531  16.407   4.646  -1.688
  173    HA   TRP 531           HA       TRP 531  18.917   4.166  -0.741
  174    HB2  TRP 531           2HB      TRP 531  17.825   4.019   1.545
  175    HB3  TRP 531           1HB      TRP 531  17.412   5.440   0.596
  176    HD1  TRP 531           HD       TRP 531  15.016   4.913  -0.961
  177    HE1  TRP 531           1HE      TRP 531  12.817   4.057  -0.010
  178    HE3  TRP 531           3HE      TRP 531  16.763   2.840   3.367
  179    HZ2  TRP 531           2HZ      TRP 531  11.897   2.685   2.287
  180    HZ3  TRP 531           3HZ      TRP 531  15.152   1.777   4.895
  181    HH2  TRP 531           HH       TRP 531  12.768   1.703   4.365
  182    H    ILE 532           H        ILE 532  16.382   1.861  -1.293
  183    HA   ILE 532           HA       ILE 532  18.043  -0.248  -0.106
  184    HB   ILE 532           HB       ILE 532  16.010  -1.537   0.126
  185   HG12  ILE 532          2HG1      ILE 532  14.957   0.109  -1.793
  186   HG13  ILE 532          1HG1      ILE 532  14.045  -1.032  -0.817
  187   HG21  ILE 532          1HG2      ILE 532  16.168   1.156   1.377
  188   HG22  ILE 532          2HG2      ILE 532  16.517  -0.428   2.081
  189   HG23  ILE 532          3HG2      ILE 532  14.847   0.059   1.787
  190   HD11  ILE 532          3HD1      ILE 532  12.945   1.097  -0.824
  191   HD12  ILE 532          1HD1      ILE 532  14.417   1.896  -0.275
  192   HD13  ILE 532          2HD1      ILE 532  13.576   0.770   0.791
  193    HA   PRO 533           HA       PRO 533  18.037  -2.182  -4.097
  194    HB2  PRO 533           2HB      PRO 533  18.678  -4.686  -3.441
  195    HB3  PRO 533           1HB      PRO 533  19.767  -3.339  -3.091
  196    HG2  PRO 533           2HG      PRO 533  18.069  -4.917  -1.251
  197    HG3  PRO 533           1HG      PRO 533  19.581  -4.056  -0.928
  198    HD2  PRO 533           2HD      PRO 533  16.905  -3.167  -0.423
  199    HD3  PRO 533           1HD      PRO 533  18.417  -2.285  -0.137
  200    H    TYR 534           H        TYR 534  15.476  -2.998  -1.970
  201    HA   TYR 534           HA       TYR 534  13.970  -4.071  -4.177
  202    HB2  TYR 534           2HB      TYR 534  13.375  -6.198  -3.035
  203    HB3  TYR 534           1HB      TYR 534  15.062  -6.101  -3.529
  204    HD1  TYR 534           2HD      TYR 534  12.838  -5.628  -0.580
  205    HD2  TYR 534           1HD      TYR 534  16.757  -6.510  -1.981
  206    HE1  TYR 534           2HE      TYR 534  13.531  -6.167   1.716
  207    HE2  TYR 534           1HE      TYR 534  17.461  -7.053   0.312
  208    HH   TYR 534           HH       TYR 534  16.819  -6.620   2.586
  209    H    PHE 535           H        PHE 535  14.043  -3.079  -0.802
  210    HA   PHE 535           HA       PHE 535  11.331  -3.430  -0.198
  211    HB2  PHE 535           2HB      PHE 535  13.006  -1.117   0.791
  212    HB3  PHE 535           1HB      PHE 535  11.583  -1.796   1.555
  213    HD1  PHE 535           2HD      PHE 535  15.065  -2.631   0.602
  214    HD2  PHE 535           1HD      PHE 535  11.806  -3.397   3.210
  215    HE1  PHE 535           2HE      PHE 535  16.526  -4.011   1.991
  216    HE2  PHE 535           1HE      PHE 535  13.265  -4.788   4.621
  217    HZ   PHE 535           HZ       PHE 535  15.633  -5.092   4.010
  218    H    GLY 536           H        GLY 536  12.940  -1.074  -2.160
  219    HA2  GLY 536           2HA      GLY 536  10.406   0.410  -2.437
  220    HA3  GLY 536           1HA      GLY 536  11.997   1.126  -2.644
  221    HA   PRO 537           HA       PRO 537  12.133   0.146  -6.939
  222    HB2  PRO 537           2HB      PRO 537  14.300  -1.841  -6.780
  223    HB3  PRO 537           1HB      PRO 537  14.293  -0.249  -7.544
  224    HG2  PRO 537           2HG      PRO 537  15.678  -0.714  -5.294
  225    HG3  PRO 537           1HG      PRO 537  14.876   0.842  -5.585
  226    HD2  PRO 537           2HD      PRO 537  13.976  -1.469  -3.896
  227    HD3  PRO 537           1HD      PRO 537  13.939   0.269  -3.533
  228    H    ALA 538           H        ALA 538  12.288  -2.751  -4.943
  229    HA   ALA 538           HA       ALA 538  11.113  -4.369  -7.070
  230    HB1  ALA 538           1HB      ALA 538  11.732  -5.362  -4.311
  231    HB2  ALA 538           2HB      ALA 538  13.007  -5.138  -5.508
  232    HB3  ALA 538           3HB      ALA 538  11.683  -6.256  -5.830
  233    H    ALA 539           H        ALA 539  10.234  -2.753  -4.131
  234    HA   ALA 539           HA       ALA 539   7.888  -4.181  -3.502
  235    HB1  ALA 539           1HB      ALA 539   7.266  -1.937  -2.378
  236    HB2  ALA 539           2HB      ALA 539   8.895  -1.444  -2.843
  237    HB3  ALA 539           3HB      ALA 539   8.663  -2.836  -1.785
  238    H    GLU 540           H        GLU 540   5.894  -4.141  -4.314
  239    HA   GLU 540           HA       GLU 540   5.176  -1.999  -6.200
  240    HB2  GLU 540           2HB      GLU 540   4.330  -4.872  -6.553
  241    HB3  GLU 540           1HB      GLU 540   4.172  -3.549  -7.701
  242    HG2  GLU 540           2HG      GLU 540   6.877  -3.646  -7.227
  243    HG3  GLU 540           1HG      GLU 540   6.401  -5.344  -7.216
  244    H    GLY 541           H        GLY 541   4.251  -4.138  -3.644
  245    HA2  GLY 541           2HA      GLY 541   1.564  -2.911  -3.599
  246    HA3  GLY 541           1HA      GLY 541   1.890  -4.549  -3.048
  247    H    ILE 542           H        ILE 542   3.929  -1.766  -2.438
  248    HA   ILE 542           HA       ILE 542   2.987  -1.551   0.311
  249    HB   ILE 542           HB       ILE 542   5.936  -1.807  -0.048
  250   HG12  ILE 542          2HG1      ILE 542   5.598  -4.280   0.624
  251   HG13  ILE 542          1HG1      ILE 542   3.973  -4.083  -0.031
  252   HG21  ILE 542          1HG2      ILE 542   5.944  -1.754   2.176
  253   HG22  ILE 542          2HG2      ILE 542   4.730  -3.027   2.281
  254   HG23  ILE 542          3HG2      ILE 542   4.231  -1.348   2.086
  255   HD11  ILE 542          3HD1      ILE 542   5.526  -3.043  -2.026
  256   HD12  ILE 542          1HD1      ILE 542   4.900  -4.695  -1.967
  257   HD13  ILE 542          2HD1      ILE 542   6.534  -4.353  -1.403
  258    H    TYR 543           H        TYR 543   4.864  -0.369  -2.382
  259    HA   TYR 543           HA       TYR 543   5.302   2.156  -1.029
  260    HB2  TYR 543           2HB      TYR 543   7.207   2.320  -2.231
  261    HB3  TYR 543           1HB      TYR 543   7.015   0.588  -2.397
  262    HD1  TYR 543           1HD      TYR 543   5.798  -0.270  -4.478
  263    HD2  TYR 543           2HD      TYR 543   7.320   3.684  -4.116
  264    HE1  TYR 543           1HE      TYR 543   5.754  -0.034  -6.922
  265    HE2  TYR 543           2HE      TYR 543   7.281   3.934  -6.556
  266    HH   TYR 543           HH       TYR 543   7.343   2.431  -8.566
  267    H    ILE 544           H        ILE 544   4.002   0.764  -4.005
  268    HA   ILE 544           HA       ILE 544   2.837   1.690  -5.763
  269    HB   ILE 544           HB       ILE 544   1.106   2.687  -3.512
  270   HG12  ILE 544          2HG1      ILE 544   0.012   0.465  -3.609
  271   HG13  ILE 544          1HG1      ILE 544   1.284  -0.091  -4.692
  272   HG21  ILE 544          1HG2      ILE 544   0.791   2.331  -6.401
  273   HG22  ILE 544          2HG2      ILE 544  -0.077   3.383  -5.284
  274   HG23  ILE 544          3HG2      ILE 544  -0.534   1.687  -5.432
  275   HD11  ILE 544          3HD1      ILE 544   1.290  -0.446  -2.027
  276   HD12  ILE 544          1HD1      ILE 544   2.204   1.055  -2.155
  277   HD13  ILE 544          2HD1      ILE 544   2.744  -0.380  -3.021
  278    H    GLU 545           H        GLU 545   2.254   4.124  -3.275
  279    HA   GLU 545           HA       GLU 545   2.576   6.369  -3.203
  280    HB2  GLU 545           2HB      GLU 545   4.205   6.148  -5.719
  281    HB3  GLU 545           1HB      GLU 545   4.323   7.359  -4.446
  282    HG2  GLU 545           2HG      GLU 545   4.994   5.476  -2.904
  283    HG3  GLU 545           1HG      GLU 545   5.156   4.476  -4.344
  284    H    GLY 546           H        GLY 546   0.373   5.162  -4.546
  285    HA2  GLY 546           2HA      GLY 546  -0.372   7.426  -6.263
  286    HA3  GLY 546           1HA      GLY 546  -0.625   5.791  -6.851
  287    H    LEU 547           H        LEU 547  -1.140   5.517  -3.629
  288    HA   LEU 547           HA       LEU 547  -3.907   6.496  -3.704
  289    HB2  LEU 547           2HB      LEU 547  -4.876   4.422  -3.149
  290    HB3  LEU 547           1HB      LEU 547  -3.841   4.148  -4.536
  291    HG   LEU 547           HG       LEU 547  -2.886   3.579  -1.746
  292   HD11  LEU 547          1HD1      LEU 547  -4.530   1.818  -3.545
  293   HD12  LEU 547          2HD1      LEU 547  -4.866   2.290  -1.880
  294   HD13  LEU 547          3HD1      LEU 547  -3.528   1.196  -2.234
  295   HD21  LEU 547          3HD2      LEU 547  -1.563   1.862  -3.114
  296   HD22  LEU 547          1HD2      LEU 547  -1.102   3.559  -3.251
  297   HD23  LEU 547          2HD2      LEU 547  -2.061   2.799  -4.522
  298    H    MET 548           H        MET 548  -1.105   6.178  -1.986
  299    HA   MET 548           HA       MET 548  -2.188   5.772   0.621
  300    HB2  MET 548           2HB      MET 548   0.197   6.823   1.216
  301    HB3  MET 548           1HB      MET 548  -0.015   5.149   0.745
  302    HG2  MET 548           2HG      MET 548   1.870   6.061  -0.407
  303    HG3  MET 548           1HG      MET 548   0.589   5.763  -1.577
  304    HE1  MET 548           3HE      MET 548  -0.599   8.537  -2.978
  305    HE2  MET 548           1HE      MET 548   0.151   6.955  -3.173
  306    HE3  MET 548           2HE      MET 548   1.037   8.411  -3.623
  307    H    HIS 549           H        HIS 549  -3.874   7.418   0.391
  308    HA   HIS 549           HA       HIS 549  -2.887   9.997   1.390
  309    HB2  HIS 549           2HB      HIS 549  -5.366  10.257  -0.132
  310    HB3  HIS 549           1HB      HIS 549  -3.903  11.228  -0.196
  311    HD1  HIS 549           1HD      HIS 549  -5.870   9.614  -2.454
  312    HD2  HIS 549           2HD      HIS 549  -1.822   9.252  -1.592
  313    HE1  HIS 549           1HE      HIS 549  -4.831   8.625  -4.517
  314    HE2  HIS 549           2HE      HIS 549  -2.366   8.501  -4.007
  315    H    ASN 550           H        ASN 550  -3.974   7.580   2.675
  316    HA   ASN 550           HA       ASN 550  -5.400   7.014   4.351
  317    HB2  ASN 550           2HB      ASN 550  -4.872   9.793   4.652
  318    HB3  ASN 550           1HB      ASN 550  -6.576   9.536   5.013
  319   HD21  ASN 550          1HD2      ASN 550  -7.110   8.764   6.943
  320   HD22  ASN 550          2HD2      ASN 550  -6.003   8.132   8.109
  321    H    GLN 551           H        GLN 551  -6.989   5.849   3.424
  322    HA   GLN 551           HA       GLN 551  -9.421   7.295   2.665
  323    HB2  GLN 551           2HB      GLN 551  -9.186   4.880   1.113
  324    HB3  GLN 551           1HB      GLN 551  -9.447   6.527   0.568
  325    HG2  GLN 551           2HG      GLN 551  -7.459   6.416  -0.398
  326    HG3  GLN 551           1HG      GLN 551  -6.744   6.440   1.210
  327   HE21  GLN 551          1HE2      GLN 551  -6.638   4.259   2.283
  328   HE22  GLN 551          2HE2      GLN 551  -6.170   2.922   1.298
  329    H    ASP 552           H        ASP 552  -8.555   3.892   2.670
  330    HA   ASP 552           HA       ASP 552  -9.424   2.077   3.725
  331    HB2  ASP 552           2HB      ASP 552  -8.609   3.432   5.717
  332    HB3  ASP 552           1HB      ASP 552 -10.277   3.957   5.927
  333    H    GLY 553           H        GLY 553 -11.173   4.007   2.113
  334    HA2  GLY 553           2HA      GLY 553 -13.753   2.867   2.992
  335    HA3  GLY 553           1HA      GLY 553 -13.620   4.512   2.382
  336    H    LEU 554           H        LEU 554 -11.706   3.875   0.347
  337    HA   LEU 554           HA       LEU 554 -13.520   2.854  -1.679
  338    HB2  LEU 554           2HB      LEU 554 -11.732   3.578  -3.234
  339    HB3  LEU 554           1HB      LEU 554 -12.329   4.863  -2.203
  340    HG   LEU 554           HG       LEU 554 -10.176   3.892  -0.770
  341   HD11  LEU 554          1HD1      LEU 554  -9.744   2.635  -3.037
  342   HD12  LEU 554          2HD1      LEU 554  -8.421   3.354  -2.118
  343   HD13  LEU 554          3HD1      LEU 554  -9.086   4.199  -3.516
  344   HD21  LEU 554          3HD2      LEU 554 -10.863   6.248  -1.198
  345   HD22  LEU 554          1HD2      LEU 554 -10.096   6.133  -2.782
  346   HD23  LEU 554          2HD2      LEU 554  -9.126   5.969  -1.318
  347    H    ILE 555           H        ILE 555 -11.618   1.364   0.431
  348    HA   ILE 555           HA       ILE 555 -11.054  -0.858  -1.371
  349    HB   ILE 555           HB       ILE 555  -8.810  -1.161  -0.318
  350   HG12  ILE 555          2HG1      ILE 555  -9.177   0.247   1.676
  351   HG13  ILE 555          1HG1      ILE 555  -7.746   0.728   0.790
  352   HG21  ILE 555          1HG2      ILE 555  -7.845  -0.099  -2.029
  353   HG22  ILE 555          2HG2      ILE 555  -8.538   1.463  -1.581
  354   HG23  ILE 555          3HG2      ILE 555  -9.502   0.298  -2.491
  355   HD11  ILE 555          3HD1      ILE 555 -10.167   2.222   1.363
  356   HD12  ILE 555          1HD1      ILE 555  -9.627   2.334  -0.310
  357   HD13  ILE 555          2HD1      ILE 555  -8.537   2.783   0.999
  358    H    CYS 556           H        CYS 556 -11.057   0.374   1.945
  359    HA   CYS 556           HA       CYS 556 -11.587  -2.341   2.897
  360    HB2  CYS 556           2HB      CYS 556  -9.618  -0.897   3.770
  361    HB3  CYS 556           1HB      CYS 556 -10.855  -0.025   4.666
  362    H    GLY 557           H        GLY 557 -13.743  -2.631   2.818
  363    HA2  GLY 557           2HA      GLY 557 -15.364  -0.951   4.570
  364    HA3  GLY 557           1HA      GLY 557 -15.858  -1.044   2.887
  365    H    LEU 558           H        LEU 558 -15.943  -3.421   2.065
  366    HA   LEU 558           HA       LEU 558 -16.961  -5.202   4.147
  367    HB2  LEU 558           2HB      LEU 558 -18.952  -5.740   2.876
  368    HB3  LEU 558           1HB      LEU 558 -18.910  -4.030   3.254
  369    HG   LEU 558           HG       LEU 558 -18.150  -5.198   0.574
  370   HD11  LEU 558          1HD1      LEU 558 -20.596  -3.574   0.928
  371   HD12  LEU 558          2HD1      LEU 558 -20.644  -5.238   1.514
  372   HD13  LEU 558          3HD1      LEU 558 -20.266  -4.908  -0.177
  373   HD21  LEU 558          3HD2      LEU 558 -17.191  -3.198   0.320
  374   HD22  LEU 558          1HD2      LEU 558 -17.953  -2.547   1.770
  375   HD23  LEU 558          2HD2      LEU 558 -18.831  -2.559   0.241
  376    H    ARG 559           H        ARG 559 -16.214  -4.887   0.674
  377    HA   ARG 559           HA       ARG 559 -14.352  -6.949   0.610
  378    HB2  ARG 559           2HB      ARG 559 -15.558  -8.785  -0.406
  379    HB3  ARG 559           1HB      ARG 559 -16.310  -8.386   1.133
  380    HG2  ARG 559           2HG      ARG 559 -17.466  -6.917  -1.087
  381    HG3  ARG 559           1HG      ARG 559 -17.595  -8.669  -1.285
  382    HD2  ARG 559           2HD      ARG 559 -18.245  -8.115   1.398
  383    HD3  ARG 559           1HD      ARG 559 -19.090  -6.914   0.423
  384    HE   ARG 559           HE       ARG 559 -19.639  -9.207  -0.872
  385   HH11  ARG 559          1HH1      ARG 559 -19.889  -8.293   2.488
  386   HH12  ARG 559          2HH1      ARG 559 -21.224  -9.350   2.804
  387   HH21  ARG 559          1HH2      ARG 559 -21.395 -10.595  -0.457
  388   HH22  ARG 559          2HH2      ARG 559 -22.079 -10.655   1.132
  389    H    GLN 560           H        GLN 560 -14.723  -4.413  -0.503
  390    HA   GLN 560           HA       GLN 560 -15.049  -4.931  -3.369
  391    HB2  GLN 560           2HB      GLN 560 -15.396  -2.622  -3.681
  392    HB3  GLN 560           1HB      GLN 560 -16.276  -3.028  -2.216
  393    HG2  GLN 560           2HG      GLN 560 -13.615  -2.238  -1.531
  394    HG3  GLN 560           1HG      GLN 560 -14.339  -1.025  -2.585
  395   HE21  GLN 560          1HE2      GLN 560 -14.698  -2.784   0.419
  396   HE22  GLN 560          2HE2      GLN 560 -15.762  -1.654   1.174
  Start of MODEL    6
    1    H1   ALA 507           1HT      ALA 507  -9.991 -10.653  -7.291
    2    H2   ALA 507           2HT      ALA 507  -9.828 -12.312  -6.882
    3    H3   ALA 507           3HT      ALA 507 -10.209 -11.159  -5.668
    4    HA   ALA 507           HA       ALA 507 -11.933 -11.575  -7.993
    5    HB1  ALA 507           1HB      ALA 507 -13.223 -12.967  -6.117
    6    HB2  ALA 507           2HB      ALA 507 -11.564 -13.314  -5.629
    7    HB3  ALA 507           3HB      ALA 507 -12.104 -13.712  -7.259
    8    H    GLN 508           H        GLN 508 -11.806 -11.006  -4.472
    9    HA   GLN 508           HA       GLN 508 -12.991  -8.458  -4.609
   10    HB2  GLN 508           2HB      GLN 508 -15.188  -9.088  -3.510
   11    HB3  GLN 508           1HB      GLN 508 -15.042  -9.478  -5.218
   12    HG2  GLN 508           2HG      GLN 508 -15.798 -11.486  -4.619
   13    HG3  GLN 508           1HG      GLN 508 -14.150 -11.770  -4.062
   14   HE21  GLN 508          1HE2      GLN 508 -17.354 -10.733  -3.055
   15   HE22  GLN 508          2HE2      GLN 508 -17.177 -11.173  -1.394
   16    HA   PRO 509           HA       PRO 509 -11.076  -9.979  -0.575
   17    HB2  PRO 509           2HB      PRO 509  -8.854  -8.431  -0.639
   18    HB3  PRO 509           1HB      PRO 509  -8.922 -10.032  -1.383
   19    HG2  PRO 509           2HG      PRO 509  -9.201  -7.339  -2.659
   20    HG3  PRO 509           1HG      PRO 509  -8.292  -8.753  -3.221
   21    HD2  PRO 509           2HD      PRO 509 -10.734  -8.095  -4.202
   22    HD3  PRO 509           1HD      PRO 509 -10.170  -9.774  -4.081
   23    H    LYS 510           H        LYS 510 -10.571  -8.630   1.335
   24    HA   LYS 510           HA       LYS 510 -12.025  -6.073   1.217
   25    HB2  LYS 510           2HB      LYS 510 -11.738  -8.129   3.393
   26    HB3  LYS 510           1HB      LYS 510 -12.222  -6.480   3.759
   27    HG2  LYS 510           2HG      LYS 510 -14.230  -6.682   2.588
   28    HG3  LYS 510           1HG      LYS 510 -13.679  -8.111   1.713
   29    HD2  LYS 510           2HD      LYS 510 -13.492  -8.985   4.267
   30    HD3  LYS 510           1HD      LYS 510 -14.851  -7.867   4.405
   31    HE2  LYS 510           2HE      LYS 510 -15.121  -9.475   2.037
   32    HE3  LYS 510           1HE      LYS 510 -14.884 -10.507   3.446
   33    HZ1  LYS 510           3HZ      LYS 510 -16.951  -8.392   3.166
   34    HZ2  LYS 510           1HZ      LYS 510 -16.714  -9.350   4.541
   35    HZ3  LYS 510           2HZ      LYS 510 -17.219 -10.060   3.091
   36    H    CYS 511           H        CYS 511 -10.921  -4.264   1.589
   37    HA   CYS 511           HA       CYS 511  -9.251  -2.829   2.162
   38    HB2  CYS 511           2HB      CYS 511  -9.637  -4.537   4.398
   39    HB3  CYS 511           1HB      CYS 511  -7.902  -4.296   4.222
   40    H    ASN 512           H        ASN 512  -7.702  -2.629   0.685
   41    HA   ASN 512           HA       ASN 512  -5.819  -4.839   0.308
   42    HB2  ASN 512           2HB      ASN 512  -6.242  -2.503  -1.553
   43    HB3  ASN 512           1HB      ASN 512  -5.325  -3.966  -1.873
   44   HD21  ASN 512          1HD2      ASN 512  -8.587  -2.911  -0.968
   45   HD22  ASN 512          2HD2      ASN 512  -9.414  -4.099  -1.904
   46    HA   PRO 513           HA       PRO 513  -2.900  -1.247   1.169
   47    HB2  PRO 513           2HB      PRO 513  -3.776   1.289   0.775
   48    HB3  PRO 513           1HB      PRO 513  -3.305   0.219  -0.549
   49    HG2  PRO 513           2HG      PRO 513  -5.939   1.227   0.064
   50    HG3  PRO 513           1HG      PRO 513  -5.444   0.207  -1.295
   51    HD2  PRO 513           2HD      PRO 513  -6.634  -0.571   1.309
   52    HD3  PRO 513           1HD      PRO 513  -6.725  -1.381  -0.267
   53    H    ASN 514           H        ASN 514  -5.512  -1.658   2.993
   54    HA   ASN 514           HA       ASN 514  -4.622   0.266   5.033
   55    HB2  ASN 514           2HB      ASN 514  -7.365  -0.352   4.049
   56    HB3  ASN 514           1HB      ASN 514  -7.172  -0.059   5.775
   57   HD21  ASN 514          1HD2      ASN 514  -7.260   1.328   2.638
   58   HD22  ASN 514          2HD2      ASN 514  -7.056   2.973   3.116
   59    H    LEU 515           H        LEU 515  -3.323  -1.918   5.142
   60    HA   LEU 515           HA       LEU 515  -4.682  -3.646   7.100
   61    HB2  LEU 515           2HB      LEU 515  -2.325  -4.784   5.783
   62    HB3  LEU 515           1HB      LEU 515  -3.879  -5.510   6.129
   63    HG   LEU 515           HG       LEU 515  -3.561  -5.549   3.772
   64   HD11  LEU 515          1HD1      LEU 515  -5.746  -5.174   3.716
   65   HD12  LEU 515          2HD1      LEU 515  -5.353  -3.513   3.282
   66   HD13  LEU 515          3HD1      LEU 515  -5.651  -3.938   4.966
   67   HD21  LEU 515          3HD2      LEU 515  -2.143  -3.169   4.174
   68   HD22  LEU 515          1HD2      LEU 515  -3.510  -2.745   3.141
   69   HD23  LEU 515          2HD2      LEU 515  -2.397  -4.026   2.654
   70    H    HIS 516           H        HIS 516  -1.434  -2.567   6.079
   71    HA   HIS 516           HA       HIS 516  -0.702  -1.648   8.634
   72    HB2  HIS 516           2HB      HIS 516   0.517  -3.352   9.586
   73    HB3  HIS 516           1HB      HIS 516  -0.765  -4.274   8.803
   74    HD1  HIS 516           1HD      HIS 516  -0.124  -5.683   6.750
   75    HD2  HIS 516           2HD      HIS 516   3.026  -3.568   8.419
   76    HE1  HIS 516           1HE      HIS 516   1.925  -6.505   5.565
   77    HE2  HIS 516           2HE      HIS 516   3.831  -5.192   6.564
   78    H    TYR 517           H        TYR 517   0.790  -3.307   5.839
   79    HA   TYR 517           HA       TYR 517   3.207  -1.959   5.793
   80    HB2  TYR 517           2HB      TYR 517   2.340  -2.328   3.073
   81    HB3  TYR 517           1HB      TYR 517   3.636  -3.123   3.938
   82    HD1  TYR 517           2HD      TYR 517  -0.112  -3.422   4.321
   83    HD2  TYR 517           1HD      TYR 517   3.569  -5.320   3.330
   84    HE1  TYR 517           2HE      TYR 517  -1.286  -5.559   4.072
   85    HE2  TYR 517           1HE      TYR 517   2.393  -7.460   3.059
   86    HH   TYR 517           HH       TYR 517  -0.390  -7.972   2.475
   87    H    TRP 518           H        TRP 518   0.174  -0.608   5.259
   88    HA   TRP 518           HA       TRP 518   1.375   1.666   3.837
   89    HB2  TRP 518           2HB      TRP 518  -1.546   1.021   3.662
   90    HB3  TRP 518           1HB      TRP 518  -0.538   1.856   2.505
   91    HD1  TRP 518           HD       TRP 518   0.016  -1.697   3.895
   92    HE1  TRP 518           1HE      TRP 518   0.081  -3.304   1.947
   93    HE3  TRP 518           3HE      TRP 518  -1.101   1.568   0.135
   94    HZ2  TRP 518           2HZ      TRP 518  -0.326  -3.258  -0.851
   95    HZ3  TRP 518           3HZ      TRP 518  -1.257   0.697  -2.161
   96    HH2  TRP 518           HH       TRP 518  -0.874  -1.668  -2.645
   97    H    THR 519           H        THR 519  -1.233   0.635   5.945
   98    HA   THR 519           HA       THR 519  -2.011   3.153   6.894
   99    HB   THR 519           HB       THR 519  -3.315   1.059   7.170
  100    HG1  THR 519           1HG      THR 519  -3.987   1.539   9.313
  101   HG21  THR 519          3HG2      THR 519  -0.955   0.199   8.569
  102   HG22  THR 519          1HG2      THR 519  -2.357  -0.733   8.042
  103   HG23  THR 519          2HG2      THR 519  -2.382   0.084   9.604
  104    H    THR 520           H        THR 520   0.721   1.199   7.683
  105    HA   THR 520           HA       THR 520   1.207   2.533  10.202
  106    HB   THR 520           HB       THR 520   1.835   0.058   9.382
  107    HG1  THR 520           1HG      THR 520   2.016   0.739  11.498
  108   HG21  THR 520          3HG2      THR 520   4.366   1.621   8.912
  109   HG22  THR 520          1HG2      THR 520   3.515   0.590   7.761
  110   HG23  THR 520          2HG2      THR 520   4.293  -0.121   9.173
  111    H    GLN 521           H        GLN 521   2.992   2.277   7.123
  112    HA   GLN 521           HA       GLN 521   4.436   4.702   7.871
  113    HB2  GLN 521           2HB      GLN 521   6.135   4.066   6.376
  114    HB3  GLN 521           1HB      GLN 521   5.648   2.580   7.179
  115    HG2  GLN 521           2HG      GLN 521   4.636   1.735   5.284
  116    HG3  GLN 521           1HG      GLN 521   4.468   3.321   4.546
  117   HE21  GLN 521          1HE2      GLN 521   6.617   4.442   4.075
  118   HE22  GLN 521          2HE2      GLN 521   7.861   3.445   3.409
  119    H    ASP 522           H        ASP 522   5.202   5.451   5.275
  120    HA   ASP 522           HA       ASP 522   2.704   6.682   4.375
  121    HB2  ASP 522           2HB      ASP 522   5.559   7.500   4.318
  122    HB3  ASP 522           1HB      ASP 522   4.465   8.154   3.106
  123    H    GLU 523           H        GLU 523   3.454   4.013   3.614
  124    HA   GLU 523           HA       GLU 523   3.752   2.652   1.794
  125    HB2  GLU 523           2HB      GLU 523   2.068   4.902   0.719
  126    HB3  GLU 523           1HB      GLU 523   2.416   3.447  -0.212
  127    HG2  GLU 523           2HG      GLU 523   0.565   2.657   0.740
  128    HG3  GLU 523           1HG      GLU 523   1.621   2.389   2.127
  129    H    GLY 524           H        GLY 524   6.015   3.155   1.898
  130    HA2  GLY 524           2HA      GLY 524   7.896   3.302   0.477
  131    HA3  GLY 524           1HA      GLY 524   6.942   4.280  -0.634
  132    H    ALA 525           H        ALA 525   5.909   5.886   1.655
  133    HA   ALA 525           HA       ALA 525   6.370   7.912   2.543
  134    HB1  ALA 525           1HB      ALA 525   7.602   7.631   4.363
  135    HB2  ALA 525           2HB      ALA 525   9.067   7.420   3.402
  136    HB3  ALA 525           3HB      ALA 525   8.021   6.039   3.731
  137    H    ALA 526           H        ALA 526   7.660   7.173  -0.253
  138    HA   ALA 526           HA       ALA 526   9.027   8.172  -1.771
  139    HB1  ALA 526           1HB      ALA 526   8.357  10.288  -2.262
  140    HB2  ALA 526           2HB      ALA 526   8.507  10.837  -0.592
  141    HB3  ALA 526           3HB      ALA 526   7.106   9.885  -1.086
  142    H    ILE 527           H        ILE 527  10.060   7.628   1.077
  143    HA   ILE 527           HA       ILE 527  11.959   9.511   1.805
  144    HB   ILE 527           HB       ILE 527  13.230   7.299   2.585
  145   HG12  ILE 527          2HG1      ILE 527  11.733   5.478   3.055
  146   HG13  ILE 527          1HG1      ILE 527  10.362   6.374   2.414
  147   HG21  ILE 527          1HG2      ILE 527  12.631   8.602   4.323
  148   HG22  ILE 527          2HG2      ILE 527  11.393   7.362   4.523
  149   HG23  ILE 527          3HG2      ILE 527  11.005   8.872   3.697
  150   HD11  ILE 527          3HD1      ILE 527  11.009   6.043   0.227
  151   HD12  ILE 527          1HD1      ILE 527  11.476   4.525   0.994
  152   HD13  ILE 527          2HD1      ILE 527  12.693   5.757   0.664
  153    H    GLY 528           H        GLY 528  11.970   7.347  -0.881
  154    HA2  GLY 528           2HA      GLY 528  13.902   8.490  -2.359
  155    HA3  GLY 528           1HA      GLY 528  14.847   7.502  -1.259
  156    H    LEU 529           H        LEU 529  13.030   5.315  -1.114
  157    HA   LEU 529           HA       LEU 529  12.462   3.380  -2.150
  158    HB2  LEU 529           2HB      LEU 529  12.441   5.182  -4.546
  159    HB3  LEU 529           1HB      LEU 529  12.129   3.465  -4.681
  160    HG   LEU 529           HG       LEU 529  10.138   3.624  -3.392
  161   HD11  LEU 529          1HD1      LEU 529  11.185   6.325  -2.646
  162   HD12  LEU 529          2HD1      LEU 529  10.608   5.023  -1.605
  163   HD13  LEU 529          3HD1      LEU 529   9.460   5.970  -2.552
  164   HD21  LEU 529          3HD2      LEU 529   9.058   5.731  -4.615
  165   HD22  LEU 529          1HD2      LEU 529   9.430   4.228  -5.459
  166   HD23  LEU 529          2HD2      LEU 529  10.539   5.595  -5.563
  167    H    ALA 530           H        ALA 530  15.111   5.122  -3.674
  168    HA   ALA 530           HA       ALA 530  16.257   2.715  -4.707
  169    HB1  ALA 530           1HB      ALA 530  17.622   5.385  -4.448
  170    HB2  ALA 530           2HB      ALA 530  16.528   4.967  -5.767
  171    HB3  ALA 530           3HB      ALA 530  18.029   4.067  -5.548
  172    H    TRP 531           H        TRP 531  16.504   4.481  -1.769
  173    HA   TRP 531           HA       TRP 531  18.968   3.941  -0.759
  174    HB2  TRP 531           2HB      TRP 531  17.838   3.833   1.499
  175    HB3  TRP 531           1HB      TRP 531  17.427   5.239   0.528
  176    HD1  TRP 531           HD       TRP 531  15.087   4.575  -1.111
  177    HE1  TRP 531           1HE      TRP 531  12.871   3.748  -0.177
  178    HE3  TRP 531           3HE      TRP 531  16.723   2.800   3.387
  179    HZ2  TRP 531           2HZ      TRP 531  11.894   2.513   2.172
  180    HZ3  TRP 531           3HZ      TRP 531  15.077   1.812   4.930
  181    HH2  TRP 531           HH       TRP 531  12.713   1.673   4.333
  182    H    ILE 532           H        ILE 532  16.401   1.654  -1.329
  183    HA   ILE 532           HA       ILE 532  18.003  -0.446  -0.055
  184    HB   ILE 532           HB       ILE 532  15.944  -1.717   0.128
  185   HG12  ILE 532          2HG1      ILE 532  14.968  -0.279  -1.916
  186   HG13  ILE 532          1HG1      ILE 532  13.939  -1.130  -0.770
  187   HG21  ILE 532          1HG2      ILE 532  16.094   1.031   1.280
  188   HG22  ILE 532          2HG2      ILE 532  16.386  -0.525   2.063
  189   HG23  ILE 532          3HG2      ILE 532  14.738  -0.026   1.680
  190   HD11  ILE 532          3HD1      ILE 532  13.315   0.809   0.304
  191   HD12  ILE 532          1HD1      ILE 532  13.417   1.318  -1.383
  192   HD13  ILE 532          2HD1      ILE 532  14.728   1.695  -0.266
  193    HA   PRO 533           HA       PRO 533  18.543  -2.549  -3.852
  194    HB2  PRO 533           2HB      PRO 533  17.928  -5.151  -2.716
  195    HB3  PRO 533           1HB      PRO 533  19.494  -4.472  -3.157
  196    HG2  PRO 533           2HG      PRO 533  18.746  -4.926  -0.586
  197    HG3  PRO 533           1HG      PRO 533  19.872  -3.641  -1.057
  198    HD2  PRO 533           2HD      PRO 533  16.951  -3.463  -0.415
  199    HD3  PRO 533           1HD      PRO 533  18.277  -2.374   0.050
  200    H    TYR 534           H        TYR 534  15.651  -3.765  -2.130
  201    HA   TYR 534           HA       TYR 534  14.138  -3.557  -4.589
  202    HB2  TYR 534           2HB      TYR 534  13.376  -5.956  -4.455
  203    HB3  TYR 534           1HB      TYR 534  15.039  -5.717  -4.980
  204    HD1  TYR 534           1HD      TYR 534  12.982  -6.545  -1.992
  205    HD2  TYR 534           2HD      TYR 534  16.792  -6.795  -3.868
  206    HE1  TYR 534           1HE      TYR 534  13.751  -8.060  -0.214
  207    HE2  TYR 534           2HE      TYR 534  17.572  -8.311  -2.096
  208    HH   TYR 534           HH       TYR 534  16.528  -9.911  -0.449
  209    H    PHE 535           H        PHE 535  14.188  -3.057  -1.379
  210    HA   PHE 535           HA       PHE 535  11.611  -4.052  -0.625
  211    HB2  PHE 535           2HB      PHE 535  12.874  -1.724   0.769
  212    HB3  PHE 535           1HB      PHE 535  11.955  -3.059   1.441
  213    HD1  PHE 535           2HD      PHE 535  13.647  -5.204  -0.097
  214    HD2  PHE 535           1HD      PHE 535  14.613  -1.890   2.389
  215    HE1  PHE 535           2HE      PHE 535  15.754  -6.302   0.544
  216    HE2  PHE 535           1HE      PHE 535  16.720  -2.976   3.030
  217    HZ   PHE 535           HZ       PHE 535  17.295  -5.189   2.110
  218    H    GLY 536           H        GLY 536  12.812  -1.206  -2.164
  219    HA2  GLY 536           2HA      GLY 536  10.168   0.068  -1.973
  220    HA3  GLY 536           1HA      GLY 536  11.673   0.915  -2.293
  221    HA   PRO 537           HA       PRO 537  11.311   0.469  -6.672
  222    HB2  PRO 537           2HB      PRO 537  13.487  -1.502  -6.985
  223    HB3  PRO 537           1HB      PRO 537  13.365   0.144  -7.612
  224    HG2  PRO 537           2HG      PRO 537  15.044  -0.459  -5.616
  225    HG3  PRO 537           1HG      PRO 537  14.180   1.090  -5.662
  226    HD2  PRO 537           2HD      PRO 537  13.578  -1.369  -4.057
  227    HD3  PRO 537           1HD      PRO 537  13.530   0.334  -3.561
  228    H    ALA 538           H        ALA 538  11.897  -2.681  -5.167
  229    HA   ALA 538           HA       ALA 538  10.305  -4.015  -7.216
  230    HB1  ALA 538           1HB      ALA 538  11.374  -5.921  -6.668
  231    HB2  ALA 538           2HB      ALA 538  11.318  -5.582  -4.938
  232    HB3  ALA 538           3HB      ALA 538  12.545  -4.815  -5.948
  233    H    ALA 539           H        ALA 539   9.736  -2.439  -4.342
  234    HA   ALA 539           HA       ALA 539   8.027  -4.028  -2.876
  235    HB1  ALA 539           1HB      ALA 539   8.786  -1.365  -2.855
  236    HB2  ALA 539           2HB      ALA 539   7.729  -2.164  -1.691
  237    HB3  ALA 539           3HB      ALA 539   7.036  -1.308  -3.068
  238    H    GLU 540           H        GLU 540   6.801  -1.515  -5.071
  239    HA   GLU 540           HA       GLU 540   5.083  -1.459  -6.540
  240    HB2  GLU 540           2HB      GLU 540   4.962  -4.450  -6.271
  241    HB3  GLU 540           1HB      GLU 540   4.324  -3.477  -7.586
  242    HG2  GLU 540           2HG      GLU 540   7.236  -3.404  -6.950
  243    HG3  GLU 540           1HG      GLU 540   6.565  -4.745  -7.875
  244    H    GLY 541           H        GLY 541   4.448  -3.824  -3.951
  245    HA2  GLY 541           2HA      GLY 541   1.699  -2.773  -3.806
  246    HA3  GLY 541           1HA      GLY 541   2.195  -4.365  -3.255
  247    H    ILE 542           H        ILE 542   4.058  -1.492  -2.571
  248    HA   ILE 542           HA       ILE 542   2.956  -1.298   0.122
  249    HB   ILE 542           HB       ILE 542   5.926  -1.413  -0.063
  250   HG12  ILE 542          2HG1      ILE 542   5.698  -3.909   0.555
  251   HG13  ILE 542          1HG1      ILE 542   4.096  -3.801  -0.168
  252   HG21  ILE 542          1HG2      ILE 542   4.429  -2.662   2.146
  253   HG22  ILE 542          2HG2      ILE 542   4.227  -0.920   1.962
  254   HG23  ILE 542          3HG2      ILE 542   5.837  -1.603   2.182
  255   HD11  ILE 542          3HD1      ILE 542   6.727  -3.903  -1.426
  256   HD12  ILE 542          1HD1      ILE 542   5.649  -2.680  -2.102
  257   HD13  ILE 542          2HD1      ILE 542   5.147  -4.372  -2.053
  258    H    TYR 543           H        TYR 543   5.061  -0.105  -2.412
  259    HA   TYR 543           HA       TYR 543   5.304   2.473  -1.121
  260    HB2  TYR 543           2HB      TYR 543   7.208   2.690  -2.322
  261    HB3  TYR 543           1HB      TYR 543   7.072   0.952  -2.487
  262    HD1  TYR 543           2HD      TYR 543   5.839   0.073  -4.554
  263    HD2  TYR 543           1HD      TYR 543   7.331   4.038  -4.225
  264    HE1  TYR 543           2HE      TYR 543   5.797   0.284  -6.997
  265    HE2  TYR 543           1HE      TYR 543   7.297   4.264  -6.669
  266    HH   TYR 543           HH       TYR 543   5.729   1.994  -8.704
  267    H    ILE 544           H        ILE 544   4.035   0.984  -4.055
  268    HA   ILE 544           HA       ILE 544   2.783   1.790  -5.795
  269    HB   ILE 544           HB       ILE 544   1.121   2.870  -3.525
  270   HG12  ILE 544          2HG1      ILE 544   0.045   0.576  -3.613
  271   HG13  ILE 544          1HG1      ILE 544   1.431   0.051  -4.561
  272   HG21  ILE 544          1HG2      ILE 544  -0.703   2.017  -5.148
  273   HG22  ILE 544          2HG2      ILE 544   0.579   2.083  -6.359
  274   HG23  ILE 544          3HG2      ILE 544   0.106   3.546  -5.494
  275   HD11  ILE 544          3HD1      ILE 544   1.933   1.380  -1.956
  276   HD12  ILE 544          1HD1      ILE 544   2.842   0.116  -2.779
  277   HD13  ILE 544          2HD1      ILE 544   1.337  -0.279  -1.959
  278    H    GLU 545           H        GLU 545   2.229   4.363  -3.444
  279    HA   GLU 545           HA       GLU 545   2.454   6.617  -3.538
  280    HB2  GLU 545           2HB      GLU 545   4.310   6.190  -5.872
  281    HB3  GLU 545           1HB      GLU 545   4.274   7.552  -4.755
  282    HG2  GLU 545           2HG      GLU 545   4.790   5.873  -2.933
  283    HG3  GLU 545           1HG      GLU 545   5.158   4.736  -4.228
  284    H    GLY 546           H        GLY 546   0.310   6.801  -4.139
  285    HA2  GLY 546           2HA      GLY 546  -0.326   8.467  -6.206
  286    HA3  GLY 546           1HA      GLY 546  -0.525   6.855  -6.879
  287    H    LEU 547           H        LEU 547  -1.256   5.909  -4.087
  288    HA   LEU 547           HA       LEU 547  -3.960   7.077  -3.911
  289    HB2  LEU 547           2HB      LEU 547  -5.026   5.018  -3.942
  290    HB3  LEU 547           1HB      LEU 547  -3.809   4.865  -5.194
  291    HG   LEU 547           HG       LEU 547  -3.638   3.731  -2.401
  292   HD11  LEU 547          1HD1      LEU 547  -3.547   2.046  -4.833
  293   HD12  LEU 547          2HD1      LEU 547  -5.111   2.726  -4.383
  294   HD13  LEU 547          3HD1      LEU 547  -4.229   1.709  -3.243
  295   HD21  LEU 547          3HD2      LEU 547  -1.605   2.574  -3.432
  296   HD22  LEU 547          1HD2      LEU 547  -1.436   4.270  -2.975
  297   HD23  LEU 547          2HD2      LEU 547  -1.676   3.832  -4.666
  298    H    MET 548           H        MET 548  -1.168   6.179  -2.326
  299    HA   MET 548           HA       MET 548  -2.179   5.286   0.146
  300    HB2  MET 548           2HB      MET 548   0.169   6.146   0.955
  301    HB3  MET 548           1HB      MET 548   0.031   4.720  -0.057
  302    HG2  MET 548           2HG      MET 548   1.855   6.069  -0.813
  303    HG3  MET 548           1HG      MET 548   0.586   6.093  -2.026
  304    HE1  MET 548           3HE      MET 548  -0.192   9.626  -2.590
  305    HE2  MET 548           1HE      MET 548  -0.626   7.932  -2.821
  306    HE3  MET 548           2HE      MET 548   0.954   8.517  -3.343
  307    H    HIS 549           H        HIS 549  -3.917   7.054   0.064
  308    HA   HIS 549           HA       HIS 549  -2.969   9.301   1.712
  309    HB2  HIS 549           2HB      HIS 549  -5.402   9.811   0.133
  310    HB3  HIS 549           1HB      HIS 549  -4.031  10.860   0.460
  311    HD1  HIS 549           1HD      HIS 549  -5.635   9.839  -2.326
  312    HD2  HIS 549           2HD      HIS 549  -1.688   9.330  -1.139
  313    HE1  HIS 549           1HE      HIS 549  -4.345   9.436  -4.445
  314    HE2  HIS 549           2HE      HIS 549  -1.941   9.256  -3.713
  315    H    ASN 550           H        ASN 550  -3.775   6.990   2.887
  316    HA   ASN 550           HA       ASN 550  -5.120   6.242   4.567
  317    HB2  ASN 550           2HB      ASN 550  -5.732   9.080   4.418
  318    HB3  ASN 550           1HB      ASN 550  -7.126   8.139   4.935
  319   HD21  ASN 550          1HD2      ASN 550  -4.402   9.705   5.947
  320   HD22  ASN 550          2HD2      ASN 550  -4.214   8.969   7.498
  321    H    GLN 551           H        GLN 551  -7.322   8.135   2.510
  322    HA   GLN 551           HA       GLN 551  -9.305   7.613   1.540
  323    HB2  GLN 551           2HB      GLN 551  -8.640   4.914   0.712
  324    HB3  GLN 551           1HB      GLN 551  -8.946   6.341  -0.255
  325    HG2  GLN 551           2HG      GLN 551  -6.801   5.917  -0.861
  326    HG3  GLN 551           1HG      GLN 551  -6.516   6.989   0.505
  327   HE21  GLN 551          1HE2      GLN 551  -7.441   3.571   0.469
  328   HE22  GLN 551          2HE2      GLN 551  -6.053   3.009   1.324
  329    H    ASP 552           H        ASP 552  -8.572   4.292   2.405
  330    HA   ASP 552           HA       ASP 552  -9.701   2.735   3.612
  331    HB2  ASP 552           2HB      ASP 552  -9.939   5.219   5.186
  332    HB3  ASP 552           1HB      ASP 552 -11.124   3.975   5.574
  333    H    GLY 553           H        GLY 553 -11.039   4.315   1.374
  334    HA2  GLY 553           2HA      GLY 553 -13.771   3.375   1.965
  335    HA3  GLY 553           1HA      GLY 553 -13.509   4.953   1.237
  336    H    LEU 554           H        LEU 554 -11.318   4.088  -0.439
  337    HA   LEU 554           HA       LEU 554 -12.871   2.942  -2.603
  338    HB2  LEU 554           2HB      LEU 554 -10.906   3.462  -3.963
  339    HB3  LEU 554           1HB      LEU 554 -11.471   4.854  -3.060
  340    HG   LEU 554           HG       LEU 554  -9.584   3.878  -1.350
  341   HD11  LEU 554          1HD1      LEU 554  -7.726   3.042  -2.451
  342   HD12  LEU 554          2HD1      LEU 554  -8.293   3.574  -4.034
  343   HD13  LEU 554          3HD1      LEU 554  -9.059   2.199  -3.239
  344   HD21  LEU 554          3HD2      LEU 554  -9.220   5.815  -3.636
  345   HD22  LEU 554          1HD2      LEU 554  -8.127   5.659  -2.261
  346   HD23  LEU 554          2HD2      LEU 554  -9.791   6.190  -2.011
  347    H    ILE 555           H        ILE 555 -11.452   1.535  -0.132
  348    HA   ILE 555           HA       ILE 555 -10.700  -0.834  -1.656
  349    HB   ILE 555           HB       ILE 555  -8.710  -1.191  -0.262
  350   HG12  ILE 555          2HG1      ILE 555  -9.370   0.120   1.703
  351   HG13  ILE 555          1HG1      ILE 555  -7.810   0.632   1.099
  352   HG21  ILE 555          1HG2      ILE 555  -7.393  -0.103  -1.705
  353   HG22  ILE 555          2HG2      ILE 555  -8.099   1.469  -1.320
  354   HG23  ILE 555          3HG2      ILE 555  -8.913   0.390  -2.453
  355   HD11  ILE 555          3HD1      ILE 555  -9.399   2.356  -0.199
  356   HD12  ILE 555          1HD1      ILE 555  -8.651   2.669   1.365
  357   HD13  ILE 555          2HD1      ILE 555 -10.318   2.112   1.286
  358    H    CYS 556           H        CYS 556 -11.284   0.618   1.502
  359    HA   CYS 556           HA       CYS 556 -12.178  -1.977   2.507
  360    HB2  CYS 556           2HB      CYS 556 -10.407  -0.148   3.585
  361    HB3  CYS 556           1HB      CYS 556 -11.898   0.172   4.468
  362    H    GLY 557           H        GLY 557 -14.287  -2.006   1.777
  363    HA2  GLY 557           2HA      GLY 557 -16.065  -0.058   3.087
  364    HA3  GLY 557           1HA      GLY 557 -16.260  -0.405   1.376
  365    H    LEU 558           H        LEU 558 -16.404  -2.873   0.924
  366    HA   LEU 558           HA       LEU 558 -17.958  -4.197   3.025
  367    HB2  LEU 558           2HB      LEU 558 -19.670  -4.875   1.477
  368    HB3  LEU 558           1HB      LEU 558 -19.534  -3.128   1.466
  369    HG   LEU 558           HG       LEU 558 -18.299  -4.913  -0.630
  370   HD11  LEU 558          1HD1      LEU 558 -20.950  -4.679  -0.299
  371   HD12  LEU 558          2HD1      LEU 558 -20.175  -4.837  -1.875
  372   HD13  LEU 558          3HD1      LEU 558 -20.641  -3.245  -1.276
  373   HD21  LEU 558          3HD2      LEU 558 -18.145  -2.088  -0.023
  374   HD22  LEU 558          1HD2      LEU 558 -18.772  -2.375  -1.646
  375   HD23  LEU 558          2HD2      LEU 558 -17.215  -3.048  -1.172
  376    H    ARG 559           H        ARG 559 -16.395  -4.584  -0.154
  377    HA   ARG 559           HA       ARG 559 -14.789  -6.726   0.621
  378    HB2  ARG 559           2HB      ARG 559 -15.884  -8.633  -0.393
  379    HB3  ARG 559           1HB      ARG 559 -16.953  -7.923   0.808
  380    HG2  ARG 559           2HG      ARG 559 -17.352  -6.788  -1.828
  381    HG3  ARG 559           1HG      ARG 559 -17.601  -8.538  -1.799
  382    HD2  ARG 559           2HD      ARG 559 -18.876  -6.617   0.142
  383    HD3  ARG 559           1HD      ARG 559 -19.651  -7.177  -1.339
  384    HE   ARG 559           HE       ARG 559 -18.746  -9.310   0.358
  385   HH11  ARG 559          1HH1      ARG 559 -21.360  -7.089  -0.289
  386   HH12  ARG 559          2HH1      ARG 559 -22.561  -8.089   0.456
  387   HH21  ARG 559          1HH2      ARG 559 -20.325 -10.627   1.338
  388   HH22  ARG 559          2HH2      ARG 559 -21.973 -10.098   1.380
  389    H    GLN 560           H        GLN 560 -14.587  -4.409  -0.925
  390    HA   GLN 560           HA       GLN 560 -14.176  -5.418  -3.647
  391    HB2  GLN 560           2HB      GLN 560 -14.272  -3.201  -4.425
  392    HB3  GLN 560           1HB      GLN 560 -15.534  -3.309  -3.209
  393    HG2  GLN 560           2HG      GLN 560 -13.157  -2.477  -1.911
  394    HG3  GLN 560           1HG      GLN 560 -13.353  -1.498  -3.364
  395   HE21  GLN 560          1HE2      GLN 560 -14.980  -2.596  -0.442
  396   HE22  GLN 560          2HE2      GLN 560 -16.029  -1.234  -0.297
  Start of MODEL    7
    1    H1   ALA 507           1HT      ALA 507 -11.865 -11.631  -3.770
    2    H2   ALA 507           2HT      ALA 507 -11.964 -13.344  -3.792
    3    H3   ALA 507           3HT      ALA 507 -12.351 -12.479  -2.362
    4    HA   ALA 507           HA       ALA 507 -13.799 -12.308  -4.915
    5    HB1  ALA 507           1HB      ALA 507 -14.985 -13.491  -2.464
    6    HB2  ALA 507           2HB      ALA 507 -13.847 -14.470  -3.390
    7    HB3  ALA 507           3HB      ALA 507 -15.305 -13.844  -4.161
    8    H    GLN 508           H        GLN 508 -13.993 -11.733  -1.397
    9    HA   GLN 508           HA       GLN 508 -14.939  -9.037  -1.878
   10    HB2  GLN 508           2HB      GLN 508 -16.658 -11.188  -0.672
   11    HB3  GLN 508           1HB      GLN 508 -16.888  -9.500  -0.233
   12    HG2  GLN 508           2HG      GLN 508 -16.993 -10.560  -3.047
   13    HG3  GLN 508           1HG      GLN 508 -18.401 -10.288  -2.022
   14   HE21  GLN 508          1HE2      GLN 508 -18.913  -8.140  -1.405
   15   HE22  GLN 508          2HE2      GLN 508 -18.390  -6.799  -2.360
   16    HA   PRO 509           HA       PRO 509 -12.544  -9.882   2.106
   17    HB2  PRO 509           2HB      PRO 509 -10.098  -9.027   1.413
   18    HB3  PRO 509           1HB      PRO 509 -10.634 -10.676   1.071
   19    HG2  PRO 509           2HG      PRO 509 -10.513  -8.307  -0.755
   20    HG3  PRO 509           1HG      PRO 509 -10.038  -9.986  -1.069
   21    HD2  PRO 509           2HD      PRO 509 -12.423  -8.910  -1.869
   22    HD3  PRO 509           1HD      PRO 509 -12.188 -10.636  -1.525
   23    H    LYS 510           H        LYS 510 -12.445  -8.326   3.632
   24    HA   LYS 510           HA       LYS 510 -12.957  -5.585   2.817
   25    HB2  LYS 510           2HB      LYS 510 -12.679  -6.545   5.656
   26    HB3  LYS 510           1HB      LYS 510 -13.594  -5.171   5.050
   27    HG2  LYS 510           2HG      LYS 510 -14.613  -7.509   3.809
   28    HG3  LYS 510           1HG      LYS 510 -14.481  -7.820   5.541
   29    HD2  LYS 510           2HD      LYS 510 -16.103  -6.338   6.058
   30    HD3  LYS 510           1HD      LYS 510 -15.593  -5.193   4.816
   31    HE2  LYS 510           2HE      LYS 510 -17.469  -5.820   3.761
   32    HE3  LYS 510           1HE      LYS 510 -16.541  -7.249   3.307
   33    HZ1  LYS 510           3HZ      LYS 510 -18.386  -7.000   5.620
   34    HZ2  LYS 510           1HZ      LYS 510 -17.420  -8.355   5.306
   35    HZ3  LYS 510           2HZ      LYS 510 -18.640  -7.915   4.220
   36    H    CYS 511           H        CYS 511 -11.474  -4.038   2.724
   37    HA   CYS 511           HA       CYS 511  -9.508  -2.914   2.914
   38    HB2  CYS 511           2HB      CYS 511  -9.362  -4.497   5.485
   39    HB3  CYS 511           1HB      CYS 511  -8.233  -3.216   5.056
   40    H    ASN 512           H        ASN 512  -8.303  -3.581   1.243
   41    HA   ASN 512           HA       ASN 512  -6.813  -6.077   1.454
   42    HB2  ASN 512           2HB      ASN 512  -7.047  -4.327  -0.987
   43    HB3  ASN 512           1HB      ASN 512  -6.484  -5.990  -0.910
   44   HD21  ASN 512          1HD2      ASN 512  -9.332  -3.995  -0.204
   45   HD22  ASN 512          2HD2      ASN 512 -10.490  -5.193  -0.650
   46    HA   PRO 513           HA       PRO 513  -3.287  -2.986   0.970
   47    HB2  PRO 513           2HB      PRO 513  -3.853  -0.479   0.083
   48    HB3  PRO 513           1HB      PRO 513  -3.700  -1.878  -0.984
   49    HG2  PRO 513           2HG      PRO 513  -6.071  -0.350  -0.389
   50    HG3  PRO 513           1HG      PRO 513  -5.888  -1.703  -1.515
   51    HD2  PRO 513           2HD      PRO 513  -6.878  -1.696   1.271
   52    HD3  PRO 513           1HD      PRO 513  -7.221  -2.821  -0.055
   53    H    ASN 514           H        ASN 514  -5.599  -2.605   3.106
   54    HA   ASN 514           HA       ASN 514  -4.275  -0.399   4.532
   55    HB2  ASN 514           2HB      ASN 514  -7.146  -1.026   4.126
   56    HB3  ASN 514           1HB      ASN 514  -6.690  -0.524   5.753
   57   HD21  ASN 514          1HD2      ASN 514  -6.878   0.422   2.397
   58   HD22  ASN 514          2HD2      ASN 514  -6.693   2.118   2.666
   59    H    LEU 515           H        LEU 515  -3.083  -2.655   4.742
   60    HA   LEU 515           HA       LEU 515  -4.134  -4.166   7.004
   61    HB2  LEU 515           2HB      LEU 515  -1.598  -4.906   5.650
   62    HB3  LEU 515           1HB      LEU 515  -2.849  -5.932   6.314
   63    HG   LEU 515           HG       LEU 515  -2.997  -6.326   4.035
   64   HD11  LEU 515          1HD1      LEU 515  -5.097  -5.013   5.272
   65   HD12  LEU 515          2HD1      LEU 515  -5.173  -5.963   3.788
   66   HD13  LEU 515          3HD1      LEU 515  -4.947  -4.216   3.706
   67   HD21  LEU 515          3HD2      LEU 515  -3.235  -3.733   2.852
   68   HD22  LEU 515          1HD2      LEU 515  -2.050  -4.997   2.527
   69   HD23  LEU 515          2HD2      LEU 515  -1.749  -3.809   3.798
   70    H    HIS 516           H        HIS 516  -1.147  -2.493   6.001
   71    HA   HIS 516           HA       HIS 516  -0.671  -1.425   8.558
   72    HB2  HIS 516           2HB      HIS 516   0.922  -2.807   9.521
   73    HB3  HIS 516           1HB      HIS 516  -0.193  -3.975   8.818
   74    HD1  HIS 516           1HD      HIS 516   0.674  -5.419   6.895
   75    HD2  HIS 516           2HD      HIS 516   3.367  -2.537   8.173
   76    HE1  HIS 516           1HE      HIS 516   2.809  -5.916   5.672
   77    HE2  HIS 516           2HE      HIS 516   4.485  -4.274   6.602
   78    H    TYR 517           H        TYR 517   1.170  -2.731   5.783
   79    HA   TYR 517           HA       TYR 517   3.199  -0.831   5.872
   80    HB2  TYR 517           2HB      TYR 517   2.968  -1.511   3.153
   81    HB3  TYR 517           1HB      TYR 517   4.125  -2.102   4.323
   82    HD1  TYR 517           2HD      TYR 517   0.462  -2.924   4.164
   83    HD2  TYR 517           1HD      TYR 517   4.465  -4.259   3.593
   84    HE1  TYR 517           2HE      TYR 517  -0.348  -5.216   3.810
   85    HE2  TYR 517           1HE      TYR 517   3.654  -6.545   3.216
   86    HH   TYR 517           HH       TYR 517   1.646  -7.706   2.572
   87    H    TRP 518           H        TRP 518   0.012  -0.524   4.582
   88    HA   TRP 518           HA       TRP 518   0.819   2.028   3.351
   89    HB2  TRP 518           2HB      TRP 518  -1.785   0.855   2.581
   90    HB3  TRP 518           1HB      TRP 518  -0.597   1.679   1.599
   91    HD1  TRP 518           HD       TRP 518   0.943  -1.268   3.270
   92    HE1  TRP 518           1HE      TRP 518   1.157  -3.185   1.649
   93    HE3  TRP 518           3HE      TRP 518  -1.984   0.562  -0.485
   94    HZ2  TRP 518           2HZ      TRP 518   0.192  -3.900  -0.911
   95    HZ3  TRP 518           3HZ      TRP 518  -2.282  -0.813  -2.503
   96    HH2  TRP 518           HH       TRP 518  -1.211  -2.997  -2.714
   97    H    THR 519           H        THR 519  -1.606   0.392   5.258
   98    HA   THR 519           HA       THR 519  -3.390   2.487   5.694
   99    HB   THR 519           HB       THR 519  -3.935   0.217   6.318
  100    HG1  THR 519           1HG      THR 519  -5.122   1.452   7.596
  101   HG21  THR 519          3HG2      THR 519  -2.894  -1.032   7.979
  102   HG22  THR 519          1HG2      THR 519  -2.039   0.366   8.627
  103   HG23  THR 519          2HG2      THR 519  -1.556  -0.320   7.075
  104    H    THR 520           H        THR 520  -0.220   1.995   6.927
  105    HA   THR 520           HA       THR 520  -0.644   4.026   9.005
  106    HB   THR 520           HB       THR 520   1.058   1.656   8.784
  107    HG1  THR 520           1HG      THR 520   0.833   1.738  11.004
  108   HG21  THR 520          3HG2      THR 520   2.297   4.232   9.685
  109   HG22  THR 520          1HG2      THR 520   2.966   2.993   8.623
  110   HG23  THR 520          2HG2      THR 520   2.795   2.676  10.351
  111    H    GLN 521           H        GLN 521   2.053   3.100   6.891
  112    HA   GLN 521           HA       GLN 521   2.740   5.925   6.652
  113    HB2  GLN 521           2HB      GLN 521   4.940   5.219   6.084
  114    HB3  GLN 521           1HB      GLN 521   4.420   4.237   7.443
  115    HG2  GLN 521           2HG      GLN 521   4.298   2.322   6.202
  116    HG3  GLN 521           1HG      GLN 521   4.020   3.183   4.694
  117   HE21  GLN 521          1HE2      GLN 521   6.056   4.918   4.512
  118   HE22  GLN 521          2HE2      GLN 521   7.574   4.099   4.472
  119    H    ASP 522           H        ASP 522   4.297   5.706   4.337
  120    HA   ASP 522           HA       ASP 522   2.205   5.798   2.308
  121    HB2  ASP 522           2HB      ASP 522   4.410   7.387   2.886
  122    HB3  ASP 522           1HB      ASP 522   4.850   6.531   1.416
  123    H    GLU 523           H        GLU 523   3.109   3.248   3.215
  124    HA   GLU 523           HA       GLU 523   3.689   1.195   2.397
  125    HB2  GLU 523           2HB      GLU 523   3.696   2.388  -0.362
  126    HB3  GLU 523           1HB      GLU 523   3.278   0.751   0.121
  127    HG2  GLU 523           2HG      GLU 523   1.214   1.427   1.005
  128    HG3  GLU 523           1HG      GLU 523   1.659   3.131   0.950
  129    H    GLY 524           H        GLY 524   5.691   3.440   2.846
  130    HA2  GLY 524           2HA      GLY 524   8.035   3.083   3.026
  131    HA3  GLY 524           1HA      GLY 524   7.945   2.018   1.630
  132    H    ALA 525           H        ALA 525   6.390   5.167   1.797
  133    HA   ALA 525           HA       ALA 525   8.305   6.088  -0.232
  134    HB1  ALA 525           1HB      ALA 525   5.667   7.374  -0.203
  135    HB2  ALA 525           2HB      ALA 525   5.683   5.676  -0.676
  136    HB3  ALA 525           3HB      ALA 525   6.663   6.846  -1.559
  137    H    ALA 526           H        ALA 526   7.641   6.553   2.894
  138    HA   ALA 526           HA       ALA 526   7.772   9.427   2.860
  139    HB1  ALA 526           1HB      ALA 526   6.363   8.968   4.566
  140    HB2  ALA 526           2HB      ALA 526   7.870   8.858   5.475
  141    HB3  ALA 526           3HB      ALA 526   7.092   7.393   4.876
  142    H    ILE 527           H        ILE 527   9.989   7.483   2.086
  143    HA   ILE 527           HA       ILE 527  12.070   8.642   3.806
  144    HB   ILE 527           HB       ILE 527  12.933   6.201   2.530
  145   HG12  ILE 527          2HG1      ILE 527  11.493   4.739   4.086
  146   HG13  ILE 527          1HG1      ILE 527  10.398   6.106   4.163
  147   HG21  ILE 527          1HG2      ILE 527  12.925   7.456   5.203
  148   HG22  ILE 527          2HG2      ILE 527  14.247   6.724   4.293
  149   HG23  ILE 527          3HG2      ILE 527  13.097   5.701   5.153
  150   HD11  ILE 527          3HD1      ILE 527  11.088   5.484   1.443
  151   HD12  ILE 527          1HD1      ILE 527   9.509   5.581   2.217
  152   HD13  ILE 527          2HD1      ILE 527  10.430   4.077   2.277
  153    H    GLY 528           H        GLY 528  11.573   7.127   0.579
  154    HA2  GLY 528           2HA      GLY 528  12.298   9.043  -1.108
  155    HA3  GLY 528           1HA      GLY 528  13.864   8.619  -0.437
  156    H    LEU 529           H        LEU 529  12.765   5.764  -0.189
  157    HA   LEU 529           HA       LEU 529  12.688   3.831  -1.393
  158    HB2  LEU 529           2HB      LEU 529  12.172   5.760  -3.618
  159    HB3  LEU 529           1HB      LEU 529  12.346   4.044  -3.919
  160    HG   LEU 529           HG       LEU 529  10.413   3.571  -2.527
  161   HD11  LEU 529          1HD1      LEU 529  10.357   5.102  -0.819
  162   HD12  LEU 529          2HD1      LEU 529   9.082   5.724  -1.868
  163   HD13  LEU 529          3HD1      LEU 529  10.681   6.467  -1.887
  164   HD21  LEU 529          3HD2      LEU 529   8.697   4.590  -3.906
  165   HD22  LEU 529          1HD2      LEU 529  10.072   4.111  -4.902
  166   HD23  LEU 529          2HD2      LEU 529   9.843   5.805  -4.472
  167    H    ALA 530           H        ALA 530  14.920   6.298  -2.150
  168    HA   ALA 530           HA       ALA 530  16.594   4.628  -3.765
  169    HB1  ALA 530           1HB      ALA 530  17.382   7.226  -2.463
  170    HB2  ALA 530           2HB      ALA 530  16.480   7.128  -3.976
  171    HB3  ALA 530           3HB      ALA 530  18.110   6.461  -3.876
  172    H    TRP 531           H        TRP 531  16.161   5.184  -0.452
  173    HA   TRP 531           HA       TRP 531  18.725   4.510   0.539
  174    HB2  TRP 531           2HB      TRP 531  17.520   4.213   2.697
  175    HB3  TRP 531           1HB      TRP 531  17.107   5.729   1.903
  176    HD1  TRP 531           HD       TRP 531  14.761   5.452   0.279
  177    HE1  TRP 531           1HE      TRP 531  12.563   4.393   0.989
  178    HE3  TRP 531           3HE      TRP 531  16.441   2.653   4.213
  179    HZ2  TRP 531           2HZ      TRP 531  11.611   2.613   2.971
  180    HZ3  TRP 531           3HZ      TRP 531  14.813   1.303   5.471
  181    HH2  TRP 531           HH       TRP 531  12.448   1.283   4.862
  182    H    ILE 532           H        ILE 532  16.267   2.675  -0.903
  183    HA   ILE 532           HA       ILE 532  17.436   0.193   0.128
  184    HB   ILE 532           HB       ILE 532  15.136  -0.787  -0.288
  185   HG12  ILE 532          2HG1      ILE 532  14.560   2.141  -0.602
  186   HG13  ILE 532          1HG1      ILE 532  13.961   0.791  -1.551
  187   HG21  ILE 532          1HG2      ILE 532  16.028  -0.439   1.929
  188   HG22  ILE 532          2HG2      ILE 532  14.318  -0.007   1.915
  189   HG23  ILE 532          3HG2      ILE 532  15.549   1.258   1.882
  190   HD11  ILE 532          3HD1      ILE 532  13.015   0.515   1.120
  191   HD12  ILE 532          1HD1      ILE 532  12.102   0.782  -0.363
  192   HD13  ILE 532          2HD1      ILE 532  12.697   2.158   0.562
  193    HA   PRO 533           HA       PRO 533  18.015  -0.659  -4.183
  194    HB2  PRO 533           2HB      PRO 533  19.013  -3.119  -4.008
  195    HB3  PRO 533           1HB      PRO 533  19.884  -1.733  -3.342
  196    HG2  PRO 533           2HG      PRO 533  18.244  -3.795  -1.935
  197    HG3  PRO 533           1HG      PRO 533  19.772  -3.047  -1.437
  198    HD2  PRO 533           2HD      PRO 533  17.246  -2.292  -0.549
  199    HD3  PRO 533           1HD      PRO 533  18.708  -1.293  -0.453
  200    H    TYR 534           H        TYR 534  15.872  -2.665  -2.258
  201    HA   TYR 534           HA       TYR 534  14.373  -3.276  -4.673
  202    HB2  TYR 534           2HB      TYR 534  14.306  -5.682  -4.254
  203    HB3  TYR 534           1HB      TYR 534  15.956  -5.130  -4.518
  204    HD1  TYR 534           2HD      TYR 534  13.552  -5.835  -1.752
  205    HD2  TYR 534           1HD      TYR 534  17.611  -5.766  -3.025
  206    HE1  TYR 534           2HE      TYR 534  14.230  -6.868   0.374
  207    HE2  TYR 534           1HE      TYR 534  18.300  -6.799  -0.902
  208    HH   TYR 534           HH       TYR 534  16.163  -7.111   1.771
  209    H    PHE 535           H        PHE 535  14.220  -2.157  -1.645
  210    HA   PHE 535           HA       PHE 535  11.900  -3.607  -0.724
  211    HB2  PHE 535           2HB      PHE 535  13.277  -1.131   0.294
  212    HB3  PHE 535           1HB      PHE 535  11.869  -1.839   1.069
  213    HD1  PHE 535           2HD      PHE 535  15.291  -2.745  -0.080
  214    HD2  PHE 535           1HD      PHE 535  12.191  -3.347   2.767
  215    HE1  PHE 535           2HE      PHE 535  16.775  -4.206   1.218
  216    HE2  PHE 535           1HE      PHE 535  13.669  -4.808   4.075
  217    HZ   PHE 535           HZ       PHE 535  15.968  -5.245   3.302
  218    H    GLY 536           H        GLY 536  12.596  -0.477  -2.181
  219    HA2  GLY 536           2HA      GLY 536   9.692   0.003  -2.404
  220    HA3  GLY 536           1HA      GLY 536  10.907   1.272  -2.357
  221    HA   PRO 537           HA       PRO 537  11.519   1.464  -6.716
  222    HB2  PRO 537           2HB      PRO 537  14.088  -0.038  -6.587
  223    HB3  PRO 537           1HB      PRO 537  13.740   1.535  -7.313
  224    HG2  PRO 537           2HG      PRO 537  15.048   1.353  -4.995
  225    HG3  PRO 537           1HG      PRO 537  13.874   2.648  -5.285
  226    HD2  PRO 537           2HD      PRO 537  13.614   0.183  -3.637
  227    HD3  PRO 537           1HD      PRO 537  12.930   1.798  -3.369
  228    H    ALA 538           H        ALA 538  12.509  -1.675  -5.403
  229    HA   ALA 538           HA       ALA 538  11.747  -3.068  -7.828
  230    HB1  ALA 538           1HB      ALA 538  12.662  -4.167  -5.173
  231    HB2  ALA 538           2HB      ALA 538  13.703  -3.802  -6.549
  232    HB3  ALA 538           3HB      ALA 538  12.492  -5.078  -6.673
  233    H    ALA 539           H        ALA 539  10.521  -2.617  -4.558
  234    HA   ALA 539           HA       ALA 539   8.575  -4.517  -4.339
  235    HB1  ALA 539           1HB      ALA 539   7.271  -2.436  -3.248
  236    HB2  ALA 539           2HB      ALA 539   8.907  -1.780  -3.313
  237    HB3  ALA 539           3HB      ALA 539   8.596  -3.289  -2.456
  238    H    GLU 540           H        GLU 540   6.198  -4.300  -4.558
  239    HA   GLU 540           HA       GLU 540   5.274  -2.621  -6.749
  240    HB2  GLU 540           2HB      GLU 540   5.059  -5.638  -6.804
  241    HB3  GLU 540           1HB      GLU 540   4.257  -4.549  -7.927
  242    HG2  GLU 540           2HG      GLU 540   6.702  -3.696  -8.346
  243    HG3  GLU 540           1HG      GLU 540   7.127  -5.289  -7.722
  244    H    GLY 541           H        GLY 541   4.494  -5.111  -4.366
  245    HA2  GLY 541           2HA      GLY 541   1.800  -3.936  -4.092
  246    HA3  GLY 541           1HA      GLY 541   2.212  -5.594  -3.676
  247    H    ILE 542           H        ILE 542   4.418  -3.082  -2.867
  248    HA   ILE 542           HA       ILE 542   3.439  -2.955  -0.110
  249    HB   ILE 542           HB       ILE 542   6.377  -3.208  -0.461
  250   HG12  ILE 542          2HG1      ILE 542   6.018  -5.753  -0.148
  251   HG13  ILE 542          1HG1      ILE 542   4.416  -5.450  -0.824
  252   HG21  ILE 542          1HG2      ILE 542   4.884  -4.663   1.631
  253   HG22  ILE 542          2HG2      ILE 542   4.785  -2.903   1.684
  254   HG23  ILE 542          3HG2      ILE 542   6.357  -3.699   1.747
  255   HD11  ILE 542          3HD1      ILE 542   6.034  -4.149  -2.597
  256   HD12  ILE 542          1HD1      ILE 542   5.412  -5.791  -2.795
  257   HD13  ILE 542          2HD1      ILE 542   7.026  -5.536  -2.132
  258    H    TYR 543           H        TYR 543   4.995  -1.502  -2.817
  259    HA   TYR 543           HA       TYR 543   5.432   0.923  -1.282
  260    HB2  TYR 543           2HB      TYR 543   7.484   1.101  -2.175
  261    HB3  TYR 543           1HB      TYR 543   7.319  -0.606  -2.516
  262    HD1  TYR 543           2HD      TYR 543   6.016  -1.115  -4.777
  263    HD2  TYR 543           1HD      TYR 543   8.143   2.467  -3.912
  264    HE1  TYR 543           2HE      TYR 543   6.236  -0.667  -7.185
  265    HE2  TYR 543           1HE      TYR 543   8.361   2.932  -6.307
  266    HH   TYR 543           HH       TYR 543   7.612   0.590  -8.711
  267    H    ILE 544           H        ILE 544   3.540  -0.551  -3.513
  268    HA   ILE 544           HA       ILE 544   2.685   0.234  -5.632
  269    HB   ILE 544           HB       ILE 544   1.005   1.578  -3.549
  270   HG12  ILE 544          2HG1      ILE 544   0.009  -0.847  -3.412
  271   HG13  ILE 544          1HG1      ILE 544   1.624  -1.327  -3.922
  272   HG21  ILE 544          1HG2      ILE 544   0.073   1.828  -5.680
  273   HG22  ILE 544          2HG2      ILE 544  -0.782   0.449  -4.988
  274   HG23  ILE 544          3HG2      ILE 544   0.510   0.188  -6.161
  275   HD11  ILE 544          3HD1      ILE 544   0.723  -0.118  -1.370
  276   HD12  ILE 544          1HD1      ILE 544   2.353   0.225  -1.934
  277   HD13  ILE 544          2HD1      ILE 544   1.848  -1.441  -1.660
  278    H    GLU 545           H        GLU 545   2.949   2.925  -3.314
  279    HA   GLU 545           HA       GLU 545   3.017   5.183  -3.636
  280    HB2  GLU 545           2HB      GLU 545   4.795   5.835  -5.341
  281    HB3  GLU 545           1HB      GLU 545   5.302   4.776  -4.035
  282    HG2  GLU 545           2HG      GLU 545   5.523   2.941  -5.416
  283    HG3  GLU 545           1HG      GLU 545   4.431   3.612  -6.630
  284    H    GLY 546           H        GLY 546   0.805   5.289  -4.339
  285    HA2  GLY 546           2HA      GLY 546   0.397   6.875  -6.577
  286    HA3  GLY 546           1HA      GLY 546   0.072   5.225  -7.082
  287    H    LEU 547           H        LEU 547  -0.907   4.578  -4.310
  288    HA   LEU 547           HA       LEU 547  -3.488   5.999  -4.442
  289    HB2  LEU 547           2HB      LEU 547  -4.700   4.035  -4.165
  290    HB3  LEU 547           1HB      LEU 547  -3.455   3.603  -5.321
  291    HG   LEU 547           HG       LEU 547  -3.419   2.943  -2.375
  292   HD11  LEU 547          1HD1      LEU 547  -3.746   1.093  -4.726
  293   HD12  LEU 547          2HD1      LEU 547  -5.089   1.708  -3.764
  294   HD13  LEU 547          3HD1      LEU 547  -3.860   0.690  -3.013
  295   HD21  LEU 547          3HD2      LEU 547  -1.524   1.411  -3.220
  296   HD22  LEU 547          1HD2      LEU 547  -1.178   3.122  -2.959
  297   HD23  LEU 547          2HD2      LEU 547  -1.454   2.517  -4.592
  298    H    MET 548           H        MET 548  -0.871   5.122  -2.519
  299    HA   MET 548           HA       MET 548  -2.143   4.872  -0.011
  300    HB2  MET 548           2HB      MET 548   0.255   5.631   0.814
  301    HB3  MET 548           1HB      MET 548  -0.044   4.019   0.195
  302    HG2  MET 548           2HG      MET 548   1.984   4.754  -0.743
  303    HG3  MET 548           1HG      MET 548   0.800   4.828  -2.035
  304    HE1  MET 548           3HE      MET 548   0.493   8.324  -3.051
  305    HE2  MET 548           1HE      MET 548  -0.028   6.643  -3.134
  306    HE3  MET 548           2HE      MET 548   1.564   7.102  -3.735
  307    H    HIS 549           H        HIS 549  -3.638   6.684  -0.364
  308    HA   HIS 549           HA       HIS 549  -2.454   9.186   0.641
  309    HB2  HIS 549           2HB      HIS 549  -4.963   9.272  -0.966
  310    HB3  HIS 549           1HB      HIS 549  -3.699  10.483  -0.799
  311    HD1  HIS 549           1HD      HIS 549  -5.060   8.972  -3.428
  312    HD2  HIS 549           2HD      HIS 549  -1.181   8.740  -1.958
  313    HE1  HIS 549           1HE      HIS 549  -3.648   8.247  -5.374
  314    HE2  HIS 549           2HE      HIS 549  -1.288   8.211  -4.488
  315    H    ASN 550           H        ASN 550  -3.693   6.860   2.020
  316    HA   ASN 550           HA       ASN 550  -5.107   6.449   3.751
  317    HB2  ASN 550           2HB      ASN 550  -5.288   9.467   3.859
  318    HB3  ASN 550           1HB      ASN 550  -5.797   8.363   5.132
  319   HD21  ASN 550          1HD2      ASN 550  -4.185   9.997   6.135
  320   HD22  ASN 550          2HD2      ASN 550  -2.554   9.437   6.241
  321    H    GLN 551           H        GLN 551  -6.383   5.794   1.671
  322    HA   GLN 551           HA       GLN 551  -8.793   7.351   1.266
  323    HB2  GLN 551           2HB      GLN 551  -8.706   4.689   0.039
  324    HB3  GLN 551           1HB      GLN 551  -9.056   6.249  -0.685
  325    HG2  GLN 551           2HG      GLN 551  -7.111   6.074  -1.729
  326    HG3  GLN 551           1HG      GLN 551  -6.335   6.354  -0.173
  327   HE21  GLN 551          1HE2      GLN 551  -6.803   4.015   1.142
  328   HE22  GLN 551          2HE2      GLN 551  -6.024   2.707   0.332
  329    H    ASP 552           H        ASP 552  -8.327   3.909   1.793
  330    HA   ASP 552           HA       ASP 552  -9.410   2.366   3.041
  331    HB2  ASP 552           2HB      ASP 552 -10.014   4.814   4.709
  332    HB3  ASP 552           1HB      ASP 552 -10.477   3.184   5.191
  333    H    GLY 553           H        GLY 553 -10.784   4.045   0.913
  334    HA2  GLY 553           2HA      GLY 553 -13.556   3.337   1.647
  335    HA3  GLY 553           1HA      GLY 553 -13.154   4.733   0.657
  336    H    LEU 554           H        LEU 554 -11.064   3.283  -0.791
  337    HA   LEU 554           HA       LEU 554 -12.782   1.997  -2.748
  338    HB2  LEU 554           2HB      LEU 554 -10.768   2.017  -4.162
  339    HB3  LEU 554           1HB      LEU 554 -11.191   3.607  -3.560
  340    HG   LEU 554           HG       LEU 554  -9.392   2.712  -1.665
  341   HD11  LEU 554          1HD1      LEU 554  -7.601   1.639  -2.670
  342   HD12  LEU 554          2HD1      LEU 554  -8.147   2.031  -4.300
  343   HD13  LEU 554          3HD1      LEU 554  -8.994   0.804  -3.357
  344   HD21  LEU 554          3HD2      LEU 554  -9.304   4.543  -4.002
  345   HD22  LEU 554          1HD2      LEU 554  -7.784   4.161  -3.195
  346   HD23  LEU 554          2HD2      LEU 554  -9.109   4.886  -2.283
  347    H    ILE 555           H        ILE 555 -11.317   0.954  -0.055
  348    HA   ILE 555           HA       ILE 555 -11.101  -1.781  -1.025
  349    HB   ILE 555           HB       ILE 555  -8.981  -2.120   0.205
  350   HG12  ILE 555          2HG1      ILE 555  -9.142  -0.192   1.733
  351   HG13  ILE 555          1HG1      ILE 555  -7.626  -0.201   0.857
  352   HG21  ILE 555          1HG2      ILE 555  -7.844  -1.799  -1.676
  353   HG22  ILE 555          2HG2      ILE 555  -8.104  -0.052  -1.634
  354   HG23  ILE 555          3HG2      ILE 555  -9.334  -1.113  -2.321
  355   HD11  ILE 555          3HD1      ILE 555  -8.051   1.937   0.482
  356   HD12  ILE 555          1HD1      ILE 555  -9.768   1.758   0.844
  357   HD13  ILE 555          2HD1      ILE 555  -9.155   1.334  -0.753
  358    H    CYS 556           H        CYS 556 -10.990   0.472   1.675
  359    HA   CYS 556           HA       CYS 556 -11.775  -1.598   3.550
  360    HB2  CYS 556           2HB      CYS 556 -10.646   1.138   3.716
  361    HB3  CYS 556           1HB      CYS 556 -11.671   0.637   5.051
  362    H    GLY 557           H        GLY 557 -13.702  -0.896   1.549
  363    HA2  GLY 557           2HA      GLY 557 -16.085  -0.959   2.574
  364    HA3  GLY 557           1HA      GLY 557 -15.675   0.678   3.055
  365    H    LEU 558           H        LEU 558 -14.916  -0.966   0.000
  366    HA   LEU 558           HA       LEU 558 -16.250   1.225  -1.399
  367    HB2  LEU 558           2HB      LEU 558 -14.947   0.739  -3.274
  368    HB3  LEU 558           1HB      LEU 558 -13.862   0.491  -1.923
  369    HG   LEU 558           HG       LEU 558 -15.294  -1.888  -3.008
  370   HD11  LEU 558          1HD1      LEU 558 -14.285  -0.386  -4.889
  371   HD12  LEU 558          2HD1      LEU 558 -14.009  -2.129  -4.887
  372   HD13  LEU 558          3HD1      LEU 558 -12.754  -1.038  -4.303
  373   HD21  LEU 558          3HD2      LEU 558 -13.746  -3.017  -1.865
  374   HD22  LEU 558          1HD2      LEU 558 -13.378  -1.481  -1.080
  375   HD23  LEU 558          2HD2      LEU 558 -12.436  -2.009  -2.474
  376    H    ARG 559           H        ARG 559 -16.208  -2.290  -1.225
  377    HA   ARG 559           HA       ARG 559 -18.901  -2.741  -1.459
  378    HB2  ARG 559           2HB      ARG 559 -19.236  -3.402  -3.787
  379    HB3  ARG 559           1HB      ARG 559 -18.752  -1.714  -3.709
  380    HG2  ARG 559           2HG      ARG 559 -16.482  -3.501  -3.942
  381    HG3  ARG 559           1HG      ARG 559 -17.619  -3.673  -5.283
  382    HD2  ARG 559           2HD      ARG 559 -16.457  -1.062  -4.327
  383    HD3  ARG 559           1HD      ARG 559 -15.849  -1.990  -5.696
  384    HE   ARG 559           HE       ARG 559 -18.159  -0.299  -5.645
  385   HH11  ARG 559          1HH1      ARG 559 -16.726  -3.089  -7.174
  386   HH12  ARG 559          2HH1      ARG 559 -17.635  -2.910  -8.637
  387   HH21  ARG 559          1HH2      ARG 559 -19.357  -0.062  -7.568
  388   HH22  ARG 559          2HH2      ARG 559 -19.130  -1.193  -8.861
  389    H    GLN 560           H        GLN 560 -16.593  -3.748  -0.234
  390    HA   GLN 560           HA       GLN 560 -16.451  -6.487  -1.278
  391    HB2  GLN 560           2HB      GLN 560 -14.326  -6.571   0.143
  392    HB3  GLN 560           1HB      GLN 560 -14.288  -5.599  -1.321
  393    HG2  GLN 560           2HG      GLN 560 -13.220  -4.615   0.762
  394    HG3  GLN 560           1HG      GLN 560 -14.330  -3.590  -0.143
  395   HE21  GLN 560          1HE2      GLN 560 -15.652  -2.473   1.062
  396   HE22  GLN 560          2HE2      GLN 560 -16.263  -2.925   2.614
  Start of MODEL    8
    1    H1   ALA 507           1HT      ALA 507 -10.848 -11.046  -6.700
    2    H2   ALA 507           2HT      ALA 507 -10.512 -12.729  -6.697
    3    H3   ALA 507           3HT      ALA 507 -10.871 -11.921  -5.227
    4    HA   ALA 507           HA       ALA 507 -12.705 -12.235  -7.505
    5    HB1  ALA 507           1HB      ALA 507 -12.743 -14.358  -6.715
    6    HB2  ALA 507           2HB      ALA 507 -13.842 -13.642  -5.537
    7    HB3  ALA 507           3HB      ALA 507 -12.148 -13.895  -5.122
    8    H    GLN 508           H        GLN 508 -12.417 -11.508  -4.024
    9    HA   GLN 508           HA       GLN 508 -13.852  -9.076  -4.230
   10    HB2  GLN 508           2HB      GLN 508 -15.878  -9.719  -2.992
   11    HB3  GLN 508           1HB      GLN 508 -15.772 -10.545  -4.540
   12    HG2  GLN 508           2HG      GLN 508 -15.441 -12.590  -3.588
   13    HG3  GLN 508           1HG      GLN 508 -14.690 -11.919  -2.141
   14   HE21  GLN 508          1HE2      GLN 508 -16.123 -10.777  -0.642
   15   HE22  GLN 508          2HE2      GLN 508 -17.745 -11.340  -0.455
   16    HA   PRO 509           HA       PRO 509 -11.369 -10.051  -0.332
   17    HB2  PRO 509           2HB      PRO 509  -9.288  -8.384  -0.794
   18    HB3  PRO 509           1HB      PRO 509  -9.317 -10.052  -1.375
   19    HG2  PRO 509           2HG      PRO 509  -9.931  -7.521  -2.853
   20    HG3  PRO 509           1HG      PRO 509  -8.987  -8.925  -3.383
   21    HD2  PRO 509           2HD      PRO 509 -11.563  -8.522  -4.130
   22    HD3  PRO 509           1HD      PRO 509 -10.864 -10.141  -3.928
   23    H    LYS 510           H        LYS 510 -10.740  -8.470   1.362
   24    HA   LYS 510           HA       LYS 510 -12.193  -5.921   1.088
   25    HB2  LYS 510           2HB      LYS 510 -11.998  -7.417   3.690
   26    HB3  LYS 510           1HB      LYS 510 -13.098  -6.117   3.254
   27    HG2  LYS 510           2HG      LYS 510 -14.631  -7.602   2.680
   28    HG3  LYS 510           1HG      LYS 510 -13.544  -8.263   1.457
   29    HD2  LYS 510           2HD      LYS 510 -12.473  -9.557   3.403
   30    HD3  LYS 510           1HD      LYS 510 -13.934  -9.139   4.302
   31    HE2  LYS 510           2HE      LYS 510 -14.387 -11.248   3.389
   32    HE3  LYS 510           1HE      LYS 510 -15.221 -10.115   2.325
   33    HZ1  LYS 510           3HZ      LYS 510 -12.596 -10.513   1.386
   34    HZ2  LYS 510           1HZ      LYS 510 -14.060 -10.886   0.623
   35    HZ3  LYS 510           2HZ      LYS 510 -13.318 -12.023   1.631
   36    H    CYS 511           H        CYS 511 -11.021  -4.162   1.526
   37    HA   CYS 511           HA       CYS 511  -9.293  -2.825   2.168
   38    HB2  CYS 511           2HB      CYS 511  -9.971  -4.408   4.414
   39    HB3  CYS 511           1HB      CYS 511  -8.213  -4.345   4.359
   40    H    ASN 512           H        ASN 512  -7.863  -3.015   0.500
   41    HA   ASN 512           HA       ASN 512  -6.023  -5.269   0.479
   42    HB2  ASN 512           2HB      ASN 512  -6.280  -3.106  -1.606
   43    HB3  ASN 512           1HB      ASN 512  -5.427  -4.635  -1.760
   44   HD21  ASN 512          1HD2      ASN 512  -8.631  -3.240  -1.247
   45   HD22  ASN 512          2HD2      ASN 512  -9.502  -4.521  -2.008
   46    HA   PRO 513           HA       PRO 513  -2.953  -1.752   1.090
   47    HB2  PRO 513           2HB      PRO 513  -3.688   0.768   0.455
   48    HB3  PRO 513           1HB      PRO 513  -3.296  -0.446  -0.766
   49    HG2  PRO 513           2HG      PRO 513  -5.871   0.756  -0.199
   50    HG3  PRO 513           1HG      PRO 513  -5.429  -0.344  -1.514
   51    HD2  PRO 513           2HD      PRO 513  -6.682  -0.949   1.096
   52    HD3  PRO 513           1HD      PRO 513  -6.740  -1.854  -0.429
   53    H    ASN 514           H        ASN 514  -5.573  -1.937   2.906
   54    HA   ASN 514           HA       ASN 514  -4.693   0.161   4.774
   55    HB2  ASN 514           2HB      ASN 514  -7.403  -0.565   3.815
   56    HB3  ASN 514           1HB      ASN 514  -7.258  -0.228   5.538
   57   HD21  ASN 514          1HD2      ASN 514  -7.285   1.072   2.364
   58   HD22  ASN 514          2HD2      ASN 514  -7.155   2.735   2.805
   59    H    LEU 515           H        LEU 515  -3.347  -1.979   5.048
   60    HA   LEU 515           HA       LEU 515  -4.658  -3.601   7.125
   61    HB2  LEU 515           2HB      LEU 515  -2.230  -4.689   5.875
   62    HB3  LEU 515           1HB      LEU 515  -3.720  -5.490   6.320
   63    HG   LEU 515           HG       LEU 515  -3.489  -5.698   3.971
   64   HD11  LEU 515          1HD1      LEU 515  -5.364  -3.755   3.378
   65   HD12  LEU 515          2HD1      LEU 515  -5.609  -4.080   5.092
   66   HD13  LEU 515          3HD1      LEU 515  -5.685  -5.398   3.926
   67   HD21  LEU 515          3HD2      LEU 515  -2.140  -3.255   4.132
   68   HD22  LEU 515          1HD2      LEU 515  -3.553  -2.947   3.122
   69   HD23  LEU 515          2HD2      LEU 515  -2.421  -4.230   2.690
   70    H    HIS 516           H        HIS 516  -1.457  -2.407   6.083
   71    HA   HIS 516           HA       HIS 516  -0.802  -1.296   8.573
   72    HB2  HIS 516           2HB      HIS 516   0.416  -2.883   9.695
   73    HB3  HIS 516           1HB      HIS 516  -0.773  -3.923   8.915
   74    HD1  HIS 516           1HD      HIS 516   0.055  -5.476   7.053
   75    HD2  HIS 516           2HD      HIS 516   2.984  -2.991   8.613
   76    HE1  HIS 516           1HE      HIS 516   2.199  -6.242   6.001
   77    HE2  HIS 516           2HE      HIS 516   3.972  -4.720   6.949
   78    H    TYR 517           H        TYR 517   0.856  -3.142   5.999
   79    HA   TYR 517           HA       TYR 517   3.206  -1.708   5.894
   80    HB2  TYR 517           2HB      TYR 517   2.563  -2.363   3.196
   81    HB3  TYR 517           1HB      TYR 517   3.731  -3.116   4.257
   82    HD1  TYR 517           1HD      TYR 517  -0.034  -3.288   4.472
   83    HD2  TYR 517           2HD      TYR 517   3.617  -5.330   3.668
   84    HE1  TYR 517           1HE      TYR 517  -1.258  -5.403   4.296
   85    HE2  TYR 517           2HE      TYR 517   2.392  -7.452   3.499
   86    HH   TYR 517           HH       TYR 517  -0.863  -7.783   4.480
   87    H    TRP 518           H        TRP 518   0.142  -0.552   5.041
   88    HA   TRP 518           HA       TRP 518   1.372   1.635   3.510
   89    HB2  TRP 518           2HB      TRP 518  -1.511   0.925   3.159
   90    HB3  TRP 518           1HB      TRP 518  -0.403   1.636   2.013
   91    HD1  TRP 518           HD       TRP 518   0.304  -1.709   3.743
   92    HE1  TRP 518           1HE      TRP 518   0.380  -3.521   1.995
   93    HE3  TRP 518           3HE      TRP 518  -1.205   1.016  -0.302
   94    HZ2  TRP 518           2HZ      TRP 518  -0.155  -3.833  -0.756
   95    HZ3  TRP 518           3HZ      TRP 518  -1.404  -0.134  -2.469
   96    HH2  TRP 518           HH       TRP 518  -0.886  -2.509  -2.692
   97    H    THR 519           H        THR 519  -1.220   0.672   5.660
   98    HA   THR 519           HA       THR 519  -2.124   3.294   6.274
   99    HB   THR 519           HB       THR 519  -3.574   1.369   6.551
  100    HG1  THR 519           1HG      THR 519  -4.379   1.900   8.536
  101   HG21  THR 519          3HG2      THR 519  -2.704   0.217   8.954
  102   HG22  THR 519          1HG2      THR 519  -1.308   0.239   7.874
  103   HG23  THR 519          2HG2      THR 519  -2.809  -0.534   7.362
  104    H    THR 520           H        THR 520   0.484   1.362   7.445
  105    HA   THR 520           HA       THR 520   0.698   2.763   9.957
  106    HB   THR 520           HB       THR 520   1.461   0.300   9.284
  107    HG1  THR 520           1HG      THR 520   2.945   1.855  11.119
  108   HG21  THR 520          3HG2      THR 520   3.921   0.154   9.241
  109   HG22  THR 520          1HG2      THR 520   3.993   1.892   8.950
  110   HG23  THR 520          2HG2      THR 520   3.239   0.829   7.762
  111    H    GLN 521           H        GLN 521   2.787   2.531   7.079
  112    HA   GLN 521           HA       GLN 521   4.088   4.996   7.941
  113    HB2  GLN 521           2HB      GLN 521   5.942   4.386   6.622
  114    HB3  GLN 521           1HB      GLN 521   5.414   2.904   7.407
  115    HG2  GLN 521           2HG      GLN 521   4.584   2.008   5.439
  116    HG3  GLN 521           1HG      GLN 521   4.503   3.576   4.645
  117   HE21  GLN 521          1HE2      GLN 521   6.588   4.646   4.173
  118   HE22  GLN 521          2HE2      GLN 521   7.937   3.649   3.759
  119    H    ASP 522           H        ASP 522   5.086   5.657   5.345
  120    HA   ASP 522           HA       ASP 522   2.663   6.883   4.250
  121    HB2  ASP 522           2HB      ASP 522   5.526   7.662   4.353
  122    HB3  ASP 522           1HB      ASP 522   4.538   8.268   3.030
  123    H    GLU 523           H        GLU 523   3.389   4.180   3.650
  124    HA   GLU 523           HA       GLU 523   3.775   2.732   1.912
  125    HB2  GLU 523           2HB      GLU 523   1.913   4.808   1.066
  126    HB3  GLU 523           1HB      GLU 523   2.728   4.037  -0.290
  127    HG2  GLU 523           2HG      GLU 523   2.014   1.862   0.505
  128    HG3  GLU 523           1HG      GLU 523   1.228   2.620   1.888
  129    H    GLY 524           H        GLY 524   6.091   3.231   2.143
  130    HA2  GLY 524           2HA      GLY 524   8.030   3.285   0.801
  131    HA3  GLY 524           1HA      GLY 524   7.139   4.218  -0.398
  132    H    ALA 525           H        ALA 525   6.033   5.932   1.793
  133    HA   ALA 525           HA       ALA 525   6.494   7.976   2.641
  134    HB1  ALA 525           1HB      ALA 525   9.225   7.400   3.455
  135    HB2  ALA 525           2HB      ALA 525   8.053   6.179   3.955
  136    HB3  ALA 525           3HB      ALA 525   7.826   7.863   4.427
  137    H    ALA 526           H        ALA 526   7.779   7.132  -0.131
  138    HA   ALA 526           HA       ALA 526   9.128   8.080  -1.694
  139    HB1  ALA 526           1HB      ALA 526   8.609  10.784  -0.604
  140    HB2  ALA 526           2HB      ALA 526   7.210   9.813  -1.063
  141    HB3  ALA 526           3HB      ALA 526   8.459  10.179  -2.254
  142    H    ILE 527           H        ILE 527  10.183   7.640   1.166
  143    HA   ILE 527           HA       ILE 527  12.070   9.524   1.859
  144    HB   ILE 527           HB       ILE 527  13.405   7.316   2.569
  145   HG12  ILE 527          2HG1      ILE 527  11.955   5.469   3.055
  146   HG13  ILE 527          1HG1      ILE 527  10.544   6.361   2.502
  147   HG21  ILE 527          1HG2      ILE 527  11.036   7.720   4.236
  148   HG22  ILE 527          2HG2      ILE 527  11.910   9.193   3.818
  149   HG23  ILE 527          3HG2      ILE 527  12.747   7.873   4.634
  150   HD11  ILE 527          3HD1      ILE 527  11.632   4.550   0.995
  151   HD12  ILE 527          1HD1      ILE 527  12.782   5.830   0.610
  152   HD13  ILE 527          2HD1      ILE 527  11.064   6.061   0.286
  153    H    GLY 528           H        GLY 528  12.105   7.332  -0.818
  154    HA2  GLY 528           2HA      GLY 528  13.976   8.552  -2.336
  155    HA3  GLY 528           1HA      GLY 528  14.960   7.574  -1.262
  156    H    LEU 529           H        LEU 529  13.677   5.249  -1.066
  157    HA   LEU 529           HA       LEU 529  13.133   3.281  -2.071
  158    HB2  LEU 529           2HB      LEU 529  12.596   5.050  -4.435
  159    HB3  LEU 529           1HB      LEU 529  12.387   3.314  -4.477
  160    HG   LEU 529           HG       LEU 529  10.611   3.400  -2.889
  161   HD11  LEU 529          1HD1      LEU 529   9.867   5.555  -1.907
  162   HD12  LEU 529          2HD1      LEU 529  11.326   6.305  -2.558
  163   HD13  LEU 529          3HD1      LEU 529  11.455   5.026  -1.352
  164   HD21  LEU 529          3HD2      LEU 529   9.144   5.252  -4.027
  165   HD22  LEU 529          1HD2      LEU 529   9.646   3.820  -4.925
  166   HD23  LEU 529          2HD2      LEU 529  10.506   5.344  -5.143
  167    H    ALA 530           H        ALA 530  15.531   5.352  -3.351
  168    HA   ALA 530           HA       ALA 530  16.732   3.338  -5.000
  169    HB1  ALA 530           1HB      ALA 530  16.927   5.758  -5.514
  170    HB2  ALA 530           2HB      ALA 530  18.486   4.938  -5.423
  171    HB3  ALA 530           3HB      ALA 530  17.938   5.944  -4.082
  172    H    TRP 531           H        TRP 531  16.947   4.377  -1.747
  173    HA   TRP 531           HA       TRP 531  19.476   3.410  -1.011
  174    HB2  TRP 531           2HB      TRP 531  18.561   3.476   1.296
  175    HB3  TRP 531           1HB      TRP 531  18.186   4.943   0.398
  176    HD1  TRP 531           HD       TRP 531  15.614   4.654  -0.926
  177    HE1  TRP 531           1HE      TRP 531  13.447   3.969   0.216
  178    HE3  TRP 531           3HE      TRP 531  17.564   2.360   3.204
  179    HZ2  TRP 531           2HZ      TRP 531  12.625   2.646   2.572
  180    HZ3  TRP 531           3HZ      TRP 531  16.010   1.413   4.862
  181    HH2  TRP 531           HH       TRP 531  13.592   1.554   4.552
  182    H    ILE 532           H        ILE 532  16.598   1.803  -1.860
  183    HA   ILE 532           HA       ILE 532  17.628  -0.717  -0.790
  184    HB   ILE 532           HB       ILE 532  15.199  -1.404  -0.697
  185   HG12  ILE 532          2HG1      ILE 532  14.916   1.545  -1.222
  186   HG13  ILE 532          1HG1      ILE 532  14.061   0.212  -1.982
  187   HG21  ILE 532          1HG2      ILE 532  16.234   0.786   1.093
  188   HG22  ILE 532          2HG2      ILE 532  16.484  -0.951   1.292
  189   HG23  ILE 532          3HG2      ILE 532  14.871  -0.265   1.489
  190   HD11  ILE 532          3HD1      ILE 532  12.394   0.426  -0.547
  191   HD12  ILE 532          1HD1      ILE 532  13.199   1.846   0.115
  192   HD13  ILE 532          2HD1      ILE 532  13.489   0.256   0.824
  193    HA   PRO 533           HA       PRO 533  17.377  -1.879  -5.078
  194    HB2  PRO 533           2HB      PRO 533  18.150  -4.553  -4.488
  195    HB3  PRO 533           1HB      PRO 533  19.180  -3.224  -5.016
  196    HG2  PRO 533           2HG      PRO 533  19.269  -4.445  -2.519
  197    HG3  PRO 533           1HG      PRO 533  19.961  -2.864  -2.919
  198    HD2  PRO 533           2HD      PRO 533  17.391  -3.524  -1.552
  199    HD3  PRO 533           1HD      PRO 533  18.510  -2.172  -1.274
  200    H    TYR 534           H        TYR 534  15.561  -3.569  -2.602
  201    HA   TYR 534           HA       TYR 534  13.656  -4.357  -4.667
  202    HB2  TYR 534           2HB      TYR 534  13.488  -6.659  -3.814
  203    HB3  TYR 534           1HB      TYR 534  15.084  -6.304  -4.465
  204    HD1  TYR 534           1HD      TYR 534  13.235  -6.310  -1.220
  205    HD2  TYR 534           2HD      TYR 534  16.949  -6.874  -3.217
  206    HE1  TYR 534           1HE      TYR 534  14.251  -7.055   0.892
  207    HE2  TYR 534           2HE      TYR 534  17.975  -7.620  -1.111
  208    HH   TYR 534           HH       TYR 534  17.350  -7.126   1.519
  209    H    PHE 535           H        PHE 535  14.015  -2.789  -1.863
  210    HA   PHE 535           HA       PHE 535  11.687  -3.866  -0.496
  211    HB2  PHE 535           2HB      PHE 535  13.440  -1.495   0.133
  212    HB3  PHE 535           1HB      PHE 535  12.116  -2.042   1.146
  213    HD1  PHE 535           2HD      PHE 535  15.246  -3.311  -0.424
  214    HD2  PHE 535           1HD      PHE 535  12.588  -3.443   2.893
  215    HE1  PHE 535           2HE      PHE 535  16.801  -4.798   0.756
  216    HE2  PHE 535           1HE      PHE 535  14.139  -4.930   4.081
  217    HZ   PHE 535           HZ       PHE 535  16.251  -5.616   3.013
  218    H    GLY 536           H        GLY 536  12.623  -0.996  -2.302
  219    HA2  GLY 536           2HA      GLY 536   9.824  -0.072  -2.229
  220    HA3  GLY 536           1HA      GLY 536  11.213   0.970  -2.486
  221    HA   PRO 537           HA       PRO 537  11.206   0.616  -6.880
  222    HB2  PRO 537           2HB      PRO 537  13.523  -1.251  -6.914
  223    HB3  PRO 537           1HB      PRO 537  13.310   0.293  -7.747
  224    HG2  PRO 537           2HG      PRO 537  14.897   0.090  -5.609
  225    HG3  PRO 537           1HG      PRO 537  13.902   1.532  -5.880
  226    HD2  PRO 537           2HD      PRO 537  13.503  -0.723  -3.972
  227    HD3  PRO 537           1HD      PRO 537  13.132   1.002  -3.775
  228    H    ALA 538           H        ALA 538  11.857  -2.459  -5.273
  229    HA   ALA 538           HA       ALA 538  10.480  -3.941  -7.380
  230    HB1  ALA 538           1HB      ALA 538  11.287  -5.927  -6.305
  231    HB2  ALA 538           2HB      ALA 538  11.789  -5.010  -4.884
  232    HB3  ALA 538           3HB      ALA 538  12.619  -4.778  -6.423
  233    H    ALA 539           H        ALA 539   9.836  -2.551  -4.326
  234    HA   ALA 539           HA       ALA 539   8.018  -4.206  -3.120
  235    HB1  ALA 539           1HB      ALA 539   8.760  -1.488  -2.928
  236    HB2  ALA 539           2HB      ALA 539   7.901  -2.472  -1.746
  237    HB3  ALA 539           3HB      ALA 539   6.998  -1.551  -2.948
  238    H    GLU 540           H        GLU 540   6.756  -1.402  -4.881
  239    HA   GLU 540           HA       GLU 540   5.096  -1.162  -6.408
  240    HB2  GLU 540           2HB      GLU 540   4.921  -4.160  -6.517
  241    HB3  GLU 540           1HB      GLU 540   4.312  -3.017  -7.701
  242    HG2  GLU 540           2HG      GLU 540   6.725  -2.291  -8.007
  243    HG3  GLU 540           1HG      GLU 540   7.155  -3.739  -7.099
  244    H    GLY 541           H        GLY 541   4.489  -3.752  -4.049
  245    HA2  GLY 541           2HA      GLY 541   1.735  -2.729  -3.778
  246    HA3  GLY 541           1HA      GLY 541   2.233  -4.370  -3.392
  247    H    ILE 542           H        ILE 542   4.031  -1.500  -2.491
  248    HA   ILE 542           HA       ILE 542   3.033  -1.577   0.237
  249    HB   ILE 542           HB       ILE 542   5.996  -1.697  -0.038
  250   HG12  ILE 542          2HG1      ILE 542   5.801  -4.223   0.362
  251   HG13  ILE 542          1HG1      ILE 542   4.157  -4.076  -0.247
  252   HG21  ILE 542          1HG2      ILE 542   5.975  -2.170   2.188
  253   HG22  ILE 542          2HG2      ILE 542   4.462  -3.072   2.096
  254   HG23  ILE 542          3HG2      ILE 542   4.440  -1.309   2.073
  255   HD11  ILE 542          3HD1      ILE 542   5.644  -2.781  -2.160
  256   HD12  ILE 542          1HD1      ILE 542   5.045  -4.438  -2.253
  257   HD13  ILE 542          2HD1      ILE 542   6.682  -4.123  -1.676
  258    H    TYR 543           H        TYR 543   5.114  -0.198  -2.223
  259    HA   TYR 543           HA       TYR 543   5.390   2.264  -0.726
  260    HB2  TYR 543           2HB      TYR 543   7.318   2.543  -1.865
  261    HB3  TYR 543           1HB      TYR 543   7.163   0.825  -2.161
  262    HD1  TYR 543           2HD      TYR 543   5.751   0.218  -4.314
  263    HD2  TYR 543           1HD      TYR 543   7.724   3.926  -3.665
  264    HE1  TYR 543           2HE      TYR 543   5.779   0.621  -6.736
  265    HE2  TYR 543           1HE      TYR 543   7.765   4.340  -6.085
  266    HH   TYR 543           HH       TYR 543   7.110   1.949  -8.371
  267    H    ILE 544           H        ILE 544   4.015   0.992  -3.696
  268    HA   ILE 544           HA       ILE 544   2.793   1.935  -5.389
  269    HB   ILE 544           HB       ILE 544   1.274   3.142  -3.094
  270   HG12  ILE 544          2HG1      ILE 544   0.021   0.971  -3.072
  271   HG13  ILE 544          1HG1      ILE 544   1.283   0.293  -4.095
  272   HG21  ILE 544          1HG2      ILE 544   0.294   3.862  -5.068
  273   HG22  ILE 544          2HG2      ILE 544  -0.644   2.425  -4.663
  274   HG23  ILE 544          3HG2      ILE 544   0.613   2.340  -5.897
  275   HD11  ILE 544          3HD1      ILE 544   2.160   1.590  -1.594
  276   HD12  ILE 544          1HD1      ILE 544   2.753   0.134  -2.393
  277   HD13  ILE 544          2HD1      ILE 544   1.272   0.074  -1.440
  278    H    GLU 545           H        GLU 545   2.495   4.488  -2.974
  279    HA   GLU 545           HA       GLU 545   2.872   6.723  -3.025
  280    HB2  GLU 545           2HB      GLU 545   4.674   6.197  -5.385
  281    HB3  GLU 545           1HB      GLU 545   4.734   7.559  -4.269
  282    HG2  GLU 545           2HG      GLU 545   5.144   5.834  -2.451
  283    HG3  GLU 545           1HG      GLU 545   5.460   4.698  -3.760
  284    H    GLY 546           H        GLY 546   0.742   7.100  -3.593
  285    HA2  GLY 546           2HA      GLY 546   0.164   8.850  -5.565
  286    HA3  GLY 546           1HA      GLY 546  -0.042   7.297  -6.363
  287    H    LEU 547           H        LEU 547  -0.865   6.290  -3.532
  288    HA   LEU 547           HA       LEU 547  -3.599   7.402  -3.563
  289    HB2  LEU 547           2HB      LEU 547  -4.602   5.317  -3.521
  290    HB3  LEU 547           1HB      LEU 547  -3.291   5.099  -4.664
  291    HG   LEU 547           HG       LEU 547  -3.297   4.195  -1.782
  292   HD11  LEU 547          1HD1      LEU 547  -4.594   3.014  -3.822
  293   HD12  LEU 547          2HD1      LEU 547  -3.868   2.130  -2.480
  294   HD13  LEU 547          3HD1      LEU 547  -2.999   2.286  -4.007
  295   HD21  LEU 547          3HD2      LEU 547  -1.173   4.384  -3.841
  296   HD22  LEU 547          1HD2      LEU 547  -1.208   2.937  -2.834
  297   HD23  LEU 547          2HD2      LEU 547  -1.070   4.529  -2.087
  298    H    MET 548           H        MET 548  -0.882   6.579  -1.746
  299    HA   MET 548           HA       MET 548  -2.098   5.985   0.736
  300    HB2  MET 548           2HB      MET 548   0.256   6.805   1.603
  301    HB3  MET 548           1HB      MET 548   0.072   5.268   0.783
  302    HG2  MET 548           2HG      MET 548   2.025   6.308  -0.056
  303    HG3  MET 548           1HG      MET 548   0.819   6.390  -1.327
  304    HE1  MET 548           3HE      MET 548   1.328   8.828  -2.796
  305    HE2  MET 548           1HE      MET 548   0.217   9.947  -2.006
  306    HE3  MET 548           2HE      MET 548  -0.234   8.255  -2.212
  307    H    HIS 549           H        HIS 549  -3.711   7.771   0.491
  308    HA   HIS 549           HA       HIS 549  -2.658  10.234   1.722
  309    HB2  HIS 549           2HB      HIS 549  -5.226  10.271   0.203
  310    HB3  HIS 549           1HB      HIS 549  -4.044  11.553   0.434
  311    HD1  HIS 549           1HD      HIS 549  -5.365  10.203  -2.287
  312    HD2  HIS 549           2HD      HIS 549  -1.451  10.033  -0.907
  313    HE1  HIS 549           1HE      HIS 549  -3.963   9.705  -4.311
  314    HE2  HIS 549           2HE      HIS 549  -1.585   9.763  -3.476
  315    H    ASN 550           H        ASN 550  -5.615   8.289   1.361
  316    HA   ASN 550           HA       ASN 550  -6.076   7.956   4.096
  317    HB2  ASN 550           2HB      ASN 550  -6.476  10.398   4.072
  318    HB3  ASN 550           1HB      ASN 550  -7.736  10.167   2.864
  319   HD21  ASN 550          1HD2      ASN 550  -6.785   9.090   6.100
  320   HD22  ASN 550          2HD2      ASN 550  -8.390   9.006   6.732
  321    H    GLN 551           H        GLN 551  -7.976   8.742   1.197
  322    HA   GLN 551           HA       GLN 551  -9.972   7.769   0.500
  323    HB2  GLN 551           2HB      GLN 551  -9.155   5.330  -0.343
  324    HB3  GLN 551           1HB      GLN 551  -8.835   6.831  -1.190
  325    HG2  GLN 551           2HG      GLN 551  -6.659   6.495  -1.015
  326    HG3  GLN 551           1HG      GLN 551  -6.777   6.436   0.739
  327   HE21  GLN 551          1HE2      GLN 551  -6.584   4.525   1.767
  328   HE22  GLN 551          2HE2      GLN 551  -6.347   3.008   0.977
  329    H    ASP 552           H        ASP 552  -8.702   4.674   1.469
  330    HA   ASP 552           HA       ASP 552  -9.500   3.030   2.818
  331    HB2  ASP 552           2HB      ASP 552 -10.202   5.510   4.286
  332    HB3  ASP 552           1HB      ASP 552 -11.050   4.047   4.776
  333    H    GLY 553           H        GLY 553 -11.159   4.392   0.593
  334    HA2  GLY 553           2HA      GLY 553 -13.682   3.011   1.257
  335    HA3  GLY 553           1HA      GLY 553 -13.667   4.561   0.427
  336    H    LEU 554           H        LEU 554 -11.280   3.821  -1.126
  337    HA   LEU 554           HA       LEU 554 -12.630   2.516  -3.310
  338    HB2  LEU 554           2HB      LEU 554 -10.548   2.966  -4.529
  339    HB3  LEU 554           1HB      LEU 554 -11.183   4.400  -3.746
  340    HG   LEU 554           HG       LEU 554  -9.440   3.440  -1.843
  341   HD11  LEU 554          1HD1      LEU 554  -7.586   2.494  -2.748
  342   HD12  LEU 554          2HD1      LEU 554  -7.800   3.288  -4.308
  343   HD13  LEU 554          3HD1      LEU 554  -8.774   1.877  -3.895
  344   HD21  LEU 554          3HD2      LEU 554  -8.795   5.375  -4.070
  345   HD22  LEU 554          1HD2      LEU 554  -8.034   5.300  -2.481
  346   HD23  LEU 554          2HD2      LEU 554  -9.728   5.766  -2.626
  347    H    ILE 555           H        ILE 555 -11.219   1.319  -0.638
  348    HA   ILE 555           HA       ILE 555 -10.515  -1.193  -1.950
  349    HB   ILE 555           HB       ILE 555  -8.563  -1.464  -0.465
  350   HG12  ILE 555          2HG1      ILE 555  -9.227   0.110   1.308
  351   HG13  ILE 555          1HG1      ILE 555  -7.622   0.462   0.700
  352   HG21  ILE 555          1HG2      ILE 555  -7.408  -0.799  -2.227
  353   HG22  ILE 555          2HG2      ILE 555  -7.534   0.872  -1.672
  354   HG23  ILE 555          3HG2      ILE 555  -8.759   0.208  -2.754
  355   HD11  ILE 555          3HD1      ILE 555 -10.014   2.101   0.681
  356   HD12  ILE 555          1HD1      ILE 555  -9.162   2.056  -0.860
  357   HD13  ILE 555          2HD1      ILE 555  -8.315   2.558   0.600
  358    H    CYS 556           H        CYS 556 -11.118   0.542   1.063
  359    HA   CYS 556           HA       CYS 556 -12.070  -1.946   2.268
  360    HB2  CYS 556           2HB      CYS 556 -10.283  -0.133   3.254
  361    HB3  CYS 556           1HB      CYS 556 -11.782   0.424   3.993
  362    H    GLY 557           H        GLY 557 -14.175  -2.104   1.655
  363    HA2  GLY 557           2HA      GLY 557 -15.955   0.038   2.612
  364    HA3  GLY 557           1HA      GLY 557 -16.147  -0.592   0.982
  365    H    LEU 558           H        LEU 558 -16.408  -3.042   0.877
  366    HA   LEU 558           HA       LEU 558 -17.816  -4.091   3.214
  367    HB2  LEU 558           2HB      LEU 558 -19.682  -4.860   1.877
  368    HB3  LEU 558           1HB      LEU 558 -19.523  -3.120   1.759
  369    HG   LEU 558           HG       LEU 558 -18.554  -5.057  -0.343
  370   HD11  LEU 558          1HD1      LEU 558 -20.534  -4.939  -1.408
  371   HD12  LEU 558          2HD1      LEU 558 -20.846  -3.287  -0.874
  372   HD13  LEU 558          3HD1      LEU 558 -21.147  -4.639   0.218
  373   HD21  LEU 558          3HD2      LEU 558 -18.910  -2.638  -1.539
  374   HD22  LEU 558          1HD2      LEU 558 -17.366  -3.249  -0.946
  375   HD23  LEU 558          2HD2      LEU 558 -18.326  -2.161   0.055
  376    H    ARG 559           H        ARG 559 -16.619  -4.833  -0.063
  377    HA   ARG 559           HA       ARG 559 -14.985  -6.945   0.714
  378    HB2  ARG 559           2HB      ARG 559 -16.269  -8.903   0.023
  379    HB3  ARG 559           1HB      ARG 559 -17.098  -8.063   1.327
  380    HG2  ARG 559           2HG      ARG 559 -17.898  -7.110  -1.292
  381    HG3  ARG 559           1HG      ARG 559 -18.200  -8.838  -1.075
  382    HD2  ARG 559           2HD      ARG 559 -19.110  -6.635   0.777
  383    HD3  ARG 559           1HD      ARG 559 -20.124  -7.479  -0.393
  384    HE   ARG 559           HE       ARG 559 -18.826  -9.222   1.491
  385   HH11  ARG 559          1HH1      ARG 559 -21.623  -7.221   0.897
  386   HH12  ARG 559          2HH1      ARG 559 -22.628  -8.078   2.017
  387   HH21  ARG 559          1HH2      ARG 559 -20.146 -10.349   2.964
  388   HH22  ARG 559          2HH2      ARG 559 -21.790  -9.854   3.191
  389    H    GLN 560           H        GLN 560 -14.956  -4.816  -1.104
  390    HA   GLN 560           HA       GLN 560 -14.947  -6.141  -3.718
  391    HB2  GLN 560           2HB      GLN 560 -15.159  -4.045  -4.737
  392    HB3  GLN 560           1HB      GLN 560 -16.198  -3.944  -3.325
  393    HG2  GLN 560           2HG      GLN 560 -13.438  -3.013  -2.915
  394    HG3  GLN 560           1HG      GLN 560 -14.401  -2.064  -4.045
  395   HE21  GLN 560          1HE2      GLN 560 -14.136  -3.206  -0.761
  396   HE22  GLN 560          2HE2      GLN 560 -15.217  -2.053  -0.068
  Start of MODEL    9
    1    H1   ALA 507           1HT      ALA 507  -8.202  -8.709  -5.649
    2    H2   ALA 507           2HT      ALA 507  -7.550 -10.049  -6.501
    3    H3   ALA 507           3HT      ALA 507  -8.283 -10.278  -4.966
    4    HA   ALA 507           HA       ALA 507  -9.492  -9.738  -7.562
    5    HB1  ALA 507           1HB      ALA 507 -11.048 -11.510  -6.711
    6    HB2  ALA 507           2HB      ALA 507  -9.986 -11.678  -5.312
    7    HB3  ALA 507           3HB      ALA 507  -9.376 -12.029  -6.930
    8    H    GLN 508           H        GLN 508 -10.820 -10.142  -4.292
    9    HA   GLN 508           HA       GLN 508 -11.973  -7.494  -4.317
   10    HB2  GLN 508           2HB      GLN 508 -14.309  -8.434  -3.988
   11    HB3  GLN 508           1HB      GLN 508 -13.664  -8.509  -5.622
   12    HG2  GLN 508           2HG      GLN 508 -14.370 -10.627  -5.556
   13    HG3  GLN 508           1HG      GLN 508 -12.880 -10.911  -4.659
   14   HE21  GLN 508          1HE2      GLN 508 -16.215  -9.838  -4.092
   15   HE22  GLN 508          2HE2      GLN 508 -16.433 -10.727  -2.627
   16    HA   PRO 509           HA       PRO 509 -11.331  -9.515  -0.123
   17    HB2  PRO 509           2HB      PRO 509  -8.939  -8.574   0.590
   18    HB3  PRO 509           1HB      PRO 509  -9.081  -9.980  -0.474
   19    HG2  PRO 509           2HG      PRO 509  -8.490  -7.131  -1.170
   20    HG3  PRO 509           1HG      PRO 509  -7.753  -8.614  -1.803
   21    HD2  PRO 509           2HD      PRO 509  -9.749  -7.187  -3.074
   22    HD3  PRO 509           1HD      PRO 509  -9.403  -8.905  -3.351
   23    H    LYS 510           H        LYS 510 -11.596  -8.486   1.885
   24    HA   LYS 510           HA       LYS 510 -12.648  -5.838   1.778
   25    HB2  LYS 510           2HB      LYS 510 -11.969  -7.492   4.216
   26    HB3  LYS 510           1HB      LYS 510 -13.035  -6.095   4.165
   27    HG2  LYS 510           2HG      LYS 510 -14.697  -7.550   3.930
   28    HG3  LYS 510           1HG      LYS 510 -14.122  -7.777   2.278
   29    HD2  LYS 510           2HD      LYS 510 -12.551  -9.542   3.264
   30    HD3  LYS 510           1HD      LYS 510 -13.560  -9.452   4.708
   31    HE2  LYS 510           2HE      LYS 510 -15.478  -9.739   2.873
   32    HE3  LYS 510           1HE      LYS 510 -14.164 -10.556   2.027
   33    HZ1  LYS 510           3HZ      LYS 510 -15.152 -12.241   3.233
   34    HZ2  LYS 510           1HZ      LYS 510 -15.436 -11.269   4.588
   35    HZ3  LYS 510           2HZ      LYS 510 -13.867 -11.796   4.239
   36    H    CYS 511           H        CYS 511 -11.445  -4.061   1.683
   37    HA   CYS 511           HA       CYS 511  -9.778  -2.552   2.031
   38    HB2  CYS 511           2HB      CYS 511  -9.007  -4.095   4.501
   39    HB3  CYS 511           1HB      CYS 511  -8.863  -2.367   4.203
   40    H    ASN 512           H        ASN 512  -8.251  -2.738   0.527
   41    HA   ASN 512           HA       ASN 512  -6.489  -5.032   0.507
   42    HB2  ASN 512           2HB      ASN 512  -6.487  -2.777  -1.485
   43    HB3  ASN 512           1HB      ASN 512  -5.839  -4.398  -1.684
   44   HD21  ASN 512          1HD2      ASN 512  -8.878  -2.670  -1.083
   45   HD22  ASN 512          2HD2      ASN 512  -9.876  -3.778  -1.952
   46    HA   PRO 513           HA       PRO 513  -3.296  -1.698   1.404
   47    HB2  PRO 513           2HB      PRO 513  -3.845   0.858   0.785
   48    HB3  PRO 513           1HB      PRO 513  -3.515  -0.357  -0.452
   49    HG2  PRO 513           2HG      PRO 513  -6.020   0.995   0.124
   50    HG3  PRO 513           1HG      PRO 513  -5.609  -0.044  -1.246
   51    HD2  PRO 513           2HD      PRO 513  -6.982  -0.732   1.273
   52    HD3  PRO 513           1HD      PRO 513  -7.006  -1.562  -0.293
   53    H    ASN 514           H        ASN 514  -5.907  -1.924   3.118
   54    HA   ASN 514           HA       ASN 514  -5.193   0.198   5.030
   55    HB2  ASN 514           2HB      ASN 514  -7.801  -0.705   4.012
   56    HB3  ASN 514           1HB      ASN 514  -7.725  -0.585   5.769
   57   HD21  ASN 514          1HD2      ASN 514  -7.374   1.176   2.758
   58   HD22  ASN 514          2HD2      ASN 514  -7.587   2.748   3.437
   59    H    LEU 515           H        LEU 515  -3.673  -1.912   5.114
   60    HA   LEU 515           HA       LEU 515  -4.753  -3.693   7.182
   61    HB2  LEU 515           2HB      LEU 515  -2.191  -4.355   5.875
   62    HB3  LEU 515           1HB      LEU 515  -3.511  -5.400   6.351
   63    HG   LEU 515           HG       LEU 515  -3.426  -5.564   4.019
   64   HD11  LEU 515          1HD1      LEU 515  -5.447  -3.712   3.509
   65   HD12  LEU 515          2HD1      LEU 515  -5.636  -4.153   5.204
   66   HD13  LEU 515          3HD1      LEU 515  -5.633  -5.404   3.964
   67   HD21  LEU 515          3HD2      LEU 515  -2.268  -3.012   4.135
   68   HD22  LEU 515          1HD2      LEU 515  -3.712  -2.848   3.135
   69   HD23  LEU 515          2HD2      LEU 515  -2.478  -4.036   2.714
   70    H    HIS 516           H        HIS 516  -1.656  -2.160   6.254
   71    HA   HIS 516           HA       HIS 516  -1.217  -1.014   8.785
   72    HB2  HIS 516           2HB      HIS 516   0.165  -2.470   9.909
   73    HB3  HIS 516           1HB      HIS 516  -0.927  -3.605   9.123
   74    HD1  HIS 516           1HD      HIS 516   0.038  -5.050   7.221
   75    HD2  HIS 516           2HD      HIS 516   2.763  -2.421   8.911
   76    HE1  HIS 516           1HE      HIS 516   2.263  -5.685   6.248
   77    HE2  HIS 516           2HE      HIS 516   3.904  -4.063   7.263
   78    H    TYR 517           H        TYR 517   0.721  -2.615   6.250
   79    HA   TYR 517           HA       TYR 517   2.870  -0.877   6.267
   80    HB2  TYR 517           2HB      TYR 517   2.629  -1.649   3.579
   81    HB3  TYR 517           1HB      TYR 517   3.669  -2.334   4.807
   82    HD1  TYR 517           1HD      TYR 517  -0.066  -2.765   4.670
   83    HD2  TYR 517           2HD      TYR 517   3.765  -4.517   4.028
   84    HE1  TYR 517           1HE      TYR 517  -1.121  -4.951   4.336
   85    HE2  TYR 517           2HE      TYR 517   2.707  -6.709   3.699
   86    HH   TYR 517           HH       TYR 517  -0.237  -7.233   2.929
   87    H    TRP 518           H        TRP 518  -0.267  -0.185   5.138
   88    HA   TRP 518           HA       TRP 518   0.797   2.127   3.650
   89    HB2  TRP 518           2HB      TRP 518  -1.949   1.092   3.115
   90    HB3  TRP 518           1HB      TRP 518  -0.843   1.910   2.041
   91    HD1  TRP 518           HD       TRP 518   0.305  -1.245   3.832
   92    HE1  TRP 518           1HE      TRP 518   0.592  -3.095   2.140
   93    HE3  TRP 518           3HE      TRP 518  -1.677   1.093  -0.246
   94    HZ2  TRP 518           2HZ      TRP 518   0.023  -3.576  -0.578
   95    HZ3  TRP 518           3HZ      TRP 518  -1.771  -0.149  -2.369
   96    HH2  TRP 518           HH       TRP 518  -0.931  -2.435  -2.533
   97    H    THR 519           H        THR 519  -1.479   0.972   5.985
   98    HA   THR 519           HA       THR 519  -2.918   3.438   6.253
   99    HB   THR 519           HB       THR 519  -4.080   1.420   6.791
  100    HG1  THR 519           1HG      THR 519  -4.672   3.064   8.164
  101   HG21  THR 519          3HG2      THR 519  -1.618   0.606   7.942
  102   HG22  THR 519          1HG2      THR 519  -3.083  -0.340   7.670
  103   HG23  THR 519          2HG2      THR 519  -2.870   0.537   9.185
  104    H    THR 520           H        THR 520   0.004   2.162   7.506
  105    HA   THR 520           HA       THR 520   0.026   4.008   9.767
  106    HB   THR 520           HB       THR 520   1.437   1.537   9.061
  107    HG1  THR 520           1HG      THR 520   1.470   1.386  11.336
  108   HG21  THR 520          3HG2      THR 520   3.003   3.825  10.196
  109   HG22  THR 520          1HG2      THR 520   3.459   2.691   8.923
  110   HG23  THR 520          2HG2      THR 520   3.379   2.151  10.603
  111    H    GLN 521           H        GLN 521   2.430   3.122   7.304
  112    HA   GLN 521           HA       GLN 521   3.378   5.882   7.356
  113    HB2  GLN 521           2HB      GLN 521   5.452   5.090   6.576
  114    HB3  GLN 521           1HB      GLN 521   4.919   3.911   7.765
  115    HG2  GLN 521           2HG      GLN 521   4.501   2.294   6.172
  116    HG3  GLN 521           1HG      GLN 521   4.376   3.468   4.866
  117   HE21  GLN 521          1HE2      GLN 521   6.427   4.724   4.435
  118   HE22  GLN 521          2HE2      GLN 521   7.907   3.834   4.471
  119    H    ASP 522           H        ASP 522   4.733   5.697   4.838
  120    HA   ASP 522           HA       ASP 522   2.468   6.281   3.088
  121    HB2  ASP 522           2HB      ASP 522   4.752   7.671   3.611
  122    HB3  ASP 522           1HB      ASP 522   5.167   6.847   2.115
  123    H    GLU 523           H        GLU 523   3.181   3.571   3.600
  124    HA   GLU 523           HA       GLU 523   3.522   1.583   2.529
  125    HB2  GLU 523           2HB      GLU 523   3.015   3.242   0.056
  126    HB3  GLU 523           1HB      GLU 523   2.906   1.487   0.171
  127    HG2  GLU 523           2HG      GLU 523   1.113   1.685   1.766
  128    HG3  GLU 523           1HG      GLU 523   1.231   3.440   1.706
  129    H    GLY 524           H        GLY 524   5.736   3.231   3.112
  130    HA2  GLY 524           2HA      GLY 524   8.031   2.953   2.835
  131    HA3  GLY 524           1HA      GLY 524   7.702   1.937   1.439
  132    H    ALA 525           H        ALA 525   6.368   5.155   1.858
  133    HA   ALA 525           HA       ALA 525   8.081   6.027  -0.364
  134    HB1  ALA 525           1HB      ALA 525   5.257   6.886   0.207
  135    HB2  ALA 525           2HB      ALA 525   5.762   5.761  -1.052
  136    HB3  ALA 525           3HB      ALA 525   6.262   7.450  -1.127
  137    H    ALA 526           H        ALA 526   7.744   6.470   2.840
  138    HA   ALA 526           HA       ALA 526   8.047   9.327   2.826
  139    HB1  ALA 526           1HB      ALA 526   8.370   8.715   5.410
  140    HB2  ALA 526           2HB      ALA 526   7.467   7.297   4.878
  141    HB3  ALA 526           3HB      ALA 526   6.788   8.909   4.655
  142    H    ILE 527           H        ILE 527  10.075   7.313   1.790
  143    HA   ILE 527           HA       ILE 527  12.367   8.305   3.337
  144    HB   ILE 527           HB       ILE 527  12.983   5.884   1.889
  145   HG12  ILE 527          2HG1      ILE 527  11.630   4.429   3.532
  146   HG13  ILE 527          1HG1      ILE 527  10.613   5.839   3.751
  147   HG21  ILE 527          1HG2      ILE 527  14.483   6.314   3.536
  148   HG22  ILE 527          2HG2      ILE 527  13.404   5.249   4.437
  149   HG23  ILE 527          3HG2      ILE 527  13.269   6.998   4.617
  150   HD11  ILE 527          3HD1      ILE 527   9.531   5.432   1.872
  151   HD12  ILE 527          1HD1      ILE 527  10.367   3.881   1.812
  152   HD13  ILE 527          2HD1      ILE 527  11.031   5.273   0.959
  153    H    GLY 528           H        GLY 528  11.469   6.977   0.114
  154    HA2  GLY 528           2HA      GLY 528  12.139   8.929  -1.551
  155    HA3  GLY 528           1HA      GLY 528  13.735   8.396  -1.053
  156    H    LEU 529           H        LEU 529  12.463   5.593  -0.839
  157    HA   LEU 529           HA       LEU 529  12.163   3.736  -2.126
  158    HB2  LEU 529           2HB      LEU 529  11.600   5.833  -4.180
  159    HB3  LEU 529           1HB      LEU 529  11.678   4.140  -4.624
  160    HG   LEU 529           HG       LEU 529   9.818   3.618  -3.193
  161   HD11  LEU 529          1HD1      LEU 529   8.665   5.750  -2.163
  162   HD12  LEU 529          2HD1      LEU 529  10.320   6.361  -2.166
  163   HD13  LEU 529          3HD1      LEU 529   9.930   4.880  -1.293
  164   HD21  LEU 529          3HD2      LEU 529   8.625   6.017  -4.325
  165   HD22  LEU 529          1HD2      LEU 529   8.335   4.321  -4.708
  166   HD23  LEU 529          2HD2      LEU 529   9.676   5.177  -5.466
  167    H    ALA 530           H        ALA 530  14.444   6.125  -3.079
  168    HA   ALA 530           HA       ALA 530  15.905   4.361  -4.800
  169    HB1  ALA 530           1HB      ALA 530  16.498   7.102  -3.718
  170    HB2  ALA 530           2HB      ALA 530  16.067   6.646  -5.367
  171    HB3  ALA 530           3HB      ALA 530  17.646   6.207  -4.714
  172    H    TRP 531           H        TRP 531  15.871   5.111  -1.472
  173    HA   TRP 531           HA       TRP 531  18.461   4.388  -0.680
  174    HB2  TRP 531           2HB      TRP 531  17.428   4.097   1.562
  175    HB3  TRP 531           1HB      TRP 531  16.919   5.595   0.789
  176    HD1  TRP 531           HD       TRP 531  14.481   5.201  -0.687
  177    HE1  TRP 531           1HE      TRP 531  12.358   4.116   0.196
  178    HE3  TRP 531           3HE      TRP 531  16.486   2.593   3.221
  179    HZ2  TRP 531           2HZ      TRP 531  11.588   2.380   2.303
  180    HZ3  TRP 531           3HZ      TRP 531  14.982   1.247   4.630
  181    HH2  TRP 531           HH       TRP 531  12.584   1.144   4.179
  182    H    ILE 532           H        ILE 532  15.871   2.518  -1.859
  183    HA   ILE 532           HA       ILE 532  17.164   0.053  -0.944
  184    HB   ILE 532           HB       ILE 532  14.850  -0.944  -1.072
  185   HG12  ILE 532          2HG1      ILE 532  14.207   1.968  -1.435
  186   HG13  ILE 532          1HG1      ILE 532  13.556   0.583  -2.293
  187   HG21  ILE 532          1HG2      ILE 532  14.224   0.014   1.164
  188   HG22  ILE 532          2HG2      ILE 532  15.533   1.177   0.945
  189   HG23  ILE 532          3HG2      ILE 532  15.892  -0.547   1.038
  190   HD11  ILE 532          3HD1      ILE 532  12.871   0.443   0.491
  191   HD12  ILE 532          1HD1      ILE 532  11.824   0.500  -0.924
  192   HD13  ILE 532          2HD1      ILE 532  12.396   1.997  -0.195
  193    HA   PRO 533           HA       PRO 533  17.243  -0.830  -5.295
  194    HB2  PRO 533           2HB      PRO 533  18.433  -3.207  -5.208
  195    HB3  PRO 533           1HB      PRO 533  19.281  -1.747  -4.686
  196    HG2  PRO 533           2HG      PRO 533  18.024  -3.897  -3.046
  197    HG3  PRO 533           1HG      PRO 533  19.513  -2.984  -2.751
  198    HD2  PRO 533           2HD      PRO 533  17.007  -2.467  -1.609
  199    HD3  PRO 533           1HD      PRO 533  18.394  -1.362  -1.625
  200    H    TYR 534           H        TYR 534  15.470  -2.855  -3.061
  201    HA   TYR 534           HA       TYR 534  13.787  -3.719  -5.278
  202    HB2  TYR 534           2HB      TYR 534  13.873  -6.087  -4.594
  203    HB3  TYR 534           1HB      TYR 534  15.433  -5.490  -5.152
  204    HD1  TYR 534           1HD      TYR 534  13.489  -5.993  -2.006
  205    HD2  TYR 534           2HD      TYR 534  17.318  -5.880  -3.859
  206    HE1  TYR 534           1HE      TYR 534  14.520  -6.755   0.092
  207    HE2  TYR 534           2HE      TYR 534  18.359  -6.643  -1.765
  208    HH   TYR 534           HH       TYR 534  17.015  -8.127   0.526
  209    H    PHE 535           H        PHE 535  13.838  -2.357  -2.342
  210    HA   PHE 535           HA       PHE 535  11.632  -3.817  -1.153
  211    HB2  PHE 535           2HB      PHE 535  13.041  -1.283  -0.328
  212    HB3  PHE 535           1HB      PHE 535  11.743  -2.025   0.592
  213    HD1  PHE 535           1HD      PHE 535  15.055  -2.879  -0.887
  214    HD2  PHE 535           2HD      PHE 535  12.303  -3.428   2.310
  215    HE1  PHE 535           1HE      PHE 535  16.712  -4.245   0.299
  216    HE2  PHE 535           2HE      PHE 535  13.955  -4.799   3.501
  217    HZ   PHE 535           HZ       PHE 535  16.167  -5.213   2.499
  218    H    GLY 536           H        GLY 536  12.212  -0.731  -2.740
  219    HA2  GLY 536           2HA      GLY 536   9.300  -0.249  -2.778
  220    HA3  GLY 536           1HA      GLY 536  10.514   1.019  -2.831
  221    HA   PRO 537           HA       PRO 537  10.860   1.159  -7.225
  222    HB2  PRO 537           2HB      PRO 537  13.393  -0.413  -7.216
  223    HB3  PRO 537           1HB      PRO 537  13.039   1.143  -7.974
  224    HG2  PRO 537           2HG      PRO 537  14.483   0.997  -5.732
  225    HG3  PRO 537           1HG      PRO 537  13.337   2.322  -6.004
  226    HD2  PRO 537           2HD      PRO 537  13.114  -0.046  -4.224
  227    HD3  PRO 537           1HD      PRO 537  12.458   1.590  -4.016
  228    H    ALA 538           H        ALA 538  11.835  -1.971  -5.895
  229    HA   ALA 538           HA       ALA 538  10.860  -3.401  -8.227
  230    HB1  ALA 538           1HB      ALA 538  11.647  -5.403  -7.083
  231    HB2  ALA 538           2HB      ALA 538  11.966  -4.460  -5.626
  232    HB3  ALA 538           3HB      ALA 538  12.897  -4.158  -7.095
  233    H    ALA 539           H        ALA 539   9.845  -2.662  -4.967
  234    HA   ALA 539           HA       ALA 539   7.891  -4.546  -4.490
  235    HB1  ALA 539           1HB      ALA 539   8.455  -1.830  -3.573
  236    HB2  ALA 539           2HB      ALA 539   7.997  -3.269  -2.662
  237    HB3  ALA 539           3HB      ALA 539   6.758  -2.295  -3.453
  238    H    GLU 540           H        GLU 540   5.486  -4.099  -4.463
  239    HA   GLU 540           HA       GLU 540   4.454  -2.523  -6.660
  240    HB2  GLU 540           2HB      GLU 540   3.934  -5.497  -6.640
  241    HB3  GLU 540           1HB      GLU 540   3.436  -4.333  -7.860
  242    HG2  GLU 540           2HG      GLU 540   5.855  -3.937  -8.347
  243    HG3  GLU 540           1HG      GLU 540   6.226  -5.284  -7.270
  244    H    GLY 541           H        GLY 541   3.848  -4.892  -4.121
  245    HA2  GLY 541           2HA      GLY 541   1.211  -3.646  -3.652
  246    HA3  GLY 541           1HA      GLY 541   1.595  -5.317  -3.259
  247    H    ILE 542           H        ILE 542   3.733  -2.614  -2.710
  248    HA   ILE 542           HA       ILE 542   3.105  -2.517   0.130
  249    HB   ILE 542           HB       ILE 542   5.985  -2.896  -0.577
  250   HG12  ILE 542          2HG1      ILE 542   5.602  -5.365   0.066
  251   HG13  ILE 542          1HG1      ILE 542   3.919  -5.068  -0.368
  252   HG21  ILE 542          1HG2      ILE 542   4.398  -3.655   1.874
  253   HG22  ILE 542          2HG2      ILE 542   5.272  -2.136   1.670
  254   HG23  ILE 542          3HG2      ILE 542   6.153  -3.663   1.702
  255   HD11  ILE 542          3HD1      ILE 542   5.341  -4.033  -2.497
  256   HD12  ILE 542          1HD1      ILE 542   4.506  -5.589  -2.444
  257   HD13  ILE 542          2HD1      ILE 542   6.226  -5.499  -2.061
  258    H    TYR 543           H        TYR 543   4.859  -1.344  -2.671
  259    HA   TYR 543           HA       TYR 543   5.455   1.123  -1.285
  260    HB2  TYR 543           2HB      TYR 543   7.311   1.246  -2.540
  261    HB3  TYR 543           1HB      TYR 543   7.042  -0.466  -2.749
  262    HD1  TYR 543           2HD      TYR 543   5.659  -1.173  -4.813
  263    HD2  TYR 543           1HD      TYR 543   7.523   2.622  -4.389
  264    HE1  TYR 543           2HE      TYR 543   5.585  -0.873  -7.246
  265    HE2  TYR 543           1HE      TYR 543   7.464   2.938  -6.821
  266    HH   TYR 543           HH       TYR 543   6.941   0.496  -8.981
  267    H    ILE 544           H        ILE 544   3.952  -0.092  -4.235
  268    HA   ILE 544           HA       ILE 544   2.646   0.867  -5.833
  269    HB   ILE 544           HB       ILE 544   1.279   2.178  -3.509
  270   HG12  ILE 544          2HG1      ILE 544  -0.020  -0.008  -3.395
  271   HG13  ILE 544          1HG1      ILE 544   1.299  -0.722  -4.313
  272   HG21  ILE 544          1HG2      ILE 544  -0.694   1.259  -5.015
  273   HG22  ILE 544          2HG2      ILE 544   0.545   1.364  -6.267
  274   HG23  ILE 544          3HG2      ILE 544   0.090   2.802  -5.355
  275   HD11  ILE 544          3HD1      ILE 544   2.224   0.762  -1.999
  276   HD12  ILE 544          1HD1      ILE 544   2.581  -0.887  -2.508
  277   HD13  ILE 544          2HD1      ILE 544   1.124  -0.546  -1.578
  278    H    GLU 545           H        GLU 545   2.600   3.463  -3.428
  279    HA   GLU 545           HA       GLU 545   3.130   5.669  -3.525
  280    HB2  GLU 545           2HB      GLU 545   4.542   5.236  -6.134
  281    HB3  GLU 545           1HB      GLU 545   4.912   6.385  -4.854
  282    HG2  GLU 545           2HG      GLU 545   5.072   3.535  -4.136
  283    HG3  GLU 545           1HG      GLU 545   6.283   4.129  -5.269
  284    H    GLY 546           H        GLY 546   0.770   4.523  -4.805
  285    HA2  GLY 546           2HA      GLY 546   0.126   6.827  -6.504
  286    HA3  GLY 546           1HA      GLY 546  -0.227   5.210  -7.092
  287    H    LEU 547           H        LEU 547  -0.672   5.005  -3.845
  288    HA   LEU 547           HA       LEU 547  -3.415   6.066  -3.923
  289    HB2  LEU 547           2HB      LEU 547  -4.461   4.080  -3.381
  290    HB3  LEU 547           1HB      LEU 547  -3.270   3.594  -4.572
  291    HG   LEU 547           HG       LEU 547  -3.017   3.260  -1.582
  292   HD11  LEU 547          1HD1      LEU 547  -3.282   1.125  -3.682
  293   HD12  LEU 547          2HD1      LEU 547  -4.661   1.783  -2.798
  294   HD13  LEU 547          3HD1      LEU 547  -3.371   0.951  -1.928
  295   HD21  LEU 547          3HD2      LEU 547  -0.826   3.309  -2.067
  296   HD22  LEU 547          1HD2      LEU 547  -1.097   3.073  -3.791
  297   HD23  LEU 547          2HD2      LEU 547  -1.111   1.688  -2.701
  298    H    MET 548           H        MET 548  -0.579   5.618  -2.179
  299    HA   MET 548           HA       MET 548  -1.654   5.493   0.443
  300    HB2  MET 548           2HB      MET 548   0.748   6.520   0.973
  301    HB3  MET 548           1HB      MET 548   0.518   4.829   0.582
  302    HG2  MET 548           2HG      MET 548   2.413   5.651  -0.605
  303    HG3  MET 548           1HG      MET 548   1.131   5.326  -1.766
  304    HE1  MET 548           3HE      MET 548   0.705   6.453  -3.410
  305    HE2  MET 548           1HE      MET 548   1.744   7.781  -3.925
  306    HE3  MET 548           2HE      MET 548   0.103   8.109  -3.372
  307    H    HIS 549           H        HIS 549  -3.294   7.195  -0.152
  308    HA   HIS 549           HA       HIS 549  -2.251   9.853   0.578
  309    HB2  HIS 549           2HB      HIS 549  -4.873   9.648  -0.803
  310    HB3  HIS 549           1HB      HIS 549  -3.634  10.888  -0.925
  311    HD1  HIS 549           1HD      HIS 549  -5.173   9.230  -3.269
  312    HD2  HIS 549           2HD      HIS 549  -1.228   8.837  -2.025
  313    HE1  HIS 549           1HE      HIS 549  -3.948   8.231  -5.223
  314    HE2  HIS 549           2HE      HIS 549  -1.540   8.130  -4.492
  315    H    ASN 550           H        ASN 550  -3.236   7.564   2.235
  316    HA   ASN 550           HA       ASN 550  -4.420   7.278   4.150
  317    HB2  ASN 550           2HB      ASN 550  -5.135  10.203   3.905
  318    HB3  ASN 550           1HB      ASN 550  -5.213   9.215   5.360
  319   HD21  ASN 550          1HD2      ASN 550  -3.630  11.664   4.375
  320   HD22  ASN 550          2HD2      ASN 550  -2.012  11.306   4.863
  321    H    GLN 551           H        GLN 551  -5.726   6.108   2.370
  322    HA   GLN 551           HA       GLN 551  -8.452   7.215   2.293
  323    HB2  GLN 551           2HB      GLN 551  -8.491   5.139   0.489
  324    HB3  GLN 551           1HB      GLN 551  -8.304   6.837   0.088
  325    HG2  GLN 551           2HG      GLN 551  -6.552   5.980  -1.053
  326    HG3  GLN 551           1HG      GLN 551  -5.754   6.293   0.484
  327   HE21  GLN 551          1HE2      GLN 551  -6.188   4.326   2.070
  328   HE22  GLN 551          2HE2      GLN 551  -5.783   2.789   1.401
  329    H    ASP 552           H        ASP 552 -10.024   5.178   1.863
  330    HA   ASP 552           HA       ASP 552  -9.562   2.773   3.193
  331    HB2  ASP 552           2HB      ASP 552 -10.727   3.099   5.306
  332    HB3  ASP 552           1HB      ASP 552  -9.366   4.208   5.193
  333    H    GLY 553           H        GLY 553 -11.699   5.157   1.942
  334    HA2  GLY 553           2HA      GLY 553 -14.042   3.454   2.055
  335    HA3  GLY 553           1HA      GLY 553 -13.949   5.056   1.338
  336    H    LEU 554           H        LEU 554 -11.540   4.269  -0.211
  337    HA   LEU 554           HA       LEU 554 -12.960   3.155  -2.475
  338    HB2  LEU 554           2HB      LEU 554 -10.811   3.606  -3.669
  339    HB3  LEU 554           1HB      LEU 554 -11.573   5.014  -2.954
  340    HG   LEU 554           HG       LEU 554  -9.775   4.004  -1.016
  341   HD11  LEU 554          1HD1      LEU 554  -8.047   4.615  -3.292
  342   HD12  LEU 554          2HD1      LEU 554  -8.898   3.076  -3.427
  343   HD13  LEU 554          3HD1      LEU 554  -7.878   3.398  -2.027
  344   HD21  LEU 554          3HD2      LEU 554 -10.147   6.435  -2.651
  345   HD22  LEU 554          1HD2      LEU 554  -8.548   6.202  -1.944
  346   HD23  LEU 554          2HD2      LEU 554  -9.971   6.253  -0.905
  347    H    ILE 555           H        ILE 555 -11.424   1.788   0.087
  348    HA   ILE 555           HA       ILE 555 -10.898  -0.659  -1.410
  349    HB   ILE 555           HB       ILE 555  -8.802  -1.024  -0.113
  350   HG12  ILE 555          2HG1      ILE 555  -9.263   0.661   1.657
  351   HG13  ILE 555          1HG1      ILE 555  -7.683   0.847   0.931
  352   HG21  ILE 555          1HG2      ILE 555  -8.313   1.430  -1.696
  353   HG22  ILE 555          2HG2      ILE 555  -9.098   0.070  -2.504
  354   HG23  ILE 555          3HG2      ILE 555  -7.514  -0.145  -1.756
  355   HD11  ILE 555          3HD1      ILE 555  -9.155   2.498  -0.605
  356   HD12  ILE 555          1HD1      ILE 555  -8.215   2.990   0.802
  357   HD13  ILE 555          2HD1      ILE 555  -9.942   2.670   0.963
  358    H    CYS 556           H        CYS 556 -11.137   0.944   1.725
  359    HA   CYS 556           HA       CYS 556 -11.784  -1.600   2.972
  360    HB2  CYS 556           2HB      CYS 556 -10.131   0.309   3.847
  361    HB3  CYS 556           1HB      CYS 556 -11.620   0.927   4.543
  362    H    GLY 557           H        GLY 557 -13.888  -1.744   1.968
  363    HA2  GLY 557           2HA      GLY 557 -15.874  -0.066   3.368
  364    HA3  GLY 557           1HA      GLY 557 -16.033  -0.427   1.657
  365    H    LEU 558           H        LEU 558 -15.949  -2.874   1.172
  366    HA   LEU 558           HA       LEU 558 -17.262  -4.408   3.289
  367    HB2  LEU 558           2HB      LEU 558 -18.981  -5.213   1.785
  368    HB3  LEU 558           1HB      LEU 558 -19.049  -3.468   1.916
  369    HG   LEU 558           HG       LEU 558 -17.798  -4.949  -0.397
  370   HD11  LEU 558          1HD1      LEU 558 -20.071  -5.432  -0.579
  371   HD12  LEU 558          2HD1      LEU 558 -19.856  -4.003  -1.590
  372   HD13  LEU 558          3HD1      LEU 558 -20.552  -3.846   0.023
  373   HD21  LEU 558          3HD2      LEU 558 -16.858  -2.957  -0.759
  374   HD22  LEU 558          1HD2      LEU 558 -17.889  -2.153   0.423
  375   HD23  LEU 558          2HD2      LEU 558 -18.474  -2.420  -1.219
  376    H    ARG 559           H        ARG 559 -15.905  -4.540  -0.007
  377    HA   ARG 559           HA       ARG 559 -14.032  -6.517   0.562
  378    HB2  ARG 559           2HB      ARG 559 -15.014  -8.510  -0.426
  379    HB3  ARG 559           1HB      ARG 559 -16.010  -7.955   0.913
  380    HG2  ARG 559           2HG      ARG 559 -16.789  -6.818  -1.648
  381    HG3  ARG 559           1HG      ARG 559 -16.907  -8.581  -1.596
  382    HD2  ARG 559           2HD      ARG 559 -18.114  -6.703   0.433
  383    HD3  ARG 559           1HD      ARG 559 -18.994  -7.436  -0.908
  384    HE   ARG 559           HE       ARG 559 -17.689  -9.384   0.721
  385   HH11  ARG 559          1HH1      ARG 559 -20.520  -7.354   0.496
  386   HH12  ARG 559          2HH1      ARG 559 -21.496  -8.392   1.482
  387   HH21  ARG 559          1HH2      ARG 559 -18.970 -10.750   2.016
  388   HH22  ARG 559          2HH2      ARG 559 -20.615 -10.320   2.346
  389    H    GLN 560           H        GLN 560 -14.213  -4.170  -0.941
  390    HA   GLN 560           HA       GLN 560 -13.990  -5.076  -3.719
  391    HB2  GLN 560           2HB      GLN 560 -14.287  -2.838  -4.402
  392    HB3  GLN 560           1HB      GLN 560 -15.430  -3.083  -3.089
  393    HG2  GLN 560           2HG      GLN 560 -12.972  -2.123  -2.004
  394    HG3  GLN 560           1HG      GLN 560 -13.455  -1.088  -3.346
  395   HE21  GLN 560          1HE2      GLN 560 -14.452  -2.429  -0.270
  396   HE22  GLN 560          2HE2      GLN 560 -15.642  -1.230   0.082
  Start of MODEL   10
    1    H1   ALA 507           1HT      ALA 507 -10.742 -10.354  -6.438
    2    H2   ALA 507           2HT      ALA 507 -10.845  -8.691  -6.853
    3    H3   ALA 507           3HT      ALA 507 -10.560  -9.867  -8.071
    4    HA   ALA 507           HA       ALA 507 -12.737  -9.429  -8.351
    5    HB1  ALA 507           1HB      ALA 507 -12.490 -11.789  -8.181
    6    HB2  ALA 507           2HB      ALA 507 -13.969 -11.357  -7.324
    7    HB3  ALA 507           3HB      ALA 507 -12.501 -11.725  -6.418
    8    H    GLN 508           H        GLN 508 -12.501 -10.129  -4.857
    9    HA   GLN 508           HA       GLN 508 -13.784  -7.643  -4.185
   10    HB2  GLN 508           2HB      GLN 508 -15.235 -10.267  -3.866
   11    HB3  GLN 508           1HB      GLN 508 -15.641  -8.843  -2.918
   12    HG2  GLN 508           2HG      GLN 508 -16.034  -7.623  -5.053
   13    HG3  GLN 508           1HG      GLN 508 -15.810  -9.151  -5.904
   14   HE21  GLN 508          1HE2      GLN 508 -17.672  -7.752  -3.229
   15   HE22  GLN 508          2HE2      GLN 508 -19.135  -8.603  -3.575
   16    HA   PRO 509           HA       PRO 509 -11.142  -9.532  -0.874
   17    HB2  PRO 509           2HB      PRO 509  -9.010  -7.734  -1.315
   18    HB3  PRO 509           1HB      PRO 509  -9.072  -9.433  -1.777
   19    HG2  PRO 509           2HG      PRO 509  -9.009  -7.246  -3.528
   20    HG3  PRO 509           1HG      PRO 509  -9.415  -8.916  -3.955
   21    HD2  PRO 509           2HD      PRO 509 -11.218  -6.601  -3.414
   22    HD3  PRO 509           1HD      PRO 509 -11.418  -7.953  -4.550
   23    H    LYS 510           H        LYS 510 -11.155  -8.787   1.182
   24    HA   LYS 510           HA       LYS 510 -12.150  -6.093   1.637
   25    HB2  LYS 510           2HB      LYS 510 -11.973  -8.597   3.233
   26    HB3  LYS 510           1HB      LYS 510 -11.981  -7.076   4.114
   27    HG2  LYS 510           2HG      LYS 510 -14.174  -6.903   3.883
   28    HG3  LYS 510           1HG      LYS 510 -14.037  -7.027   2.129
   29    HD2  LYS 510           2HD      LYS 510 -13.880  -9.476   3.847
   30    HD3  LYS 510           1HD      LYS 510 -15.444  -8.784   3.411
   31    HE2  LYS 510           2HE      LYS 510 -15.082  -9.140   1.117
   32    HE3  LYS 510           1HE      LYS 510 -13.354  -9.409   1.347
   33    HZ1  LYS 510           3HZ      LYS 510 -13.903 -11.460   2.547
   34    HZ2  LYS 510           1HZ      LYS 510 -14.466 -11.489   0.952
   35    HZ3  LYS 510           2HZ      LYS 510 -15.544 -11.213   2.225
   36    H    CYS 511           H        CYS 511 -10.803  -4.460   1.947
   37    HA   CYS 511           HA       CYS 511  -8.964  -3.238   2.493
   38    HB2  CYS 511           2HB      CYS 511  -9.543  -4.933   4.722
   39    HB3  CYS 511           1HB      CYS 511  -7.795  -4.775   4.581
   40    H    ASN 512           H        ASN 512  -7.608  -3.400   0.791
   41    HA   ASN 512           HA       ASN 512  -5.822  -5.707   0.643
   42    HB2  ASN 512           2HB      ASN 512  -6.193  -3.585  -1.466
   43    HB3  ASN 512           1HB      ASN 512  -5.391  -5.139  -1.641
   44   HD21  ASN 512          1HD2      ASN 512  -8.537  -3.738  -0.772
   45   HD22  ASN 512          2HD2      ASN 512  -9.479  -4.979  -1.511
   46    HA   PRO 513           HA       PRO 513  -2.723  -2.177   0.991
   47    HB2  PRO 513           2HB      PRO 513  -3.505   0.335   0.356
   48    HB3  PRO 513           1HB      PRO 513  -3.164  -0.896  -0.863
   49    HG2  PRO 513           2HG      PRO 513  -5.712   0.303  -0.196
   50    HG3  PRO 513           1HG      PRO 513  -5.332  -0.831  -1.501
   51    HD2  PRO 513           2HD      PRO 513  -6.442  -1.367   1.189
   52    HD3  PRO 513           1HD      PRO 513  -6.590  -2.306  -0.308
   53    H    ASN 514           H        ASN 514  -5.199  -2.388   2.952
   54    HA   ASN 514           HA       ASN 514  -4.308  -0.225   4.741
   55    HB2  ASN 514           2HB      ASN 514  -7.020  -1.113   3.965
   56    HB3  ASN 514           1HB      ASN 514  -6.789  -0.837   5.688
   57   HD21  ASN 514          1HD2      ASN 514  -6.879   0.615   2.532
   58   HD22  ASN 514          2HD2      ASN 514  -6.923   2.254   3.070
   59    H    LEU 515           H        LEU 515  -2.802  -2.272   4.910
   60    HA   LEU 515           HA       LEU 515  -3.853  -4.025   7.022
   61    HB2  LEU 515           2HB      LEU 515  -1.341  -4.707   5.609
   62    HB3  LEU 515           1HB      LEU 515  -2.607  -5.755   6.212
   63    HG   LEU 515           HG       LEU 515  -2.672  -5.994   3.882
   64   HD11  LEU 515          1HD1      LEU 515  -4.848  -5.108   5.217
   65   HD12  LEU 515          2HD1      LEU 515  -4.862  -5.649   3.539
   66   HD13  LEU 515          3HD1      LEU 515  -4.757  -3.930   3.910
   67   HD21  LEU 515          3HD2      LEU 515  -3.091  -3.305   2.959
   68   HD22  LEU 515          1HD2      LEU 515  -1.870  -4.480   2.466
   69   HD23  LEU 515          2HD2      LEU 515  -1.570  -3.419   3.842
   70    H    HIS 516           H        HIS 516  -0.855  -2.386   5.979
   71    HA   HIS 516           HA       HIS 516  -0.311  -1.292   8.503
   72    HB2  HIS 516           2HB      HIS 516   1.144  -2.731   9.542
   73    HB3  HIS 516           1HB      HIS 516   0.080  -3.893   8.757
   74    HD1  HIS 516           1HD      HIS 516   1.050  -5.257   6.807
   75    HD2  HIS 516           2HD      HIS 516   3.694  -2.509   8.438
   76    HE1  HIS 516           1HE      HIS 516   3.262  -5.746   5.728
   77    HE2  HIS 516           2HE      HIS 516   4.859  -4.064   6.722
   78    H    TYR 517           H        TYR 517   1.539  -2.791   5.841
   79    HA   TYR 517           HA       TYR 517   3.654  -1.019   5.779
   80    HB2  TYR 517           2HB      TYR 517   3.173  -1.699   3.074
   81    HB3  TYR 517           1HB      TYR 517   4.382  -2.346   4.160
   82    HD1  TYR 517           1HD      TYR 517   0.667  -2.957   4.299
   83    HD2  TYR 517           2HD      TYR 517   4.532  -4.531   3.441
   84    HE1  TYR 517           1HE      TYR 517  -0.304  -5.191   4.026
   85    HE2  TYR 517           2HE      TYR 517   3.560  -6.771   3.173
   86    HH   TYR 517           HH       TYR 517   0.465  -7.383   2.653
   87    H    TRP 518           H        TRP 518   0.440  -0.356   4.864
   88    HA   TRP 518           HA       TRP 518   1.364   2.056   3.452
   89    HB2  TRP 518           2HB      TRP 518  -1.362   1.007   2.906
   90    HB3  TRP 518           1HB      TRP 518  -0.247   1.821   1.840
   91    HD1  TRP 518           HD       TRP 518   0.947  -1.370   3.522
   92    HE1  TRP 518           1HE      TRP 518   1.149  -3.191   1.792
   93    HE3  TRP 518           3HE      TRP 518  -1.264   1.019  -0.411
   94    HZ2  TRP 518           2HZ      TRP 518   0.446  -3.638  -0.902
   95    HZ3  TRP 518           3HZ      TRP 518  -1.463  -0.195  -2.544
   96    HH2  TRP 518           HH       TRP 518  -0.621  -2.474  -2.786
   97    H    THR 519           H        THR 519  -1.084   0.636   5.515
   98    HA   THR 519           HA       THR 519  -2.575   2.954   6.043
   99    HB   THR 519           HB       THR 519  -3.403   0.719   6.555
  100    HG1  THR 519           1HG      THR 519  -4.203   1.176   8.628
  101   HG21  THR 519          3HG2      THR 519  -2.357  -0.794   7.796
  102   HG22  THR 519          1HG2      THR 519  -1.960   0.376   9.052
  103   HG23  THR 519          2HG2      THR 519  -0.931   0.230   7.625
  104    H    THR 520           H        THR 520   0.429   1.805   7.324
  105    HA   THR 520           HA       THR 520   0.372   3.670   9.551
  106    HB   THR 520           HB       THR 520   1.796   1.255   8.934
  107    HG1  THR 520           1HG      THR 520   1.028   1.283  10.899
  108   HG21  THR 520          3HG2      THR 520   3.555   3.593   9.620
  109   HG22  THR 520          1HG2      THR 520   3.770   2.401   8.339
  110   HG23  THR 520          2HG2      THR 520   3.971   1.929  10.026
  111    H    GLN 521           H        GLN 521   2.691   3.042   6.917
  112    HA   GLN 521           HA       GLN 521   3.509   5.839   7.101
  113    HB2  GLN 521           2HB      GLN 521   5.551   5.229   6.102
  114    HB3  GLN 521           1HB      GLN 521   5.186   3.941   7.241
  115    HG2  GLN 521           2HG      GLN 521   4.764   2.409   5.583
  116    HG3  GLN 521           1HG      GLN 521   4.394   3.646   4.389
  117   HE21  GLN 521          1HE2      GLN 521   6.428   5.243   4.181
  118   HE22  GLN 521          2HE2      GLN 521   7.906   4.408   3.852
  119    H    ASP 522           H        ASP 522   4.607   6.150   4.600
  120    HA   ASP 522           HA       ASP 522   2.180   6.425   2.984
  121    HB2  ASP 522           2HB      ASP 522   4.631   8.009   3.340
  122    HB3  ASP 522           1HB      ASP 522   3.993   7.953   1.703
  123    H    GLU 523           H        GLU 523   3.565   3.947   3.086
  124    HA   GLU 523           HA       GLU 523   4.544   2.328   1.786
  125    HB2  GLU 523           2HB      GLU 523   3.242   3.686  -0.557
  126    HB3  GLU 523           1HB      GLU 523   3.439   1.964  -0.248
  127    HG2  GLU 523           2HG      GLU 523   1.793   2.043   1.502
  128    HG3  GLU 523           1HG      GLU 523   1.665   3.792   1.341
  129    H    GLY 524           H        GLY 524   6.068   4.714   2.200
  130    HA2  GLY 524           2HA      GLY 524   8.342   4.299   0.777
  131    HA3  GLY 524           1HA      GLY 524   7.415   5.389  -0.246
  132    H    ALA 525           H        ALA 525   6.158   6.689   2.048
  133    HA   ALA 525           HA       ALA 525   6.470   8.547   3.293
  134    HB1  ALA 525           1HB      ALA 525   7.483   7.765   5.102
  135    HB2  ALA 525           2HB      ALA 525   9.001   8.317   4.392
  136    HB3  ALA 525           3HB      ALA 525   8.458   6.658   4.137
  137    H    ALA 526           H        ALA 526   7.813   8.259   0.490
  138    HA   ALA 526           HA       ALA 526   9.144   9.485  -0.876
  139    HB1  ALA 526           1HB      ALA 526   7.172  11.031   0.023
  140    HB2  ALA 526           2HB      ALA 526   8.403  11.621  -1.094
  141    HB3  ALA 526           3HB      ALA 526   8.543  11.959   0.633
  142    H    ILE 527           H        ILE 527  10.214   8.643   1.889
  143    HA   ILE 527           HA       ILE 527  12.173  10.582   2.577
  144    HB   ILE 527           HB       ILE 527  13.247   8.476   3.697
  145   HG12  ILE 527          2HG1      ILE 527  11.660   6.716   4.225
  146   HG13  ILE 527          1HG1      ILE 527  10.418   7.517   3.270
  147   HG21  ILE 527          1HG2      ILE 527  12.458  10.014   5.177
  148   HG22  ILE 527          2HG2      ILE 527  11.324   8.699   5.482
  149   HG23  ILE 527          3HG2      ILE 527  10.852  10.048   4.450
  150   HD11  ILE 527          3HD1      ILE 527  12.993   6.648   2.026
  151   HD12  ILE 527          1HD1      ILE 527  11.433   6.958   1.262
  152   HD13  ILE 527          2HD1      ILE 527  11.656   5.520   2.259
  153    H    GLY 528           H        GLY 528  11.996   8.379   0.000
  154    HA2  GLY 528           2HA      GLY 528  14.196   9.141  -1.363
  155    HA3  GLY 528           1HA      GLY 528  14.854   7.962  -0.240
  156    H    LEU 529           H        LEU 529  13.216   5.934  -0.166
  157    HA   LEU 529           HA       LEU 529  12.258   4.181  -1.218
  158    HB2  LEU 529           2HB      LEU 529  11.415   6.223  -2.765
  159    HB3  LEU 529           1HB      LEU 529  12.348   5.302  -3.931
  160    HG   LEU 529           HG       LEU 529   9.842   4.556  -2.504
  161   HD11  LEU 529          1HD1      LEU 529   9.705   3.462  -4.938
  162   HD12  LEU 529          2HD1      LEU 529  10.874   4.740  -5.271
  163   HD13  LEU 529          3HD1      LEU 529   9.285   5.146  -4.626
  164   HD21  LEU 529          3HD2      LEU 529  11.826   2.582  -3.609
  165   HD22  LEU 529          1HD2      LEU 529  10.208   2.206  -3.018
  166   HD23  LEU 529          2HD2      LEU 529  11.441   2.807  -1.904
  167    H    ALA 530           H        ALA 530  15.045   5.663  -2.566
  168    HA   ALA 530           HA       ALA 530  15.837   3.371  -4.071
  169    HB1  ALA 530           1HB      ALA 530  16.489   5.602  -4.806
  170    HB2  ALA 530           2HB      ALA 530  17.906   4.591  -4.521
  171    HB3  ALA 530           3HB      ALA 530  17.443   5.814  -3.337
  172    H    TRP 531           H        TRP 531  15.807   3.941  -0.862
  173    HA   TRP 531           HA       TRP 531  18.313   2.751  -0.072
  174    HB2  TRP 531           2HB      TRP 531  17.277   2.879   2.213
  175    HB3  TRP 531           1HB      TRP 531  17.271   4.427   1.371
  176    HD1  TRP 531           HD       TRP 531  14.875   4.950   0.027
  177    HE1  TRP 531           1HE      TRP 531  12.494   4.552   0.834
  178    HE3  TRP 531           3HE      TRP 531  15.848   1.578   3.736
  179    HZ2  TRP 531           2HZ      TRP 531  11.165   3.035   2.825
  180    HZ3  TRP 531           3HZ      TRP 531  13.962   0.709   5.058
  181    HH2  TRP 531           HH       TRP 531  11.669   1.424   4.612
  182    H    ILE 532           H        ILE 532  15.485   1.619  -1.348
  183    HA   ILE 532           HA       ILE 532  15.813  -1.041  -0.153
  184    HB   ILE 532           HB       ILE 532  13.225  -1.120  -0.591
  185   HG12  ILE 532          2HG1      ILE 532  13.809   1.834  -0.315
  186   HG13  ILE 532          1HG1      ILE 532  12.977   1.037  -1.642
  187   HG21  ILE 532          1HG2      ILE 532  14.181  -1.449   1.582
  188   HG22  ILE 532          2HG2      ILE 532  12.876  -0.273   1.742
  189   HG23  ILE 532          3HG2      ILE 532  14.555   0.268   1.725
  190   HD11  ILE 532          3HD1      ILE 532  11.064   0.646  -0.310
  191   HD12  ILE 532          1HD1      ILE 532  11.545   2.320  -0.037
  192   HD13  ILE 532          2HD1      ILE 532  11.922   1.085   1.165
  193    HA   PRO 533           HA       PRO 533  16.366  -0.778  -4.924
  194    HB2  PRO 533           2HB      PRO 533  17.850  -3.177  -3.917
  195    HB3  PRO 533           1HB      PRO 533  18.251  -2.091  -5.253
  196    HG2  PRO 533           2HG      PRO 533  19.429  -1.857  -2.856
  197    HG3  PRO 533           1HG      PRO 533  19.049  -0.441  -3.852
  198    HD2  PRO 533           2HD      PRO 533  17.812  -1.346  -1.338
  199    HD3  PRO 533           1HD      PRO 533  17.791   0.260  -2.092
  200    H    TYR 534           H        TYR 534  15.826  -3.660  -2.877
  201    HA   TYR 534           HA       TYR 534  13.961  -4.638  -4.938
  202    HB2  TYR 534           2HB      TYR 534  14.410  -6.899  -4.015
  203    HB3  TYR 534           1HB      TYR 534  15.846  -6.116  -4.670
  204    HD1  TYR 534           2HD      TYR 534  14.046  -6.549  -1.419
  205    HD2  TYR 534           1HD      TYR 534  17.783  -6.128  -3.412
  206    HE1  TYR 534           2HE      TYR 534  15.217  -6.910   0.713
  207    HE2  TYR 534           1HE      TYR 534  18.964  -6.486  -1.285
  208    HH   TYR 534           HH       TYR 534  17.378  -7.612   1.534
  209    H    PHE 535           H        PHE 535  13.794  -3.034  -2.157
  210    HA   PHE 535           HA       PHE 535  11.497  -4.575  -1.146
  211    HB2  PHE 535           2HB      PHE 535  13.215  -4.425   0.507
  212    HB3  PHE 535           1HB      PHE 535  13.391  -2.701   0.269
  213    HD1  PHE 535           1HD      PHE 535  11.404  -1.218   0.865
  214    HD2  PHE 535           2HD      PHE 535  11.774  -5.262   2.133
  215    HE1  PHE 535           1HE      PHE 535   9.791  -0.792   2.672
  216    HE2  PHE 535           2HE      PHE 535  10.158  -4.845   3.943
  217    HZ   PHE 535           HZ       PHE 535   9.168  -2.606   4.212
  218    H    GLY 536           H        GLY 536  12.505  -1.612  -2.533
  219    HA2  GLY 536           2HA      GLY 536   9.891  -0.393  -1.893
  220    HA3  GLY 536           1HA      GLY 536  11.344   0.522  -2.239
  221    HA   PRO 537           HA       PRO 537  10.283   0.902  -6.492
  222    HB2  PRO 537           2HB      PRO 537  12.890  -0.225  -7.329
  223    HB3  PRO 537           1HB      PRO 537  12.201   1.369  -7.652
  224    HG2  PRO 537           2HG      PRO 537  14.209   1.074  -5.920
  225    HG3  PRO 537           1HG      PRO 537  12.901   2.231  -5.609
  226    HD2  PRO 537           2HD      PRO 537  13.323  -0.505  -4.473
  227    HD3  PRO 537           1HD      PRO 537  12.808   0.981  -3.649
  228    H    ALA 538           H        ALA 538  11.821  -2.112  -5.565
  229    HA   ALA 538           HA       ALA 538  10.573  -3.557  -7.768
  230    HB1  ALA 538           1HB      ALA 538  12.098  -4.924  -5.602
  231    HB2  ALA 538           2HB      ALA 538  12.969  -3.925  -6.765
  232    HB3  ALA 538           3HB      ALA 538  12.008  -5.294  -7.324
  233    H    ALA 539           H        ALA 539   9.935  -2.718  -4.535
  234    HA   ALA 539           HA       ALA 539   8.569  -4.863  -3.472
  235    HB1  ALA 539           1HB      ALA 539   8.974  -2.205  -2.805
  236    HB2  ALA 539           2HB      ALA 539   8.137  -3.416  -1.834
  237    HB3  ALA 539           3HB      ALA 539   7.221  -2.360  -2.911
  238    H    GLU 540           H        GLU 540   7.105  -2.162  -5.273
  239    HA   GLU 540           HA       GLU 540   5.336  -2.036  -6.673
  240    HB2  GLU 540           2HB      GLU 540   5.295  -5.041  -6.596
  241    HB3  GLU 540           1HB      GLU 540   4.543  -4.010  -7.803
  242    HG2  GLU 540           2HG      GLU 540   7.233  -3.271  -7.765
  243    HG3  GLU 540           1HG      GLU 540   7.225  -5.031  -7.672
  244    H    GLY 541           H        GLY 541   4.748  -4.681  -4.344
  245    HA2  GLY 541           2HA      GLY 541   2.023  -3.616  -3.977
  246    HA3  GLY 541           1HA      GLY 541   2.522  -5.259  -3.611
  247    H    ILE 542           H        ILE 542   4.347  -2.423  -2.717
  248    HA   ILE 542           HA       ILE 542   3.378  -2.502   0.018
  249    HB   ILE 542           HB       ILE 542   6.336  -2.646  -0.290
  250   HG12  ILE 542          2HG1      ILE 542   6.130  -5.172   0.079
  251   HG13  ILE 542          1HG1      ILE 542   4.474  -5.009  -0.493
  252   HG21  ILE 542          1HG2      ILE 542   4.311  -3.014   1.816
  253   HG22  ILE 542          2HG2      ILE 542   5.937  -2.336   1.905
  254   HG23  ILE 542          3HG2      ILE 542   5.710  -4.084   1.897
  255   HD11  ILE 542          3HD1      ILE 542   6.982  -5.015  -1.977
  256   HD12  ILE 542          1HD1      ILE 542   5.885  -3.713  -2.442
  257   HD13  ILE 542          2HD1      ILE 542   5.343  -5.392  -2.510
  258    H    TYR 543           H        TYR 543   5.349  -1.075  -2.499
  259    HA   TYR 543           HA       TYR 543   5.684   1.340  -0.945
  260    HB2  TYR 543           2HB      TYR 543   7.611   1.621  -2.088
  261    HB3  TYR 543           1HB      TYR 543   7.432  -0.089  -2.420
  262    HD1  TYR 543           2HD      TYR 543   6.152  -0.704  -4.581
  263    HD2  TYR 543           1HD      TYR 543   7.889   3.106  -3.856
  264    HE1  TYR 543           2HE      TYR 543   6.179  -0.266  -6.996
  265    HE2  TYR 543           1HE      TYR 543   7.925   3.559  -6.269
  266    HH   TYR 543           HH       TYR 543   6.220   2.275  -8.408
  267    H    ILE 544           H        ILE 544   4.441   0.217  -4.057
  268    HA   ILE 544           HA       ILE 544   3.201   1.209  -5.694
  269    HB   ILE 544           HB       ILE 544   1.581   2.217  -3.379
  270   HG12  ILE 544          2HG1      ILE 544   0.430  -0.033  -3.541
  271   HG13  ILE 544          1HG1      ILE 544   1.814  -0.579  -4.479
  272   HG21  ILE 544          1HG2      ILE 544  -0.271   1.503  -5.011
  273   HG22  ILE 544          2HG2      ILE 544   1.008   1.496  -6.225
  274   HG23  ILE 544          3HG2      ILE 544   0.627   2.982  -5.356
  275   HD11  ILE 544          3HD1      ILE 544   1.563  -0.777  -1.779
  276   HD12  ILE 544          1HD1      ILE 544   2.522   0.691  -1.948
  277   HD13  ILE 544          2HD1      ILE 544   3.085  -0.817  -2.664
  278    H    GLU 545           H        GLU 545   2.772   3.600  -3.126
  279    HA   GLU 545           HA       GLU 545   3.139   5.839  -3.018
  280    HB2  GLU 545           2HB      GLU 545   4.754   5.737  -5.533
  281    HB3  GLU 545           1HB      GLU 545   4.963   6.765  -4.121
  282    HG2  GLU 545           2HG      GLU 545   5.347   4.374  -2.993
  283    HG3  GLU 545           1HG      GLU 545   5.896   4.021  -4.627
  284    H    GLY 546           H        GLY 546   0.914   4.731  -4.434
  285    HA2  GLY 546           2HA      GLY 546   0.269   7.075  -6.073
  286    HA3  GLY 546           1HA      GLY 546   0.027   5.481  -6.766
  287    H    LEU 547           H        LEU 547  -0.588   5.206  -3.509
  288    HA   LEU 547           HA       LEU 547  -3.375   6.092  -3.738
  289    HB2  LEU 547           2HB      LEU 547  -4.334   4.023  -3.292
  290    HB3  LEU 547           1HB      LEU 547  -3.106   3.690  -4.496
  291    HG   LEU 547           HG       LEU 547  -2.781   3.207  -1.536
  292   HD11  LEU 547          1HD1      LEU 547  -3.059   0.872  -2.017
  293   HD12  LEU 547          2HD1      LEU 547  -3.233   1.204  -3.740
  294   HD13  LEU 547          3HD1      LEU 547  -4.472   1.747  -2.608
  295   HD21  LEU 547          3HD2      LEU 547  -0.991   3.005  -3.879
  296   HD22  LEU 547          1HD2      LEU 547  -0.909   1.700  -2.695
  297   HD23  LEU 547          2HD2      LEU 547  -0.620   3.366  -2.195
  298    H    MET 548           H        MET 548  -0.636   5.747  -1.824
  299    HA   MET 548           HA       MET 548  -1.971   5.503   0.696
  300    HB2  MET 548           2HB      MET 548   0.442   6.468   1.439
  301    HB3  MET 548           1HB      MET 548   0.105   4.775   1.151
  302    HG2  MET 548           2HG      MET 548   2.120   5.224   0.058
  303    HG3  MET 548           1HG      MET 548   0.918   5.152  -1.220
  304    HE1  MET 548           3HE      MET 548   1.866   7.812  -3.233
  305    HE2  MET 548           1HE      MET 548   0.223   7.984  -2.619
  306    HE3  MET 548           2HE      MET 548   0.898   6.379  -2.888
  307    H    HIS 549           H        HIS 549  -3.510   7.220   0.272
  308    HA   HIS 549           HA       HIS 549  -2.471   9.784   1.255
  309    HB2  HIS 549           2HB      HIS 549  -4.766  10.076  -0.547
  310    HB3  HIS 549           1HB      HIS 549  -3.281  11.013  -0.457
  311    HD1  HIS 549           1HD      HIS 549  -4.995   9.351  -2.892
  312    HD2  HIS 549           2HD      HIS 549  -1.092   8.958  -1.526
  313    HE1  HIS 549           1HE      HIS 549  -3.730   8.274  -4.778
  314    HE2  HIS 549           2HE      HIS 549  -1.348   8.140  -3.967
  315    H    ASN 550           H        ASN 550  -3.824   7.490   2.510
  316    HA   ASN 550           HA       ASN 550  -5.420   7.099   4.080
  317    HB2  ASN 550           2HB      ASN 550  -6.012  10.058   3.966
  318    HB3  ASN 550           1HB      ASN 550  -6.334   8.951   5.297
  319   HD21  ASN 550          1HD2      ASN 550  -4.713   8.409   6.690
  320   HD22  ASN 550          2HD2      ASN 550  -3.157   9.160   6.676
  321    H    GLN 551           H        GLN 551  -6.680   5.897   2.630
  322    HA   GLN 551           HA       GLN 551  -9.024   7.314   1.564
  323    HB2  GLN 551           2HB      GLN 551  -8.769   4.747   0.345
  324    HB3  GLN 551           1HB      GLN 551  -8.706   6.329  -0.409
  325    HG2  GLN 551           2HG      GLN 551  -6.615   5.868  -0.969
  326    HG3  GLN 551           1HG      GLN 551  -6.191   6.017   0.732
  327   HE21  GLN 551          1HE2      GLN 551  -6.391   4.038   2.037
  328   HE22  GLN 551          2HE2      GLN 551  -6.018   2.522   1.301
  329    H    ASP 552           H        ASP 552  -8.363   3.908   2.098
  330    HA   ASP 552           HA       ASP 552  -9.457   2.281   3.250
  331    HB2  ASP 552           2HB      ASP 552  -9.081   4.232   5.068
  332    HB3  ASP 552           1HB      ASP 552 -10.841   4.189   5.056
  333    H    GLY 553           H        GLY 553 -10.748   3.807   1.036
  334    HA2  GLY 553           2HA      GLY 553 -13.520   2.968   1.605
  335    HA3  GLY 553           1HA      GLY 553 -13.181   4.480   0.773
  336    H    LEU 554           H        LEU 554 -10.974   3.438  -0.754
  337    HA   LEU 554           HA       LEU 554 -12.477   2.197  -2.895
  338    HB2  LEU 554           2HB      LEU 554 -10.424   2.537  -4.194
  339    HB3  LEU 554           1HB      LEU 554 -10.979   4.012  -3.426
  340    HG   LEU 554           HG       LEU 554  -9.200   3.046  -1.561
  341   HD11  LEU 554          1HD1      LEU 554  -7.321   2.144  -2.561
  342   HD12  LEU 554          2HD1      LEU 554  -7.790   2.680  -4.175
  343   HD13  LEU 554          3HD1      LEU 554  -8.629   1.327  -3.415
  344   HD21  LEU 554          3HD2      LEU 554  -9.539   5.346  -2.727
  345   HD22  LEU 554          1HD2      LEU 554  -8.258   4.790  -3.803
  346   HD23  LEU 554          2HD2      LEU 554  -7.957   4.927  -2.071
  347    H    ILE 555           H        ILE 555 -11.051   0.981  -0.251
  348    HA   ILE 555           HA       ILE 555 -10.473  -1.570  -1.550
  349    HB   ILE 555           HB       ILE 555  -8.472  -1.891  -0.149
  350   HG12  ILE 555          2HG1      ILE 555  -9.028  -0.285   1.641
  351   HG13  ILE 555          1HG1      ILE 555  -7.434   0.005   0.977
  352   HG21  ILE 555          1HG2      ILE 555  -7.240  -1.173  -1.847
  353   HG22  ILE 555          2HG2      ILE 555  -7.586   0.516  -1.468
  354   HG23  ILE 555          3HG2      ILE 555  -8.694  -0.407  -2.485
  355   HD11  ILE 555          3HD1      ILE 555  -8.967   1.643  -0.544
  356   HD12  ILE 555          1HD1      ILE 555  -8.058   2.125   0.884
  357   HD13  ILE 555          2HD1      ILE 555  -9.768   1.726   1.023
  358    H    CYS 556           H        CYS 556 -10.924   0.216   1.463
  359    HA   CYS 556           HA       CYS 556 -12.006  -2.227   2.676
  360    HB2  CYS 556           2HB      CYS 556  -9.952  -0.645   3.594
  361    HB3  CYS 556           1HB      CYS 556 -11.331  -0.017   4.491
  362    H    GLY 557           H        GLY 557 -14.125  -1.902   1.872
  363    HA2  GLY 557           2HA      GLY 557 -15.535   0.366   3.133
  364    HA3  GLY 557           1HA      GLY 557 -15.928  -0.211   1.520
  365    H    LEU 558           H        LEU 558 -16.508  -2.616   1.440
  366    HA   LEU 558           HA       LEU 558 -17.860  -3.501   3.870
  367    HB2  LEU 558           2HB      LEU 558 -19.936  -3.945   2.636
  368    HB3  LEU 558           1HB      LEU 558 -19.542  -2.240   2.719
  369    HG   LEU 558           HG       LEU 558 -18.745  -3.790   0.293
  370   HD11  LEU 558          1HD1      LEU 558 -20.935  -4.453   0.213
  371   HD12  LEU 558          2HD1      LEU 558 -21.039  -2.887  -0.593
  372   HD13  LEU 558          3HD1      LEU 558 -21.511  -3.040   1.098
  373   HD21  LEU 558          3HD2      LEU 558 -18.400  -1.202   1.059
  374   HD22  LEU 558          1HD2      LEU 558 -19.879  -1.095   0.103
  375   HD23  LEU 558          2HD2      LEU 558 -18.412  -1.765  -0.612
  376    H    ARG 559           H        ARG 559 -16.900  -4.250   0.543
  377    HA   ARG 559           HA       ARG 559 -15.713  -6.678   1.118
  378    HB2  ARG 559           2HB      ARG 559 -17.502  -8.208   0.082
  379    HB3  ARG 559           1HB      ARG 559 -17.747  -7.683   1.745
  380    HG2  ARG 559           2HG      ARG 559 -19.777  -7.051   1.087
  381    HG3  ARG 559           1HG      ARG 559 -18.959  -5.698   0.300
  382    HD2  ARG 559           2HD      ARG 559 -19.643  -6.424  -1.673
  383    HD3  ARG 559           1HD      ARG 559 -18.776  -7.940  -1.423
  384    HE   ARG 559           HE       ARG 559 -21.049  -8.349  -0.049
  385   HH11  ARG 559          1HH1      ARG 559 -20.467  -7.186  -3.290
  386   HH12  ARG 559          2HH1      ARG 559 -21.945  -7.829  -3.919
  387   HH21  ARG 559          1HH2      ARG 559 -22.992  -9.193  -0.876
  388   HH22  ARG 559          2HH2      ARG 559 -23.381  -8.967  -2.548
  389    H    GLN 560           H        GLN 560 -15.553  -4.396  -0.570
  390    HA   GLN 560           HA       GLN 560 -15.983  -5.189  -3.285
  391    HB2  GLN 560           2HB      GLN 560 -15.036  -3.102  -3.898
  392    HB3  GLN 560           1HB      GLN 560 -15.955  -2.804  -2.431
  393    HG2  GLN 560           2HG      GLN 560 -12.993  -3.307  -2.411
  394    HG3  GLN 560           1HG      GLN 560 -13.692  -1.700  -2.600
  395   HE21  GLN 560          1HE2      GLN 560 -13.417  -4.461  -0.454
  396   HE22  GLN 560          2HE2      GLN 560 -13.771  -3.605   1.003
  Start of MODEL   11
    1    H1   ALA 507           1HT      ALA 507 -12.016 -10.243  -7.239
    2    H2   ALA 507           2HT      ALA 507 -12.009 -11.920  -6.876
    3    H3   ALA 507           3HT      ALA 507 -12.092 -10.767  -5.609
    4    HA   ALA 507           HA       ALA 507 -14.127 -10.890  -7.703
    5    HB1  ALA 507           1HB      ALA 507 -14.525 -12.297  -5.107
    6    HB2  ALA 507           2HB      ALA 507 -13.656 -13.120  -6.402
    7    HB3  ALA 507           3HB      ALA 507 -15.308 -12.561  -6.666
    8    H    GLN 508           H        GLN 508 -13.531 -10.509  -4.202
    9    HA   GLN 508           HA       GLN 508 -14.340  -7.828  -4.087
   10    HB2  GLN 508           2HB      GLN 508 -16.492  -9.836  -3.896
   11    HB3  GLN 508           1HB      GLN 508 -16.493  -8.627  -2.620
   12    HG2  GLN 508           2HG      GLN 508 -16.106  -7.180  -4.960
   13    HG3  GLN 508           1HG      GLN 508 -17.305  -8.403  -5.378
   14   HE21  GLN 508          1HE2      GLN 508 -18.944  -8.689  -3.446
   15   HE22  GLN 508          2HE2      GLN 508 -19.650  -7.210  -2.901
   16    HA   PRO 509           HA       PRO 509 -12.331  -9.859  -0.347
   17    HB2  PRO 509           2HB      PRO 509  -9.964  -8.547  -0.493
   18    HB3  PRO 509           1HB      PRO 509 -10.266 -10.068  -1.339
   19    HG2  PRO 509           2HG      PRO 509 -10.350  -7.266  -2.390
   20    HG3  PRO 509           1HG      PRO 509  -9.649  -8.719  -3.130
   21    HD2  PRO 509           2HD      PRO 509 -12.072  -7.737  -3.845
   22    HD3  PRO 509           1HD      PRO 509 -11.690  -9.470  -3.888
   23    H    LYS 510           H        LYS 510 -10.900  -8.392   1.328
   24    HA   LYS 510           HA       LYS 510 -12.238  -5.793   1.605
   25    HB2  LYS 510           2HB      LYS 510 -11.880  -7.716   3.904
   26    HB3  LYS 510           1HB      LYS 510 -12.740  -6.183   3.920
   27    HG2  LYS 510           2HG      LYS 510 -14.536  -7.519   3.707
   28    HG3  LYS 510           1HG      LYS 510 -14.114  -7.446   1.995
   29    HD2  LYS 510           2HD      LYS 510 -12.547  -9.496   2.809
   30    HD3  LYS 510           1HD      LYS 510 -13.919  -9.680   3.905
   31    HE2  LYS 510           2HE      LYS 510 -15.431  -9.979   2.141
   32    HE3  LYS 510           1HE      LYS 510 -14.306  -9.324   0.951
   33    HZ1  LYS 510           3HZ      LYS 510 -14.714 -11.920   1.295
   34    HZ2  LYS 510           1HZ      LYS 510 -13.429 -11.703   2.374
   35    HZ3  LYS 510           2HZ      LYS 510 -13.246 -11.286   0.746
   36    H    CYS 511           H        CYS 511 -10.814  -4.221   1.920
   37    HA   CYS 511           HA       CYS 511  -8.891  -3.106   2.408
   38    HB2  CYS 511           2HB      CYS 511  -9.374  -4.886   4.633
   39    HB3  CYS 511           1HB      CYS 511  -7.646  -4.652   4.398
   40    H    ASN 512           H        ASN 512  -7.811  -3.461   0.484
   41    HA   ASN 512           HA       ASN 512  -6.155  -5.831   0.232
   42    HB2  ASN 512           2HB      ASN 512  -6.464  -3.614  -1.788
   43    HB3  ASN 512           1HB      ASN 512  -5.812  -5.224  -2.057
   44   HD21  ASN 512          1HD2      ASN 512  -8.757  -3.508  -1.111
   45   HD22  ASN 512          2HD2      ASN 512  -9.852  -4.670  -1.766
   46    HA   PRO 513           HA       PRO 513  -2.769  -2.568   0.518
   47    HB2  PRO 513           2HB      PRO 513  -3.383   0.015   0.008
   48    HB3  PRO 513           1HB      PRO 513  -3.215  -1.192  -1.269
   49    HG2  PRO 513           2HG      PRO 513  -5.617   0.174  -0.396
   50    HG3  PRO 513           1HG      PRO 513  -5.409  -0.924  -1.768
   51    HD2  PRO 513           2HD      PRO 513  -6.398  -1.492   0.961
   52    HD3  PRO 513           1HD      PRO 513  -6.703  -2.355  -0.559
   53    H    ASN 514           H        ASN 514  -5.123  -2.698   2.608
   54    HA   ASN 514           HA       ASN 514  -3.998  -0.670   4.422
   55    HB2  ASN 514           2HB      ASN 514  -6.798  -1.332   3.757
   56    HB3  ASN 514           1HB      ASN 514  -6.466  -1.172   5.478
   57   HD21  ASN 514          1HD2      ASN 514  -6.551   0.459   2.404
   58   HD22  ASN 514          2HD2      ASN 514  -6.475   2.065   3.033
   59    H    LEU 515           H        LEU 515  -2.621  -2.806   4.436
   60    HA   LEU 515           HA       LEU 515  -3.683  -4.581   6.523
   61    HB2  LEU 515           2HB      LEU 515  -1.296  -5.374   4.965
   62    HB3  LEU 515           1HB      LEU 515  -2.615  -6.352   5.572
   63    HG   LEU 515           HG       LEU 515  -2.787  -6.470   3.236
   64   HD11  LEU 515          1HD1      LEU 515  -4.781  -4.999   4.697
   65   HD12  LEU 515          2HD1      LEU 515  -4.977  -6.206   3.428
   66   HD13  LEU 515          3HD1      LEU 515  -4.762  -4.509   3.004
   67   HD21  LEU 515          3HD2      LEU 515  -1.497  -3.984   3.268
   68   HD22  LEU 515          1HD2      LEU 515  -3.040  -3.714   2.459
   69   HD23  LEU 515          2HD2      LEU 515  -1.934  -4.950   1.858
   70    H    HIS 516           H        HIS 516  -0.681  -2.996   5.422
   71    HA   HIS 516           HA       HIS 516   0.053  -2.101   7.967
   72    HB2  HIS 516           2HB      HIS 516   1.471  -3.666   8.857
   73    HB3  HIS 516           1HB      HIS 516   0.342  -4.738   8.034
   74    HD1  HIS 516           1HD      HIS 516   1.213  -6.052   6.024
   75    HD2  HIS 516           2HD      HIS 516   3.976  -3.408   7.626
   76    HE1  HIS 516           1HE      HIS 516   3.365  -6.542   4.832
   77    HE2  HIS 516           2HE      HIS 516   5.035  -4.923   5.807
   78    H    TYR 517           H        TYR 517   1.696  -3.524   5.135
   79    HA   TYR 517           HA       TYR 517   3.871  -1.814   5.068
   80    HB2  TYR 517           2HB      TYR 517   3.313  -2.391   2.364
   81    HB3  TYR 517           1HB      TYR 517   4.505  -3.134   3.407
   82    HD1  TYR 517           2HD      TYR 517   0.774  -3.589   3.627
   83    HD2  TYR 517           1HD      TYR 517   4.535  -5.284   2.558
   84    HE1  TYR 517           2HE      TYR 517  -0.300  -5.768   3.305
   85    HE2  TYR 517           1HE      TYR 517   3.455  -7.464   2.221
   86    HH   TYR 517           HH       TYR 517   0.652  -8.332   3.408
   87    H    TRP 518           H        TRP 518   0.646  -1.034   4.283
   88    HA   TRP 518           HA       TRP 518   1.603   1.409   2.948
   89    HB2  TRP 518           2HB      TRP 518  -1.160   0.500   2.382
   90    HB3  TRP 518           1HB      TRP 518  -0.004   1.280   1.335
   91    HD1  TRP 518           HD       TRP 518   1.100  -1.996   2.878
   92    HE1  TRP 518           1HE      TRP 518   1.149  -3.777   1.101
   93    HE3  TRP 518           3HE      TRP 518  -1.198   0.573  -0.887
   94    HZ2  TRP 518           2HZ      TRP 518   0.305  -4.128  -1.569
   95    HZ3  TRP 518           3HZ      TRP 518  -1.538  -0.573  -3.039
   96    HH2  TRP 518           HH       TRP 518  -0.797  -2.875  -3.373
   97    H    THR 519           H        THR 519  -0.774  -0.045   5.063
   98    HA   THR 519           HA       THR 519  -2.207   2.299   5.699
   99    HB   THR 519           HB       THR 519  -3.123   0.096   6.140
  100    HG1  THR 519           1HG      THR 519  -3.730   0.434   8.337
  101   HG21  THR 519          3HG2      THR 519  -0.659  -0.633   6.989
  102   HG22  THR 519          1HG2      THR 519  -2.141  -1.537   7.300
  103   HG23  THR 519          2HG2      THR 519  -1.510  -0.435   8.522
  104    H    THR 520           H        THR 520   0.826   1.051   6.771
  105    HA   THR 520           HA       THR 520   0.883   2.784   9.105
  106    HB   THR 520           HB       THR 520   2.019   0.315   8.564
  107    HG1  THR 520           1HG      THR 520   1.547   1.030  10.611
  108   HG21  THR 520          3HG2      THR 520   3.928   1.036   7.387
  109   HG22  THR 520          1HG2      THR 520   4.462   0.743   9.042
  110   HG23  THR 520          2HG2      THR 520   4.192   2.393   8.481
  111    H    GLN 521           H        GLN 521   3.034   2.252   6.308
  112    HA   GLN 521           HA       GLN 521   3.931   5.015   6.605
  113    HB2  GLN 521           2HB      GLN 521   5.901   4.441   5.459
  114    HB3  GLN 521           1HB      GLN 521   5.586   3.089   6.536
  115    HG2  GLN 521           2HG      GLN 521   5.152   1.652   4.839
  116    HG3  GLN 521           1HG      GLN 521   4.555   2.911   3.769
  117   HE21  GLN 521          1HE2      GLN 521   6.601   4.695   3.655
  118   HE22  GLN 521          2HE2      GLN 521   8.012   3.948   2.996
  119    H    ASP 522           H        ASP 522   4.843   5.534   4.109
  120    HA   ASP 522           HA       ASP 522   2.328   5.828   2.630
  121    HB2  ASP 522           2HB      ASP 522   4.701   7.502   3.038
  122    HB3  ASP 522           1HB      ASP 522   4.078   7.505   1.394
  123    H    GLU 523           H        GLU 523   3.929   3.429   2.533
  124    HA   GLU 523           HA       GLU 523   4.938   1.959   1.091
  125    HB2  GLU 523           2HB      GLU 523   3.444   3.243  -1.158
  126    HB3  GLU 523           1HB      GLU 523   3.693   1.538  -0.816
  127    HG2  GLU 523           2HG      GLU 523   2.008   1.494   0.799
  128    HG3  GLU 523           1HG      GLU 523   1.987   3.251   0.951
  129    H    GLY 524           H        GLY 524   6.247   4.527   1.481
  130    HA2  GLY 524           2HA      GLY 524   8.494   4.421   0.050
  131    HA3  GLY 524           1HA      GLY 524   7.410   5.216  -1.084
  132    H    ALA 525           H        ALA 525   5.968   6.423   1.251
  133    HA   ALA 525           HA       ALA 525   5.894   8.607   1.938
  134    HB1  ALA 525           1HB      ALA 525   7.313   6.907   3.638
  135    HB2  ALA 525           2HB      ALA 525   6.389   8.346   4.069
  136    HB3  ALA 525           3HB      ALA 525   8.111   8.479   3.699
  137    H    ALA 526           H        ALA 526   7.631   8.364  -0.413
  138    HA   ALA 526           HA       ALA 526   9.288   9.466  -1.492
  139    HB1  ALA 526           1HB      ALA 526   8.471  11.995  -0.178
  140    HB2  ALA 526           2HB      ALA 526   7.245  11.098  -1.074
  141    HB3  ALA 526           3HB      ALA 526   8.714  11.639  -1.887
  142    H    ILE 527           H        ILE 527   9.836   8.644   1.414
  143    HA   ILE 527           HA       ILE 527  11.586  10.473   2.594
  144    HB   ILE 527           HB       ILE 527  12.692   8.282   3.467
  145   HG12  ILE 527          2HG1      ILE 527  11.108   7.160   1.521
  146   HG13  ILE 527          1HG1      ILE 527  11.836   6.289   2.862
  147   HG21  ILE 527          1HG2      ILE 527  10.738   7.992   5.054
  148   HG22  ILE 527          2HG2      ILE 527   9.922   9.229   4.098
  149   HG23  ILE 527          3HG2      ILE 527  11.429   9.609   4.930
  150   HD11  ILE 527          3HD1      ILE 527   9.702   6.799   4.129
  151   HD12  ILE 527          1HD1      ILE 527   9.594   5.648   2.795
  152   HD13  ILE 527          2HD1      ILE 527   9.056   7.309   2.570
  153    H    GLY 528           H        GLY 528  12.005   8.143   0.036
  154    HA2  GLY 528           2HA      GLY 528  14.096   9.378  -1.254
  155    HA3  GLY 528           1HA      GLY 528  14.870   8.339  -0.068
  156    H    LEU 529           H        LEU 529  13.032   6.203  -0.155
  157    HA   LEU 529           HA       LEU 529  12.498   4.307  -1.283
  158    HB2  LEU 529           2HB      LEU 529  12.880   6.075  -3.679
  159    HB3  LEU 529           1HB      LEU 529  12.407   4.395  -3.800
  160    HG   LEU 529           HG       LEU 529  10.320   4.810  -2.720
  161   HD11  LEU 529          1HD1      LEU 529  10.950   6.317  -0.987
  162   HD12  LEU 529          2HD1      LEU 529   9.733   7.130  -1.973
  163   HD13  LEU 529          3HD1      LEU 529  11.438   7.547  -2.152
  164   HD21  LEU 529          3HD2      LEU 529   9.515   6.838  -4.173
  165   HD22  LEU 529          1HD2      LEU 529   9.991   5.319  -4.931
  166   HD23  LEU 529          2HD2      LEU 529  11.114   6.678  -4.900
  167    H    ALA 530           H        ALA 530  15.462   5.903  -1.755
  168    HA   ALA 530           HA       ALA 530  16.707   3.727  -3.141
  169    HB1  ALA 530           1HB      ALA 530  17.450   6.104  -3.372
  170    HB2  ALA 530           2HB      ALA 530  18.748   4.970  -2.997
  171    HB3  ALA 530           3HB      ALA 530  18.086   6.004  -1.730
  172    H    TRP 531           H        TRP 531  15.981   4.490   0.055
  173    HA   TRP 531           HA       TRP 531  18.020   3.017   1.401
  174    HB2  TRP 531           2HB      TRP 531  16.574   3.366   3.380
  175    HB3  TRP 531           1HB      TRP 531  16.800   4.864   2.482
  176    HD1  TRP 531           HD       TRP 531  14.702   5.302   0.600
  177    HE1  TRP 531           1HE      TRP 531  12.204   5.095   1.039
  178    HE3  TRP 531           3HE      TRP 531  14.857   2.340   4.761
  179    HZ2  TRP 531           2HZ      TRP 531  10.479   3.856   2.916
  180    HZ3  TRP 531           3HZ      TRP 531  12.733   1.693   5.823
  181    HH2  TRP 531           HH       TRP 531  10.590   2.436   4.919
  182    H    ILE 532           H        ILE 532  15.308   2.153  -0.392
  183    HA   ILE 532           HA       ILE 532  15.180  -0.485   0.891
  184    HB   ILE 532           HB       ILE 532  12.784  -0.467  -0.072
  185   HG12  ILE 532          2HG1      ILE 532  13.426   2.485   0.005
  186   HG13  ILE 532          1HG1      ILE 532  12.912   1.553  -1.396
  187   HG21  ILE 532          1HG2      ILE 532  13.617   1.189   2.300
  188   HG22  ILE 532          2HG2      ILE 532  13.244  -0.537   2.286
  189   HG23  ILE 532          3HG2      ILE 532  11.964   0.645   2.000
  190   HD11  ILE 532          3HD1      ILE 532  10.740   1.183  -0.325
  191   HD12  ILE 532          1HD1      ILE 532  11.095   2.896  -0.548
  192   HD13  ILE 532          2HD1      ILE 532  11.265   2.160   1.045
  193    HA   PRO 533           HA       PRO 533  16.741  -0.572  -3.653
  194    HB2  PRO 533           2HB      PRO 533  18.058  -2.850  -2.236
  195    HB3  PRO 533           1HB      PRO 533  18.692  -1.804  -3.510
  196    HG2  PRO 533           2HG      PRO 533  19.379  -1.443  -0.952
  197    HG3  PRO 533           1HG      PRO 533  19.144  -0.072  -2.051
  198    HD2  PRO 533           2HD      PRO 533  17.446  -1.009   0.184
  199    HD3  PRO 533           1HD      PRO 533  17.591   0.609  -0.527
  200    H    TYR 534           H        TYR 534  15.738  -3.176  -1.440
  201    HA   TYR 534           HA       TYR 534  14.401  -4.471  -3.725
  202    HB2  TYR 534           2HB      TYR 534  14.617  -6.582  -2.441
  203    HB3  TYR 534           1HB      TYR 534  16.171  -5.854  -2.835
  204    HD1  TYR 534           2HD      TYR 534  13.651  -5.910  -0.069
  205    HD2  TYR 534           1HD      TYR 534  17.756  -5.670  -1.165
  206    HE1  TYR 534           2HE      TYR 534  14.284  -5.972   2.306
  207    HE2  TYR 534           1HE      TYR 534  18.399  -5.732   1.207
  208    HH   TYR 534           HH       TYR 534  17.248  -5.108   3.444
  209    H    PHE 535           H        PHE 535  13.627  -2.516  -1.290
  210    HA   PHE 535           HA       PHE 535  11.143  -3.958  -0.645
  211    HB2  PHE 535           2HB      PHE 535  12.422  -3.600   1.341
  212    HB3  PHE 535           1HB      PHE 535  12.703  -1.919   0.942
  213    HD1  PHE 535           2HD      PHE 535  10.683  -0.365   0.884
  214    HD2  PHE 535           1HD      PHE 535  10.618  -4.227   2.663
  215    HE1  PHE 535           2HE      PHE 535   8.711   0.284   2.202
  216    HE2  PHE 535           1HE      PHE 535   8.643  -3.586   3.987
  217    HZ   PHE 535           HZ       PHE 535   7.691  -1.326   3.756
  218    H    GLY 536           H        GLY 536  12.506  -1.079  -1.983
  219    HA2  GLY 536           2HA      GLY 536   9.804   0.096  -2.221
  220    HA3  GLY 536           1HA      GLY 536  11.292   1.029  -2.235
  221    HA   PRO 537           HA       PRO 537  11.381   1.356  -6.626
  222    HB2  PRO 537           2HB      PRO 537  14.092   0.111  -6.397
  223    HB3  PRO 537           1HB      PRO 537  13.589   1.546  -7.296
  224    HG2  PRO 537           2HG      PRO 537  14.873   1.737  -4.949
  225    HG3  PRO 537           1HG      PRO 537  13.620   2.894  -5.425
  226    HD2  PRO 537           2HD      PRO 537  13.536   0.760  -3.391
  227    HD3  PRO 537           1HD      PRO 537  12.574   2.242  -3.509
  228    H    ALA 538           H        ALA 538  12.815  -1.611  -5.296
  229    HA   ALA 538           HA       ALA 538  12.231  -3.193  -7.608
  230    HB1  ALA 538           1HB      ALA 538  14.058  -3.614  -5.887
  231    HB2  ALA 538           2HB      ALA 538  13.125  -5.016  -6.413
  232    HB3  ALA 538           3HB      ALA 538  12.785  -4.264  -4.853
  233    H    ALA 539           H        ALA 539  10.614  -2.438  -4.614
  234    HA   ALA 539           HA       ALA 539   8.680  -4.495  -4.637
  235    HB1  ALA 539           1HB      ALA 539   8.616  -3.570  -2.592
  236    HB2  ALA 539           2HB      ALA 539   7.440  -2.473  -3.317
  237    HB3  ALA 539           3HB      ALA 539   9.129  -1.991  -3.182
  238    H    GLU 540           H        GLU 540   6.495  -4.436  -5.233
  239    HA   GLU 540           HA       GLU 540   5.699  -2.299  -7.085
  240    HB2  GLU 540           2HB      GLU 540   5.395  -5.267  -7.575
  241    HB3  GLU 540           1HB      GLU 540   4.695  -4.002  -8.579
  242    HG2  GLU 540           2HG      GLU 540   7.058  -3.154  -8.907
  243    HG3  GLU 540           1HG      GLU 540   7.591  -4.673  -8.187
  244    H    GLY 541           H        GLY 541   4.809  -4.817  -4.838
  245    HA2  GLY 541           2HA      GLY 541   2.084  -3.684  -4.701
  246    HA3  GLY 541           1HA      GLY 541   2.449  -5.376  -4.386
  247    H    ILE 542           H        ILE 542   4.491  -2.770  -3.320
  248    HA   ILE 542           HA       ILE 542   3.466  -2.958  -0.587
  249    HB   ILE 542           HB       ILE 542   6.425  -2.996  -0.892
  250   HG12  ILE 542          2HG1      ILE 542   6.224  -5.582  -0.727
  251   HG13  ILE 542          1HG1      ILE 542   4.636  -5.343  -1.450
  252   HG21  ILE 542          1HG2      ILE 542   5.945  -2.894   1.318
  253   HG22  ILE 542          2HG2      ILE 542   5.870  -4.647   1.136
  254   HG23  ILE 542          3HG2      ILE 542   4.386  -3.694   1.129
  255   HD11  ILE 542          3HD1      ILE 542   5.807  -5.621  -3.353
  256   HD12  ILE 542          1HD1      ILE 542   7.320  -5.074  -2.633
  257   HD13  ILE 542          2HD1      ILE 542   6.113  -3.895  -3.149
  258    H    TYR 543           H        TYR 543   5.396  -1.362  -3.026
  259    HA   TYR 543           HA       TYR 543   5.587   1.022  -1.369
  260    HB2  TYR 543           2HB      TYR 543   7.591   1.367  -2.332
  261    HB3  TYR 543           1HB      TYR 543   7.487  -0.323  -2.768
  262    HD1  TYR 543           2HD      TYR 543   6.120  -0.723  -5.044
  263    HD2  TYR 543           1HD      TYR 543   8.207   2.833  -3.999
  264    HE1  TYR 543           2HE      TYR 543   6.297  -0.137  -7.418
  265    HE2  TYR 543           1HE      TYR 543   8.397   3.432  -6.372
  266    HH   TYR 543           HH       TYR 543   7.623   1.223  -8.893
  267    H    ILE 544           H        ILE 544   4.313  -0.253  -4.351
  268    HA   ILE 544           HA       ILE 544   3.194   0.703  -6.123
  269    HB   ILE 544           HB       ILE 544   1.509   1.871  -3.936
  270   HG12  ILE 544          2HG1      ILE 544   0.406  -0.519  -4.153
  271   HG13  ILE 544          1HG1      ILE 544   2.043  -0.988  -4.594
  272   HG21  ILE 544          1HG2      ILE 544   0.492   2.418  -5.911
  273   HG22  ILE 544          2HG2      ILE 544  -0.244   0.846  -5.600
  274   HG23  ILE 544          3HG2      ILE 544   1.094   0.983  -6.742
  275   HD11  ILE 544          3HD1      ILE 544   1.601  -1.327  -2.223
  276   HD12  ILE 544          1HD1      ILE 544   1.240   0.388  -2.043
  277   HD13  ILE 544          2HD1      ILE 544   2.868  -0.130  -2.477
  278    H    GLU 545           H        GLU 545   2.760   3.220  -3.675
  279    HA   GLU 545           HA       GLU 545   3.171   5.452  -3.665
  280    HB2  GLU 545           2HB      GLU 545   4.825   5.018  -6.145
  281    HB3  GLU 545           1HB      GLU 545   4.930   6.357  -5.007
  282    HG2  GLU 545           2HG      GLU 545   5.515   4.614  -3.259
  283    HG3  GLU 545           1HG      GLU 545   5.749   3.504  -4.607
  284    H    GLY 546           H        GLY 546   0.904   4.365  -4.954
  285    HA2  GLY 546           2HA      GLY 546   0.285   6.618  -6.728
  286    HA3  GLY 546           1HA      GLY 546  -0.050   4.988  -7.290
  287    H    LEU 547           H        LEU 547  -0.536   4.917  -4.024
  288    HA   LEU 547           HA       LEU 547  -3.262   5.973  -4.113
  289    HB2  LEU 547           2HB      LEU 547  -4.312   3.950  -3.493
  290    HB3  LEU 547           1HB      LEU 547  -3.329   3.620  -4.905
  291    HG   LEU 547           HG       LEU 547  -2.339   3.031  -2.129
  292   HD11  LEU 547          1HD1      LEU 547  -3.832   1.130  -3.930
  293   HD12  LEU 547          2HD1      LEU 547  -4.505   1.890  -2.487
  294   HD13  LEU 547          3HD1      LEU 547  -3.146   0.775  -2.345
  295   HD21  LEU 547          3HD2      LEU 547  -0.589   2.977  -3.696
  296   HD22  LEU 547          1HD2      LEU 547  -1.586   2.176  -4.909
  297   HD23  LEU 547          2HD2      LEU 547  -1.060   1.293  -3.476
  298    H    MET 548           H        MET 548  -0.459   5.510  -2.381
  299    HA   MET 548           HA       MET 548  -1.634   5.271   0.220
  300    HB2  MET 548           2HB      MET 548   0.867   6.101   0.813
  301    HB3  MET 548           1HB      MET 548   0.434   4.431   0.510
  302    HG2  MET 548           2HG      MET 548   2.390   4.824  -0.707
  303    HG3  MET 548           1HG      MET 548   1.103   4.829  -1.900
  304    HE1  MET 548           3HE      MET 548   2.018   7.468  -3.931
  305    HE2  MET 548           1HE      MET 548   0.440   7.740  -3.193
  306    HE3  MET 548           2HE      MET 548   0.987   6.098  -3.526
  307    H    HIS 549           H        HIS 549  -3.106   7.056  -0.003
  308    HA   HIS 549           HA       HIS 549  -1.859   9.558   0.885
  309    HB2  HIS 549           2HB      HIS 549  -4.301   9.976  -0.684
  310    HB3  HIS 549           1HB      HIS 549  -2.771  10.842  -0.735
  311    HD1  HIS 549           1HD      HIS 549  -4.797   9.264  -2.989
  312    HD2  HIS 549           2HD      HIS 549  -0.791   8.717  -2.033
  313    HE1  HIS 549           1HE      HIS 549  -3.774   8.152  -4.997
  314    HE2  HIS 549           2HE      HIS 549  -1.328   7.925  -4.437
  315    H    ASN 550           H        ASN 550  -3.175   7.322   2.257
  316    HA   ASN 550           HA       ASN 550  -4.641   6.970   3.957
  317    HB2  ASN 550           2HB      ASN 550  -4.912   9.982   3.921
  318    HB3  ASN 550           1HB      ASN 550  -5.424   8.916   5.225
  319   HD21  ASN 550          1HD2      ASN 550  -3.142  11.026   4.433
  320   HD22  ASN 550          2HD2      ASN 550  -1.792  10.388   5.303
  321    H    GLN 551           H        GLN 551  -6.138   5.875   2.671
  322    HA   GLN 551           HA       GLN 551  -8.486   7.462   1.893
  323    HB2  GLN 551           2HB      GLN 551  -8.569   5.014   0.493
  324    HB3  GLN 551           1HB      GLN 551  -8.341   6.625  -0.165
  325    HG2  GLN 551           2HG      GLN 551  -6.393   5.887  -0.924
  326    HG3  GLN 551           1HG      GLN 551  -5.822   5.953   0.739
  327   HE21  GLN 551          1HE2      GLN 551  -5.898   4.019   1.996
  328   HE22  GLN 551          2HE2      GLN 551  -5.868   2.469   1.233
  329    H    ASP 552           H        ASP 552  -7.992   3.997   2.134
  330    HA   ASP 552           HA       ASP 552  -9.003   2.369   3.359
  331    HB2  ASP 552           2HB      ASP 552  -8.456   4.217   5.217
  332    HB3  ASP 552           1HB      ASP 552 -10.214   4.292   5.287
  333    H    GLY 553           H        GLY 553 -10.376   4.031   1.282
  334    HA2  GLY 553           2HA      GLY 553 -13.130   3.210   1.952
  335    HA3  GLY 553           1HA      GLY 553 -12.803   4.759   1.188
  336    H    LEU 554           H        LEU 554 -10.710   3.779  -0.517
  337    HA   LEU 554           HA       LEU 554 -12.340   2.734  -2.653
  338    HB2  LEU 554           2HB      LEU 554 -10.323   3.028  -4.007
  339    HB3  LEU 554           1HB      LEU 554 -10.728   4.478  -3.110
  340    HG   LEU 554           HG       LEU 554  -8.964   3.212  -1.407
  341   HD11  LEU 554          1HD1      LEU 554  -8.640   1.800  -3.694
  342   HD12  LEU 554          2HD1      LEU 554  -7.368   2.066  -2.505
  343   HD13  LEU 554          3HD1      LEU 554  -7.464   3.090  -3.936
  344   HD21  LEU 554          3HD2      LEU 554  -8.601   5.350  -3.492
  345   HD22  LEU 554          1HD2      LEU 554  -7.318   4.903  -2.367
  346   HD23  LEU 554          2HD2      LEU 554  -8.847   5.535  -1.756
  347    H    ILE 555           H        ILE 555 -10.880   1.272  -0.139
  348    HA   ILE 555           HA       ILE 555 -10.544  -1.231  -1.608
  349    HB   ILE 555           HB       ILE 555  -8.542  -1.792  -0.292
  350   HG12  ILE 555          2HG1      ILE 555  -8.928  -0.289   1.623
  351   HG13  ILE 555          1HG1      ILE 555  -7.334  -0.066   0.933
  352   HG21  ILE 555          1HG2      ILE 555  -7.316   0.477  -1.401
  353   HG22  ILE 555          2HG2      ILE 555  -8.699   0.095  -2.428
  354   HG23  ILE 555          3HG2      ILE 555  -7.470  -1.132  -2.108
  355   HD11  ILE 555          3HD1      ILE 555  -9.534   1.811   1.173
  356   HD12  ILE 555          1HD1      ILE 555  -8.777   1.787  -0.418
  357   HD13  ILE 555          2HD1      ILE 555  -7.802   2.094   1.016
  358    H    CYS 556           H        CYS 556 -10.765   0.393   1.512
  359    HA   CYS 556           HA       CYS 556 -11.967  -2.029   2.640
  360    HB2  CYS 556           2HB      CYS 556  -9.839  -0.544   3.570
  361    HB3  CYS 556           1HB      CYS 556 -11.183   0.077   4.523
  362    H    GLY 557           H        GLY 557 -14.100  -1.977   2.939
  363    HA2  GLY 557           2HA      GLY 557 -15.388   0.383   3.994
  364    HA3  GLY 557           1HA      GLY 557 -15.850  -0.002   2.345
  365    H    LEU 558           H        LEU 558 -16.558  -2.341   2.015
  366    HA   LEU 558           HA       LEU 558 -17.897  -3.388   4.400
  367    HB2  LEU 558           2HB      LEU 558 -19.968  -3.748   3.170
  368    HB3  LEU 558           1HB      LEU 558 -19.553  -2.048   3.239
  369    HG   LEU 558           HG       LEU 558 -18.922  -3.738   0.831
  370   HD11  LEU 558          1HD1      LEU 558 -21.457  -3.444   1.682
  371   HD12  LEU 558          2HD1      LEU 558 -20.994  -3.532  -0.017
  372   HD13  LEU 558          3HD1      LEU 558 -21.267  -1.964   0.742
  373   HD21  LEU 558          3HD2      LEU 558 -17.835  -1.853   0.320
  374   HD22  LEU 558          1HD2      LEU 558 -18.636  -0.935   1.595
  375   HD23  LEU 558          2HD2      LEU 558 -19.433  -1.166   0.038
  376    H    ARG 559           H        ARG 559 -17.011  -4.007   1.004
  377    HA   ARG 559           HA       ARG 559 -15.774  -6.448   1.504
  378    HB2  ARG 559           2HB      ARG 559 -17.420  -8.062   0.689
  379    HB3  ARG 559           1HB      ARG 559 -18.026  -7.233   2.117
  380    HG2  ARG 559           2HG      ARG 559 -18.726  -5.929  -0.399
  381    HG3  ARG 559           1HG      ARG 559 -19.395  -7.555  -0.216
  382    HD2  ARG 559           2HD      ARG 559 -19.659  -5.322   1.794
  383    HD3  ARG 559           1HD      ARG 559 -20.902  -5.794   0.638
  384    HE   ARG 559           HE       ARG 559 -20.164  -7.169   3.071
  385   HH11  ARG 559          1HH1      ARG 559 -21.787  -7.404  -0.012
  386   HH12  ARG 559          2HH1      ARG 559 -22.784  -8.732   0.475
  387   HH21  ARG 559          1HH2      ARG 559 -21.474  -8.915   3.710
  388   HH22  ARG 559          2HH2      ARG 559 -22.608  -9.590   2.587
  389    H    GLN 560           H        GLN 560 -15.393  -4.200  -0.101
  390    HA   GLN 560           HA       GLN 560 -15.751  -5.181  -2.836
  391    HB2  GLN 560           2HB      GLN 560 -15.416  -2.973  -3.597
  392    HB3  GLN 560           1HB      GLN 560 -16.436  -2.829  -2.174
  393    HG2  GLN 560           2HG      GLN 560 -13.778  -2.652  -1.274
  394    HG3  GLN 560           1HG      GLN 560 -13.897  -1.636  -2.709
  395   HE21  GLN 560          1HE2      GLN 560 -15.492  -2.337   0.363
  396   HE22  GLN 560          2HE2      GLN 560 -16.054  -0.728   0.640
  Start of MODEL   12
    1    H1   ALA 507           1HT      ALA 507 -12.637  -9.715  -8.702
    2    H2   ALA 507           2HT      ALA 507 -13.282 -10.269  -7.212
    3    H3   ALA 507           3HT      ALA 507 -11.839  -9.339  -7.233
    4    HA   ALA 507           HA       ALA 507 -12.908  -7.421  -7.762
    5    HB1  ALA 507           1HB      ALA 507 -14.765  -9.235  -9.049
    6    HB2  ALA 507           2HB      ALA 507 -14.413  -7.542  -9.398
    7    HB3  ALA 507           3HB      ALA 507 -15.597  -7.960  -8.158
    8    H    GLN 508           H        GLN 508 -12.601  -9.113  -5.386
    9    HA   GLN 508           HA       GLN 508 -14.322  -7.612  -3.636
   10    HB2  GLN 508           2HB      GLN 508 -14.809 -10.489  -4.196
   11    HB3  GLN 508           1HB      GLN 508 -14.918  -9.974  -2.519
   12    HG2  GLN 508           2HG      GLN 508 -16.433  -8.086  -3.549
   13    HG3  GLN 508           1HG      GLN 508 -16.633  -9.272  -4.839
   14   HE21  GLN 508          1HE2      GLN 508 -17.107  -8.636  -1.433
   15   HE22  GLN 508          2HE2      GLN 508 -18.298  -9.859  -1.172
   16    HA   PRO 509           HA       PRO 509 -10.137  -9.118  -2.029
   17    HB2  PRO 509           2HB      PRO 509  -8.766  -6.801  -2.181
   18    HB3  PRO 509           1HB      PRO 509  -8.864  -7.926  -3.540
   19    HG2  PRO 509           2HG      PRO 509 -10.419  -5.414  -3.047
   20    HG3  PRO 509           1HG      PRO 509  -9.680  -5.995  -4.551
   21    HD2  PRO 509           2HD      PRO 509 -12.332  -6.264  -3.989
   22    HD3  PRO 509           1HD      PRO 509 -11.434  -7.406  -5.010
   23    H    LYS 510           H        LYS 510 -10.139  -9.205   0.123
   24    HA   LYS 510           HA       LYS 510 -11.586  -7.280   1.689
   25    HB2  LYS 510           2HB      LYS 510  -9.831  -9.510   2.712
   26    HB3  LYS 510           1HB      LYS 510 -11.144  -8.707   3.560
   27    HG2  LYS 510           2HG      LYS 510 -12.374 -10.452   2.921
   28    HG3  LYS 510           1HG      LYS 510 -12.409  -9.668   1.340
   29    HD2  LYS 510           2HD      LYS 510 -10.780 -11.066   0.468
   30    HD3  LYS 510           1HD      LYS 510 -10.142 -11.481   2.060
   31    HE2  LYS 510           2HE      LYS 510 -12.678 -12.428   2.248
   32    HE3  LYS 510           1HE      LYS 510 -12.351 -12.675   0.533
   33    HZ1  LYS 510           3HZ      LYS 510 -10.757 -13.710   2.814
   34    HZ2  LYS 510           1HZ      LYS 510 -10.294 -13.846   1.192
   35    HZ3  LYS 510           2HZ      LYS 510 -11.697 -14.616   1.738
   36    H    CYS 511           H        CYS 511 -10.449  -5.343   1.385
   37    HA   CYS 511           HA       CYS 511  -8.953  -3.718   1.908
   38    HB2  CYS 511           2HB      CYS 511  -8.051  -5.606   4.090
   39    HB3  CYS 511           1HB      CYS 511  -7.806  -3.862   4.037
   40    H    ASN 512           H        ASN 512  -7.338  -3.275   0.612
   41    HA   ASN 512           HA       ASN 512  -5.270  -5.298   0.172
   42    HB2  ASN 512           2HB      ASN 512  -5.871  -2.959  -1.632
   43    HB3  ASN 512           1HB      ASN 512  -4.848  -4.342  -1.978
   44   HD21  ASN 512          1HD2      ASN 512  -8.195  -3.672  -0.951
   45   HD22  ASN 512          2HD2      ASN 512  -8.914  -4.850  -1.978
   46    HA   PRO 513           HA       PRO 513  -2.750  -1.473   1.236
   47    HB2  PRO 513           2HB      PRO 513  -3.814   0.975   0.810
   48    HB3  PRO 513           1HB      PRO 513  -3.237  -0.050  -0.509
   49    HG2  PRO 513           2HG      PRO 513  -5.957   0.736   0.074
   50    HG3  PRO 513           1HG      PRO 513  -5.352  -0.198  -1.303
   51    HD2  PRO 513           2HD      PRO 513  -6.525  -1.151   1.250
   52    HD3  PRO 513           1HD      PRO 513  -6.495  -1.928  -0.345
   53    H    ASN 514           H        ASN 514  -5.348  -2.198   2.929
   54    HA   ASN 514           HA       ASN 514  -4.857  -0.167   5.000
   55    HB2  ASN 514           2HB      ASN 514  -7.403  -1.299   3.939
   56    HB3  ASN 514           1HB      ASN 514  -7.319  -0.973   5.668
   57   HD21  ASN 514          1HD2      ASN 514  -7.693   0.366   2.549
   58   HD22  ASN 514          2HD2      ASN 514  -7.770   2.025   3.021
   59    H    LEU 515           H        LEU 515  -3.196  -2.160   5.051
   60    HA   LEU 515           HA       LEU 515  -4.239  -4.053   7.050
   61    HB2  LEU 515           2HB      LEU 515  -1.740  -4.810   5.726
   62    HB3  LEU 515           1HB      LEU 515  -3.157  -5.771   6.083
   63    HG   LEU 515           HG       LEU 515  -2.860  -5.780   3.728
   64   HD11  LEU 515          1HD1      LEU 515  -4.927  -4.000   3.252
   65   HD12  LEU 515          2HD1      LEU 515  -5.159  -4.502   4.926
   66   HD13  LEU 515          3HD1      LEU 515  -5.074  -5.711   3.646
   67   HD21  LEU 515          3HD2      LEU 515  -1.799  -3.215   4.108
   68   HD22  LEU 515          1HD2      LEU 515  -3.209  -3.005   3.069
   69   HD23  LEU 515          2HD2      LEU 515  -1.923  -4.116   2.597
   70    H    HIS 516           H        HIS 516  -1.003  -2.957   6.006
   71    HA   HIS 516           HA       HIS 516  -0.475  -1.741   8.552
   72    HB2  HIS 516           2HB      HIS 516   0.995  -3.244   9.491
   73    HB3  HIS 516           1HB      HIS 516  -0.163  -4.339   8.742
   74    HD1  HIS 516           1HD      HIS 516   0.616  -5.620   6.632
   75    HD2  HIS 516           2HD      HIS 516   3.515  -3.205   8.354
   76    HE1  HIS 516           1HE      HIS 516   2.752  -6.217   5.467
   77    HE2  HIS 516           2HE      HIS 516   4.503  -4.729   6.502
   78    H    TYR 517           H        TYR 517   1.238  -3.169   5.757
   79    HA   TYR 517           HA       TYR 517   3.421  -1.470   5.705
   80    HB2  TYR 517           2HB      TYR 517   2.674  -1.987   2.987
   81    HB3  TYR 517           1HB      TYR 517   4.036  -2.606   3.893
   82    HD1  TYR 517           2HD      TYR 517   0.359  -3.398   4.244
   83    HD2  TYR 517           1HD      TYR 517   4.257  -4.785   3.238
   84    HE1  TYR 517           2HE      TYR 517  -0.523  -5.667   3.979
   85    HE2  TYR 517           1HE      TYR 517   3.373  -7.059   2.952
   86    HH   TYR 517           HH       TYR 517   1.174  -8.134   2.453
   87    H    TRP 518           H        TRP 518   0.240  -0.547   5.194
   88    HA   TRP 518           HA       TRP 518   1.112   1.836   3.703
   89    HB2  TRP 518           2HB      TRP 518  -1.694   0.794   3.585
   90    HB3  TRP 518           1HB      TRP 518  -0.830   1.761   2.411
   91    HD1  TRP 518           HD       TRP 518   0.181  -1.680   3.830
   92    HE1  TRP 518           1HE      TRP 518   0.478  -3.282   1.886
   93    HE3  TRP 518           3HE      TRP 518  -1.279   1.399   0.031
   94    HZ2  TRP 518           2HZ      TRP 518   0.097  -3.295  -0.913
   95    HZ3  TRP 518           3HZ      TRP 518  -1.291   0.505  -2.261
   96    HH2  TRP 518           HH       TRP 518  -0.614  -1.795  -2.723
   97    H    THR 519           H        THR 519  -1.191   0.500   5.972
   98    HA   THR 519           HA       THR 519  -2.383   2.899   6.808
   99    HB   THR 519           HB       THR 519  -3.303   0.648   7.264
  100    HG1  THR 519           1HG      THR 519  -3.800   2.562   8.590
  101   HG21  THR 519          3HG2      THR 519  -2.277  -0.925   8.446
  102   HG22  THR 519          1HG2      THR 519  -1.801   0.211   9.706
  103   HG23  THR 519          2HG2      THR 519  -0.813   0.041   8.253
  104    H    THR 520           H        THR 520   0.580   1.349   7.730
  105    HA   THR 520           HA       THR 520   0.980   3.017  10.052
  106    HB   THR 520           HB       THR 520   2.194   0.635   8.940
  107    HG1  THR 520           1HG      THR 520   1.249   1.062  11.082
  108   HG21  THR 520          3HG2      THR 520   4.082   2.803   9.802
  109   HG22  THR 520          1HG2      THR 520   4.162   1.780   8.367
  110   HG23  THR 520          2HG2      THR 520   4.471   1.090   9.961
  111    H    GLN 521           H        GLN 521   2.920   2.528   7.107
  112    HA   GLN 521           HA       GLN 521   3.902   5.262   7.406
  113    HB2  GLN 521           2HB      GLN 521   5.784   4.637   6.134
  114    HB3  GLN 521           1HB      GLN 521   5.475   3.278   7.205
  115    HG2  GLN 521           2HG      GLN 521   4.763   1.916   5.492
  116    HG3  GLN 521           1HG      GLN 521   4.359   3.269   4.445
  117   HE21  GLN 521          1HE2      GLN 521   6.426   4.737   4.057
  118   HE22  GLN 521          2HE2      GLN 521   7.816   3.850   3.534
  119    H    ASP 522           H        ASP 522   4.744   5.590   4.738
  120    HA   ASP 522           HA       ASP 522   2.162   6.208   3.498
  121    HB2  ASP 522           2HB      ASP 522   4.868   7.433   3.394
  122    HB3  ASP 522           1HB      ASP 522   3.795   7.643   2.017
  123    H    GLU 523           H        GLU 523   3.268   3.586   3.330
  124    HA   GLU 523           HA       GLU 523   3.897   1.937   1.859
  125    HB2  GLU 523           2HB      GLU 523   2.386   3.510  -0.209
  126    HB3  GLU 523           1HB      GLU 523   2.499   1.766  -0.023
  127    HG2  GLU 523           2HG      GLU 523   0.850   1.683   1.478
  128    HG3  GLU 523           1HG      GLU 523   1.336   3.188   2.256
  129    H    GLY 524           H        GLY 524   5.712   4.066   2.129
  130    HA2  GLY 524           2HA      GLY 524   7.803   3.666   0.638
  131    HA3  GLY 524           1HA      GLY 524   6.796   4.467  -0.562
  132    H    ALA 525           H        ALA 525   5.532   6.314   1.113
  133    HA   ALA 525           HA       ALA 525   5.797   8.437   1.865
  134    HB1  ALA 525           1HB      ALA 525   8.318   8.210   3.193
  135    HB2  ALA 525           2HB      ALA 525   7.329   6.783   3.502
  136    HB3  ALA 525           3HB      ALA 525   6.703   8.387   3.883
  137    H    ALA 526           H        ALA 526   7.573   7.330  -0.541
  138    HA   ALA 526           HA       ALA 526   9.141   8.152  -1.960
  139    HB1  ALA 526           1HB      ALA 526   8.369  10.938  -1.325
  140    HB2  ALA 526           2HB      ALA 526   7.095   9.853  -1.881
  141    HB3  ALA 526           3HB      ALA 526   8.518  10.131  -2.886
  142    H    ILE 527           H        ILE 527   9.699   8.118   1.072
  143    HA   ILE 527           HA       ILE 527  11.409  10.175   1.782
  144    HB   ILE 527           HB       ILE 527  12.614   8.150   3.052
  145   HG12  ILE 527          2HG1      ILE 527  11.107   6.359   3.568
  146   HG13  ILE 527          1HG1      ILE 527   9.815   7.110   2.641
  147   HG21  ILE 527          1HG2      ILE 527  10.512   8.427   4.680
  148   HG22  ILE 527          2HG2      ILE 527  10.236   9.792   3.598
  149   HG23  ILE 527          3HG2      ILE 527  11.756   9.660   4.482
  150   HD11  ILE 527          3HD1      ILE 527  12.361   6.314   1.303
  151   HD12  ILE 527          1HD1      ILE 527  10.747   6.505   0.619
  152   HD13  ILE 527          2HD1      ILE 527  11.109   5.120   1.644
  153    H    GLY 528           H        GLY 528  11.948   7.584  -0.461
  154    HA2  GLY 528           2HA      GLY 528  14.198   8.729  -1.615
  155    HA3  GLY 528           1HA      GLY 528  14.795   7.618  -0.394
  156    H    LEU 529           H        LEU 529  13.189   5.478  -0.578
  157    HA   LEU 529           HA       LEU 529  12.596   3.637  -1.782
  158    HB2  LEU 529           2HB      LEU 529  12.985   5.470  -4.123
  159    HB3  LEU 529           1HB      LEU 529  12.554   3.786  -4.302
  160    HG   LEU 529           HG       LEU 529  10.439   4.118  -3.264
  161   HD11  LEU 529          1HD1      LEU 529  11.423   6.886  -2.590
  162   HD12  LEU 529          2HD1      LEU 529  11.079   5.578  -1.458
  163   HD13  LEU 529          3HD1      LEU 529   9.765   6.323  -2.368
  164   HD21  LEU 529          3HD2      LEU 529   9.908   4.770  -5.341
  165   HD22  LEU 529          1HD2      LEU 529  11.288   5.861  -5.457
  166   HD23  LEU 529          2HD2      LEU 529   9.813   6.386  -4.644
  167    H    ALA 530           H        ALA 530  15.553   5.264  -2.191
  168    HA   ALA 530           HA       ALA 530  16.828   3.118  -3.609
  169    HB1  ALA 530           1HB      ALA 530  18.929   4.363  -3.153
  170    HB2  ALA 530           2HB      ALA 530  17.996   5.514  -2.195
  171    HB3  ALA 530           3HB      ALA 530  17.689   5.352  -3.924
  172    H    TRP 531           H        TRP 531  16.306   4.065  -0.355
  173    HA   TRP 531           HA       TRP 531  18.214   2.480   0.986
  174    HB2  TRP 531           2HB      TRP 531  16.813   2.911   2.958
  175    HB3  TRP 531           1HB      TRP 531  16.976   4.382   2.004
  176    HD1  TRP 531           HD       TRP 531  14.796   4.221  -0.071
  177    HE1  TRP 531           1HE      TRP 531  12.332   4.147   0.525
  178    HE3  TRP 531           3HE      TRP 531  15.188   2.545   4.741
  179    HZ2  TRP 531           2HZ      TRP 531  10.710   3.480   2.756
  180    HZ3  TRP 531           3HZ      TRP 531  13.124   2.218   6.041
  181    HH2  TRP 531           HH       TRP 531  10.932   2.677   5.067
  182    H    ILE 532           H        ILE 532  15.350   1.707  -0.691
  183    HA   ILE 532           HA       ILE 532  15.246  -0.946   0.562
  184    HB   ILE 532           HB       ILE 532  12.804  -0.881  -0.171
  185   HG12  ILE 532          2HG1      ILE 532  13.545   2.029  -0.438
  186   HG13  ILE 532          1HG1      ILE 532  12.760   1.005  -1.628
  187   HG21  ILE 532          1HG2      ILE 532  13.490  -0.786   2.148
  188   HG22  ILE 532          2HG2      ILE 532  12.159   0.343   1.885
  189   HG23  ILE 532          3HG2      ILE 532  13.817   0.943   2.003
  190   HD11  ILE 532          3HD1      ILE 532  10.749   0.948  -0.298
  191   HD12  ILE 532          1HD1      ILE 532  11.234   2.619  -0.582
  192   HD13  ILE 532          2HD1      ILE 532  11.541   1.866   0.982
  193    HA   PRO 533           HA       PRO 533  16.485  -1.156  -4.043
  194    HB2  PRO 533           2HB      PRO 533  17.791  -3.506  -2.742
  195    HB3  PRO 533           1HB      PRO 533  18.392  -2.455  -4.031
  196    HG2  PRO 533           2HG      PRO 533  19.264  -2.181  -1.528
  197    HG3  PRO 533           1HG      PRO 533  18.985  -0.768  -2.562
  198    HD2  PRO 533           2HD      PRO 533  17.389  -1.783  -0.271
  199    HD3  PRO 533           1HD      PRO 533  17.598  -0.124  -0.860
  200    H    TYR 534           H        TYR 534  15.376  -3.612  -1.726
  201    HA   TYR 534           HA       TYR 534  13.865  -4.864  -3.928
  202    HB2  TYR 534           2HB      TYR 534  14.048  -6.991  -2.624
  203    HB3  TYR 534           1HB      TYR 534  15.586  -6.379  -3.226
  204    HD1  TYR 534           1HD      TYR 534  13.445  -6.115  -0.158
  205    HD2  TYR 534           2HD      TYR 534  17.373  -6.395  -1.775
  206    HE1  TYR 534           1HE      TYR 534  14.371  -6.194   2.116
  207    HE2  TYR 534           2HE      TYR 534  18.307  -6.475   0.497
  208    HH   TYR 534           HH       TYR 534  17.528  -7.120   2.788
  209    H    PHE 535           H        PHE 535  13.379  -2.905  -1.419
  210    HA   PHE 535           HA       PHE 535  10.910  -4.257  -0.563
  211    HB2  PHE 535           2HB      PHE 535  12.330  -3.908   1.307
  212    HB3  PHE 535           1HB      PHE 535  12.670  -2.256   0.843
  213    HD1  PHE 535           2HD      PHE 535  10.730  -0.595   0.892
  214    HD2  PHE 535           1HD      PHE 535  10.623  -4.397   2.796
  215    HE1  PHE 535           2HE      PHE 535   8.913   0.194   2.347
  216    HE2  PHE 535           1HE      PHE 535   8.803  -3.615   4.260
  217    HZ   PHE 535           HZ       PHE 535   7.951  -1.314   4.035
  218    H    GLY 536           H        GLY 536  12.230  -1.402  -2.021
  219    HA2  GLY 536           2HA      GLY 536   9.526  -0.206  -2.109
  220    HA3  GLY 536           1HA      GLY 536  11.015   0.713  -2.224
  221    HA   PRO 537           HA       PRO 537  10.891   1.023  -6.615
  222    HB2  PRO 537           2HB      PRO 537  13.544  -0.361  -6.509
  223    HB3  PRO 537           1HB      PRO 537  13.069   1.086  -7.406
  224    HG2  PRO 537           2HG      PRO 537  14.473   1.230  -5.113
  225    HG3  PRO 537           1HG      PRO 537  13.285   2.461  -5.570
  226    HD2  PRO 537           2HD      PRO 537  13.150   0.423  -3.459
  227    HD3  PRO 537           1HD      PRO 537  12.234   1.928  -3.629
  228    H    ALA 538           H        ALA 538  12.249  -2.012  -5.353
  229    HA   ALA 538           HA       ALA 538  11.445  -3.564  -7.618
  230    HB1  ALA 538           1HB      ALA 538  13.358  -4.091  -6.046
  231    HB2  ALA 538           2HB      ALA 538  12.296  -5.439  -6.453
  232    HB3  ALA 538           3HB      ALA 538  12.139  -4.634  -4.892
  233    H    ALA 539           H        ALA 539  10.103  -2.832  -4.464
  234    HA   ALA 539           HA       ALA 539   8.072  -4.743  -4.330
  235    HB1  ALA 539           1HB      ALA 539   8.066  -3.718  -2.344
  236    HB2  ALA 539           2HB      ALA 539   6.975  -2.557  -3.101
  237    HB3  ALA 539           3HB      ALA 539   8.702  -2.217  -3.015
  238    H    GLU 540           H        GLU 540   5.786  -4.493  -4.684
  239    HA   GLU 540           HA       GLU 540   5.047  -2.533  -6.742
  240    HB2  GLU 540           2HB      GLU 540   4.300  -5.462  -6.836
  241    HB3  GLU 540           1HB      GLU 540   3.853  -4.231  -8.010
  242    HG2  GLU 540           2HG      GLU 540   5.912  -4.194  -8.970
  243    HG3  GLU 540           1HG      GLU 540   6.738  -4.647  -7.479
  244    H    GLY 541           H        GLY 541   4.101  -4.714  -4.184
  245    HA2  GLY 541           2HA      GLY 541   1.538  -3.267  -3.941
  246    HA3  GLY 541           1HA      GLY 541   1.741  -4.960  -3.505
  247    H    ILE 542           H        ILE 542   4.010  -2.369  -2.853
  248    HA   ILE 542           HA       ILE 542   3.262  -2.259  -0.040
  249    HB   ILE 542           HB       ILE 542   6.159  -2.694  -0.620
  250   HG12  ILE 542          2HG1      ILE 542   5.685  -5.174  -0.038
  251   HG13  ILE 542          1HG1      ILE 542   4.045  -4.829  -0.584
  252   HG21  ILE 542          1HG2      ILE 542   5.635  -3.957   1.697
  253   HG22  ILE 542          2HG2      ILE 542   4.334  -2.768   1.696
  254   HG23  ILE 542          3HG2      ILE 542   6.012  -2.238   1.586
  255   HD11  ILE 542          3HD1      ILE 542   4.834  -5.440  -2.586
  256   HD12  ILE 542          1HD1      ILE 542   6.512  -5.175  -2.118
  257   HD13  ILE 542          2HD1      ILE 542   5.517  -3.810  -2.631
  258    H    TYR 543           H        TYR 543   5.262  -1.196  -2.719
  259    HA   TYR 543           HA       TYR 543   5.810   1.314  -1.378
  260    HB2  TYR 543           2HB      TYR 543   7.727   1.336  -2.553
  261    HB3  TYR 543           1HB      TYR 543   7.400  -0.365  -2.808
  262    HD1  TYR 543           2HD      TYR 543   5.879  -0.889  -4.884
  263    HD2  TYR 543           1HD      TYR 543   8.173   2.658  -4.396
  264    HE1  TYR 543           2HE      TYR 543   5.840  -0.539  -7.308
  265    HE2  TYR 543           1HE      TYR 543   8.151   3.022  -6.822
  266    HH   TYR 543           HH       TYR 543   7.257   0.659  -9.027
  267    H    ILE 544           H        ILE 544   4.183  -0.106  -4.109
  268    HA   ILE 544           HA       ILE 544   3.006   0.773  -5.881
  269    HB   ILE 544           HB       ILE 544   1.538   2.244  -3.728
  270   HG12  ILE 544          2HG1      ILE 544   0.342  -0.111  -3.563
  271   HG13  ILE 544          1HG1      ILE 544   1.935  -0.696  -4.032
  272   HG21  ILE 544          1HG2      ILE 544   0.793   0.850  -6.278
  273   HG22  ILE 544          2HG2      ILE 544   0.549   2.539  -5.836
  274   HG23  ILE 544          3HG2      ILE 544  -0.406   1.278  -5.058
  275   HD11  ILE 544          3HD1      ILE 544   1.768  -0.739  -1.652
  276   HD12  ILE 544          1HD1      ILE 544   1.236   0.941  -1.608
  277   HD13  ILE 544          2HD1      ILE 544   2.880   0.549  -2.101
  278    H    GLU 545           H        GLU 545   2.877   3.503  -3.639
  279    HA   GLU 545           HA       GLU 545   3.367   5.707  -3.864
  280    HB2  GLU 545           2HB      GLU 545   4.903   4.974  -6.351
  281    HB3  GLU 545           1HB      GLU 545   5.130   6.385  -5.322
  282    HG2  GLU 545           2HG      GLU 545   5.647   4.708  -3.467
  283    HG3  GLU 545           1HG      GLU 545   5.820   3.528  -4.763
  284    H    GLY 546           H        GLY 546   1.363   6.474  -4.255
  285    HA2  GLY 546           2HA      GLY 546   0.585   8.044  -6.171
  286    HA3  GLY 546           1HA      GLY 546   0.394   6.522  -7.025
  287    H    LEU 547           H        LEU 547  -0.328   5.577  -4.049
  288    HA   LEU 547           HA       LEU 547  -3.132   6.500  -4.171
  289    HB2  LEU 547           2HB      LEU 547  -3.975   4.365  -3.979
  290    HB3  LEU 547           1HB      LEU 547  -2.611   4.133  -5.054
  291    HG   LEU 547           HG       LEU 547  -2.610   3.554  -2.091
  292   HD11  LEU 547          1HD1      LEU 547  -3.831   2.074  -4.007
  293   HD12  LEU 547          2HD1      LEU 547  -3.131   1.414  -2.528
  294   HD13  LEU 547          3HD1      LEU 547  -2.207   1.386  -4.031
  295   HD21  LEU 547          3HD2      LEU 547  -0.440   2.394  -2.732
  296   HD22  LEU 547          1HD2      LEU 547  -0.419   4.158  -2.683
  297   HD23  LEU 547          2HD2      LEU 547  -0.517   3.320  -4.231
  298    H    MET 548           H        MET 548  -0.420   6.396  -2.357
  299    HA   MET 548           HA       MET 548  -1.461   5.694   0.194
  300    HB2  MET 548           2HB      MET 548   0.852   7.498   0.256
  301    HB3  MET 548           1HB      MET 548   0.656   5.900   0.951
  302    HG2  MET 548           2HG      MET 548   2.183   5.275  -0.530
  303    HG3  MET 548           1HG      MET 548   0.884   5.332  -1.713
  304    HE1  MET 548           3HE      MET 548   0.336   8.397  -1.565
  305    HE2  MET 548           1HE      MET 548   0.493   7.861  -3.237
  306    HE3  MET 548           2HE      MET 548   1.418   9.250  -2.665
  307    H    HIS 549           H        HIS 549  -3.347   6.932   0.364
  308    HA   HIS 549           HA       HIS 549  -2.847   9.734   1.099
  309    HB2  HIS 549           2HB      HIS 549  -5.454   8.936  -0.130
  310    HB3  HIS 549           1HB      HIS 549  -4.684  10.516  -0.087
  311    HD1  HIS 549           1HD      HIS 549  -5.763   8.610  -2.576
  312    HD2  HIS 549           2HD      HIS 549  -1.881   9.717  -1.598
  313    HE1  HIS 549           1HE      HIS 549  -4.448   8.385  -4.703
  314    HE2  HIS 549           2HE      HIS 549  -2.080   8.967  -4.066
  315    H    ASN 550           H        ASN 550  -5.122   7.029   1.299
  316    HA   ASN 550           HA       ASN 550  -5.278   6.755   4.008
  317    HB2  ASN 550           2HB      ASN 550  -6.647   9.164   3.144
  318    HB3  ASN 550           1HB      ASN 550  -7.760   8.045   3.923
  319   HD21  ASN 550          1HD2      ASN 550  -6.866  10.611   4.865
  320   HD22  ASN 550          2HD2      ASN 550  -6.083  10.341   6.382
  321    H    GLN 551           H        GLN 551  -8.008   7.392   1.833
  322    HA   GLN 551           HA       GLN 551  -9.675   6.065   1.046
  323    HB2  GLN 551           2HB      GLN 551  -8.018   3.617   1.113
  324    HB3  GLN 551           1HB      GLN 551  -8.981   4.279  -0.194
  325    HG2  GLN 551           2HG      GLN 551  -7.012   4.741  -1.131
  326    HG3  GLN 551           1HG      GLN 551  -6.987   6.113  -0.027
  327   HE21  GLN 551          1HE2      GLN 551  -6.538   2.680   0.743
  328   HE22  GLN 551          2HE2      GLN 551  -4.918   2.850   1.313
  329    H    ASP 552           H        ASP 552  -9.914   3.196   1.487
  330    HA   ASP 552           HA       ASP 552 -10.216   1.638   3.248
  331    HB2  ASP 552           2HB      ASP 552  -9.489   3.354   4.977
  332    HB3  ASP 552           1HB      ASP 552 -11.150   3.937   4.979
  333    H    GLY 553           H        GLY 553 -11.795   3.034   1.151
  334    HA2  GLY 553           2HA      GLY 553 -14.412   1.977   1.948
  335    HA3  GLY 553           1HA      GLY 553 -14.325   3.615   1.310
  336    H    LEU 554           H        LEU 554 -11.927   1.971  -0.158
  337    HA   LEU 554           HA       LEU 554 -13.584   1.051  -2.408
  338    HB2  LEU 554           2HB      LEU 554 -11.677   1.852  -3.855
  339    HB3  LEU 554           1HB      LEU 554 -12.649   3.109  -3.113
  340    HG   LEU 554           HG       LEU 554 -10.566   2.662  -1.290
  341   HD11  LEU 554          1HD1      LEU 554  -9.180   3.178  -3.850
  342   HD12  LEU 554          2HD1      LEU 554  -9.625   1.507  -3.501
  343   HD13  LEU 554          3HD1      LEU 554  -8.603   2.402  -2.375
  344   HD21  LEU 554          3HD2      LEU 554 -10.183   4.848  -3.212
  345   HD22  LEU 554          1HD2      LEU 554 -10.363   4.892  -1.458
  346   HD23  LEU 554          2HD2      LEU 554 -11.789   4.775  -2.488
  347    H    ILE 555           H        ILE 555 -11.604   0.124  -0.027
  348    HA   ILE 555           HA       ILE 555 -10.659  -2.237  -1.449
  349    HB   ILE 555           HB       ILE 555  -8.431  -2.041  -0.395
  350   HG12  ILE 555          2HG1      ILE 555  -9.084  -0.551   1.470
  351   HG13  ILE 555          1HG1      ILE 555  -7.703   0.055   0.585
  352   HG21  ILE 555          1HG2      ILE 555  -9.273  -0.861  -2.684
  353   HG22  ILE 555          2HG2      ILE 555  -7.590  -0.969  -2.164
  354   HG23  ILE 555          3HG2      ILE 555  -8.523   0.496  -1.840
  355   HD11  ILE 555          3HD1      ILE 555 -10.300   1.248   0.983
  356   HD12  ILE 555          1HD1      ILE 555  -9.779   1.248  -0.700
  357   HD13  ILE 555          2HD1      ILE 555  -8.761   1.981   0.535
  358    H    CYS 556           H        CYS 556 -10.992  -0.477   1.580
  359    HA   CYS 556           HA       CYS 556 -11.304  -3.022   3.004
  360    HB2  CYS 556           2HB      CYS 556  -9.364  -1.249   3.465
  361    HB3  CYS 556           1HB      CYS 556 -10.623  -0.492   4.428
  362    H    GLY 557           H        GLY 557 -13.147  -3.343   4.164
  363    HA2  GLY 557           2HA      GLY 557 -15.321  -3.020   4.840
  364    HA3  GLY 557           1HA      GLY 557 -14.734  -1.469   5.418
  365    H    LEU 558           H        LEU 558 -15.679  -3.022   2.360
  366    HA   LEU 558           HA       LEU 558 -17.399  -0.743   1.784
  367    HB2  LEU 558           2HB      LEU 558 -16.580  -0.563  -0.508
  368    HB3  LEU 558           1HB      LEU 558 -15.314  -0.222   0.654
  369    HG   LEU 558           HG       LEU 558 -15.568  -2.938  -0.605
  370   HD11  LEU 558          1HD1      LEU 558 -14.762  -0.442  -1.873
  371   HD12  LEU 558          2HD1      LEU 558 -15.147  -2.008  -2.587
  372   HD13  LEU 558          3HD1      LEU 558 -13.531  -1.703  -1.952
  373   HD21  LEU 558          3HD2      LEU 558 -13.096  -2.900  -0.154
  374   HD22  LEU 558          1HD2      LEU 558 -14.121  -2.895   1.281
  375   HD23  LEU 558          2HD2      LEU 558 -13.357  -1.402   0.739
  376    H    ARG 559           H        ARG 559 -16.306  -3.963   0.796
  377    HA   ARG 559           HA       ARG 559 -18.719  -5.248   0.883
  378    HB2  ARG 559           2HB      ARG 559 -19.451  -5.349  -1.463
  379    HB3  ARG 559           1HB      ARG 559 -19.528  -3.705  -0.846
  380    HG2  ARG 559           2HG      ARG 559 -16.986  -4.407  -2.107
  381    HG3  ARG 559           1HG      ARG 559 -18.379  -4.436  -3.194
  382    HD2  ARG 559           2HD      ARG 559 -18.744  -2.115  -1.752
  383    HD3  ARG 559           1HD      ARG 559 -16.997  -2.181  -1.972
  384    HE   ARG 559           HE       ARG 559 -17.935  -2.688  -4.451
  385   HH11  ARG 559          1HH1      ARG 559 -18.604  -0.163  -2.136
  386   HH12  ARG 559          2HH1      ARG 559 -18.960   1.024  -3.345
  387   HH21  ARG 559          1HH2      ARG 559 -18.402  -1.127  -6.043
  388   HH22  ARG 559          2HH2      ARG 559 -18.846   0.477  -5.563
  389    H    GLN 560           H        GLN 560 -15.963  -5.685   1.239
  390    HA   GLN 560           HA       GLN 560 -15.432  -7.847  -0.672
  391    HB2  GLN 560           2HB      GLN 560 -13.032  -7.568   0.198
  392    HB3  GLN 560           1HB      GLN 560 -13.672  -6.341  -0.883
  393    HG2  GLN 560           2HG      GLN 560 -12.360  -5.489   1.067
  394    HG3  GLN 560           1HG      GLN 560 -13.968  -4.800   0.867
  395   HE21  GLN 560          1HE2      GLN 560 -15.042  -4.580   2.666
  396   HE22  GLN 560          2HE2      GLN 560 -14.901  -5.557   4.080
  Start of MODEL   13
    1    H1   ALA 507           1HT      ALA 507 -10.286 -12.009  -7.370
    2    H2   ALA 507           2HT      ALA 507 -10.928 -11.969  -5.778
    3    H3   ALA 507           3HT      ALA 507 -10.423 -10.515  -6.540
    4    HA   ALA 507           HA       ALA 507 -12.115 -11.040  -8.285
    5    HB1  ALA 507           1HB      ALA 507 -12.784 -13.029  -6.155
    6    HB2  ALA 507           2HB      ALA 507 -12.720 -13.241  -7.905
    7    HB3  ALA 507           3HB      ALA 507 -14.053 -12.348  -7.174
    8    H    GLN 508           H        GLN 508 -12.221 -10.731  -4.761
    9    HA   GLN 508           HA       GLN 508 -13.134  -8.068  -4.835
   10    HB2  GLN 508           2HB      GLN 508 -15.405  -8.478  -3.818
   11    HB3  GLN 508           1HB      GLN 508 -15.260  -8.892  -5.520
   12    HG2  GLN 508           2HG      GLN 508 -15.105 -11.229  -4.995
   13    HG3  GLN 508           1HG      GLN 508 -15.062 -10.877  -3.268
   14   HE21  GLN 508          1HE2      GLN 508 -16.952 -10.210  -2.230
   15   HE22  GLN 508          2HE2      GLN 508 -18.512 -10.449  -2.932
   16    HA   PRO 509           HA       PRO 509 -11.370  -9.758  -0.842
   17    HB2  PRO 509           2HB      PRO 509  -9.275  -7.758  -1.213
   18    HB3  PRO 509           1HB      PRO 509  -9.124  -9.504  -1.008
   19    HG2  PRO 509           2HG      PRO 509  -8.585  -8.255  -3.349
   20    HG3  PRO 509           1HG      PRO 509  -9.216  -9.910  -3.266
   21    HD2  PRO 509           2HD      PRO 509 -10.669  -7.354  -3.843
   22    HD3  PRO 509           1HD      PRO 509 -10.837  -8.945  -4.617
   23    H    LYS 510           H        LYS 510 -10.692  -8.413   1.112
   24    HA   LYS 510           HA       LYS 510 -12.198  -5.881   1.172
   25    HB2  LYS 510           2HB      LYS 510 -11.930  -7.710   3.547
   26    HB3  LYS 510           1HB      LYS 510 -13.059  -6.384   3.314
   27    HG2  LYS 510           2HG      LYS 510 -14.575  -7.766   2.489
   28    HG3  LYS 510           1HG      LYS 510 -13.450  -8.319   1.248
   29    HD2  LYS 510           2HD      LYS 510 -13.203  -9.369   4.034
   30    HD3  LYS 510           1HD      LYS 510 -14.456 -10.013   2.971
   31    HE2  LYS 510           2HE      LYS 510 -12.847 -10.741   1.380
   32    HE3  LYS 510           1HE      LYS 510 -11.554  -9.856   2.187
   33    HZ1  LYS 510           3HZ      LYS 510 -12.723 -12.433   2.838
   34    HZ2  LYS 510           1HZ      LYS 510 -12.367 -11.437   4.160
   35    HZ3  LYS 510           2HZ      LYS 510 -11.146 -11.867   3.072
   36    H    CYS 511           H        CYS 511 -11.019  -4.166   1.741
   37    HA   CYS 511           HA       CYS 511  -9.291  -2.884   2.483
   38    HB2  CYS 511           2HB      CYS 511 -10.120  -4.348   4.636
   39    HB3  CYS 511           1HB      CYS 511  -8.412  -4.772   4.570
   40    H    ASN 512           H        ASN 512  -7.836  -2.959   0.844
   41    HA   ASN 512           HA       ASN 512  -5.957  -5.190   0.758
   42    HB2  ASN 512           2HB      ASN 512  -6.287  -3.066  -1.349
   43    HB3  ASN 512           1HB      ASN 512  -5.463  -4.611  -1.498
   44   HD21  ASN 512          1HD2      ASN 512  -8.655  -3.239  -0.771
   45   HD22  ASN 512          2HD2      ASN 512  -9.554  -4.488  -1.552
   46    HA   PRO 513           HA       PRO 513  -2.994  -1.569   1.225
   47    HB2  PRO 513           2HB      PRO 513  -3.847   0.928   0.603
   48    HB3  PRO 513           1HB      PRO 513  -3.409  -0.271  -0.613
   49    HG2  PRO 513           2HG      PRO 513  -6.019   0.823  -0.058
   50    HG3  PRO 513           1HG      PRO 513  -5.546  -0.300  -1.340
   51    HD2  PRO 513           2HD      PRO 513  -6.746  -0.870   1.305
   52    HD3  PRO 513           1HD      PRO 513  -6.805  -1.812  -0.197
   53    H    ASN 514           H        ASN 514  -5.565  -1.805   3.120
   54    HA   ASN 514           HA       ASN 514  -4.635   0.278   4.978
   55    HB2  ASN 514           2HB      ASN 514  -7.397  -0.426   4.113
   56    HB3  ASN 514           1HB      ASN 514  -7.167  -0.029   5.813
   57   HD21  ASN 514          1HD2      ASN 514  -7.315   1.158   2.598
   58   HD22  ASN 514          2HD2      ASN 514  -7.135   2.834   2.969
   59    H    LEU 515           H        LEU 515  -3.303  -1.860   5.241
   60    HA   LEU 515           HA       LEU 515  -4.604  -3.466   7.335
   61    HB2  LEU 515           2HB      LEU 515  -2.249  -4.667   6.081
   62    HB3  LEU 515           1HB      LEU 515  -3.796  -5.379   6.479
   63    HG   LEU 515           HG       LEU 515  -3.467  -5.572   4.125
   64   HD11  LEU 515          1HD1      LEU 515  -5.303  -3.619   3.500
   65   HD12  LEU 515          2HD1      LEU 515  -5.591  -3.924   5.213
   66   HD13  LEU 515          3HD1      LEU 515  -5.661  -5.251   4.054
   67   HD21  LEU 515          3HD2      LEU 515  -3.474  -2.798   3.338
   68   HD22  LEU 515          1HD2      LEU 515  -2.364  -4.093   2.888
   69   HD23  LEU 515          2HD2      LEU 515  -2.082  -3.163   4.359
   70    H    HIS 516           H        HIS 516  -1.414  -2.333   6.199
   71    HA   HIS 516           HA       HIS 516  -0.663  -1.258   8.680
   72    HB2  HIS 516           2HB      HIS 516   0.601  -2.872   9.727
   73    HB3  HIS 516           1HB      HIS 516  -0.665  -3.872   9.018
   74    HD1  HIS 516           1HD      HIS 516   0.003  -5.446   7.109
   75    HD2  HIS 516           2HD      HIS 516   3.093  -3.055   8.492
   76    HE1  HIS 516           1HE      HIS 516   2.059  -6.284   5.945
   77    HE2  HIS 516           2HE      HIS 516   3.934  -4.828   6.796
   78    H    TYR 517           H        TYR 517   0.874  -3.081   6.011
   79    HA   TYR 517           HA       TYR 517   3.240  -1.666   5.859
   80    HB2  TYR 517           2HB      TYR 517   2.489  -2.285   3.174
   81    HB3  TYR 517           1HB      TYR 517   3.713  -3.035   4.174
   82    HD1  TYR 517           2HD      TYR 517  -0.041  -3.238   4.503
   83    HD2  TYR 517           1HD      TYR 517   3.605  -5.253   3.616
   84    HE1  TYR 517           2HE      TYR 517  -1.251  -5.366   4.374
   85    HE2  TYR 517           1HE      TYR 517   2.391  -7.385   3.468
   86    HH   TYR 517           HH       TYR 517   0.328  -8.388   4.259
   87    H    TRP 518           H        TRP 518   0.162  -0.474   5.114
   88    HA   TRP 518           HA       TRP 518   1.368   1.725   3.577
   89    HB2  TRP 518           2HB      TRP 518  -1.526   1.048   3.278
   90    HB3  TRP 518           1HB      TRP 518  -0.427   1.748   2.115
   91    HD1  TRP 518           HD       TRP 518   0.268  -1.627   3.803
   92    HE1  TRP 518           1HE      TRP 518   0.264  -3.424   2.036
   93    HE3  TRP 518           3HE      TRP 518  -1.305   1.163  -0.173
   94    HZ2  TRP 518           2HZ      TRP 518  -0.355  -3.700  -0.705
   95    HZ3  TRP 518           3HZ      TRP 518  -1.589   0.039  -2.344
   96    HH2  TRP 518           HH       TRP 518  -1.119  -2.342  -2.606
   97    H    THR 519           H        THR 519  -1.228   0.754   5.725
   98    HA   THR 519           HA       THR 519  -2.148   3.335   6.391
   99    HB   THR 519           HB       THR 519  -3.579   1.481   6.804
  100    HG1  THR 519           1HG      THR 519  -3.963   1.707   9.063
  101   HG21  THR 519          3HG2      THR 519  -2.441   0.120   8.981
  102   HG22  THR 519          1HG2      THR 519  -1.204   0.200   7.724
  103   HG23  THR 519          2HG2      THR 519  -2.785  -0.496   7.366
  104    H    THR 520           H        THR 520   0.517   1.443   7.537
  105    HA   THR 520           HA       THR 520   0.842   2.960   9.964
  106    HB   THR 520           HB       THR 520   1.601   0.468   9.316
  107    HG1  THR 520           1HG      THR 520   3.075   2.079  11.112
  108   HG21  THR 520          3HG2      THR 520   4.096   2.104   8.907
  109   HG22  THR 520          1HG2      THR 520   3.360   0.964   7.778
  110   HG23  THR 520          2HG2      THR 520   4.078   0.379   9.278
  111    H    GLN 521           H        GLN 521   2.815   2.593   7.016
  112    HA   GLN 521           HA       GLN 521   4.110   5.122   7.687
  113    HB2  GLN 521           2HB      GLN 521   5.931   4.474   6.363
  114    HB3  GLN 521           1HB      GLN 521   5.448   3.012   7.212
  115    HG2  GLN 521           2HG      GLN 521   4.608   2.025   5.300
  116    HG3  GLN 521           1HG      GLN 521   4.440   3.561   4.460
  117   HE21  GLN 521          1HE2      GLN 521   6.560   4.739   4.070
  118   HE22  GLN 521          2HE2      GLN 521   7.897   3.764   3.570
  119    H    ASP 522           H        ASP 522   5.007   5.760   5.121
  120    HA   ASP 522           HA       ASP 522   2.520   6.783   3.966
  121    HB2  ASP 522           2HB      ASP 522   5.312   7.770   4.098
  122    HB3  ASP 522           1HB      ASP 522   4.316   8.269   2.738
  123    H    GLU 523           H        GLU 523   3.341   4.142   3.414
  124    HA   GLU 523           HA       GLU 523   3.853   2.674   1.727
  125    HB2  GLU 523           2HB      GLU 523   2.178   4.801   0.452
  126    HB3  GLU 523           1HB      GLU 523   2.797   3.468  -0.515
  127    HG2  GLU 523           2HG      GLU 523   1.680   1.870   0.839
  128    HG3  GLU 523           1HG      GLU 523   1.209   3.108   2.001
  129    H    GLY 524           H        GLY 524   6.107   3.253   2.030
  130    HA2  GLY 524           2HA      GLY 524   8.108   3.331   0.783
  131    HA3  GLY 524           1HA      GLY 524   7.245   4.191  -0.488
  132    H    ALA 525           H        ALA 525   6.025   5.919   1.686
  133    HA   ALA 525           HA       ALA 525   6.387   7.995   2.480
  134    HB1  ALA 525           1HB      ALA 525   8.049   6.300   3.822
  135    HB2  ALA 525           2HB      ALA 525   7.708   7.970   4.275
  136    HB3  ALA 525           3HB      ALA 525   9.137   7.591   3.312
  137    H    ALA 526           H        ALA 526   7.667   7.161  -0.278
  138    HA   ALA 526           HA       ALA 526   8.961   8.126  -1.877
  139    HB1  ALA 526           1HB      ALA 526   8.374  10.831  -0.826
  140    HB2  ALA 526           2HB      ALA 526   6.997   9.809  -1.239
  141    HB3  ALA 526           3HB      ALA 526   8.210  10.191  -2.462
  142    H    ILE 527           H        ILE 527  10.064   7.768   0.974
  143    HA   ILE 527           HA       ILE 527  11.911   9.739   1.571
  144    HB   ILE 527           HB       ILE 527  13.277   7.620   2.428
  145   HG12  ILE 527          2HG1      ILE 527  11.867   5.756   3.000
  146   HG13  ILE 527          1HG1      ILE 527  10.452   6.560   2.336
  147   HG21  ILE 527          1HG2      ILE 527  10.775   8.775   3.617
  148   HG22  ILE 527          2HG2      ILE 527  12.440   9.289   3.890
  149   HG23  ILE 527          3HG2      ILE 527  11.886   7.729   4.501
  150   HD11  ILE 527          3HD1      ILE 527  12.783   5.994   0.573
  151   HD12  ILE 527          1HD1      ILE 527  11.073   6.139   0.165
  152   HD13  ILE 527          2HD1      ILE 527  11.663   4.697   0.993
  153    H    GLY 528           H        GLY 528  11.943   7.452  -1.013
  154    HA2  GLY 528           2HA      GLY 528  13.810   8.605  -2.575
  155    HA3  GLY 528           1HA      GLY 528  14.800   7.676  -1.464
  156    H    LEU 529           H        LEU 529  12.930   5.477  -1.249
  157    HA   LEU 529           HA       LEU 529  12.402   3.497  -2.233
  158    HB2  LEU 529           2HB      LEU 529  12.032   5.456  -4.350
  159    HB3  LEU 529           1HB      LEU 529  12.519   3.898  -4.983
  160    HG   LEU 529           HG       LEU 529  10.048   4.571  -3.408
  161   HD11  LEU 529          1HD1      LEU 529   9.724   2.903  -5.721
  162   HD12  LEU 529          2HD1      LEU 529  10.631   4.357  -6.139
  163   HD13  LEU 529          3HD1      LEU 529   9.043   4.494  -5.382
  164   HD21  LEU 529          3HD2      LEU 529   9.666   2.007  -3.759
  165   HD22  LEU 529          1HD2      LEU 529  10.573   2.593  -2.362
  166   HD23  LEU 529          2HD2      LEU 529  11.429   1.959  -3.766
  167    H    ALA 530           H        ALA 530  14.758   5.113  -4.278
  168    HA   ALA 530           HA       ALA 530  16.165   2.664  -4.740
  169    HB1  ALA 530           1HB      ALA 530  17.031   5.445  -5.474
  170    HB2  ALA 530           2HB      ALA 530  15.982   4.425  -6.458
  171    HB3  ALA 530           3HB      ALA 530  17.643   3.930  -6.132
  172    H    TRP 531           H        TRP 531  16.126   3.022  -2.069
  173    HA   TRP 531           HA       TRP 531  18.912   3.714  -1.410
  174    HB2  TRP 531           2HB      TRP 531  17.992   4.083   0.952
  175    HB3  TRP 531           1HB      TRP 531  17.538   5.288  -0.252
  176    HD1  TRP 531           HD       TRP 531  15.103   4.672  -1.499
  177    HE1  TRP 531           1HE      TRP 531  12.926   3.971  -0.375
  178    HE3  TRP 531           3HE      TRP 531  16.992   3.095   2.966
  179    HZ2  TRP 531           2HZ      TRP 531  12.080   2.917   2.117
  180    HZ3  TRP 531           3HZ      TRP 531  15.432   2.263   4.679
  181    HH2  TRP 531           HH       TRP 531  13.026   2.178   4.263
  182    H    ILE 532           H        ILE 532  16.415   1.375  -1.468
  183    HA   ILE 532           HA       ILE 532  17.953  -0.424   0.286
  184    HB   ILE 532           HB       ILE 532  15.826  -1.810   0.210
  185   HG12  ILE 532          2HG1      ILE 532  15.043  -0.145  -1.759
  186   HG13  ILE 532          1HG1      ILE 532  13.923  -1.045  -0.746
  187   HG21  ILE 532          1HG2      ILE 532  14.654  -0.113   1.808
  188   HG22  ILE 532          2HG2      ILE 532  16.144   0.809   1.592
  189   HG23  ILE 532          3HG2      ILE 532  16.206  -0.827   2.249
  190   HD11  ILE 532          3HD1      ILE 532  13.215   1.241  -0.994
  191   HD12  ILE 532          1HD1      ILE 532  14.762   1.807  -0.365
  192   HD13  ILE 532          2HD1      ILE 532  13.660   0.914   0.682
  193    HA   PRO 533           HA       PRO 533  19.161  -3.096  -2.979
  194    HB2  PRO 533           2HB      PRO 533  18.407  -5.574  -2.028
  195    HB3  PRO 533           1HB      PRO 533  19.876  -4.716  -1.552
  196    HG2  PRO 533           2HG      PRO 533  17.240  -4.884  -0.152
  197    HG3  PRO 533           1HG      PRO 533  18.878  -4.957   0.528
  198    HD2  PRO 533           2HD      PRO 533  17.410  -2.726   0.683
  199    HD3  PRO 533           1HD      PRO 533  19.163  -2.656   0.407
  200    H    TYR 534           H        TYR 534  15.968  -4.112  -1.704
  201    HA   TYR 534           HA       TYR 534  14.842  -3.893  -4.360
  202    HB2  TYR 534           2HB      TYR 534  14.085  -6.229  -4.468
  203    HB3  TYR 534           1HB      TYR 534  15.842  -6.108  -4.463
  204    HD1  TYR 534           1HD      TYR 534  12.891  -7.043  -2.474
  205    HD2  TYR 534           2HD      TYR 534  17.140  -6.995  -2.649
  206    HE1  TYR 534           1HE      TYR 534  12.981  -8.581  -0.556
  207    HE2  TYR 534           2HE      TYR 534  17.244  -8.532  -0.733
  208    HH   TYR 534           HH       TYR 534  15.408  -9.018   1.336
  209    H    PHE 535           H        PHE 535  14.441  -3.362  -1.182
  210    HA   PHE 535           HA       PHE 535  11.784  -4.309  -0.753
  211    HB2  PHE 535           2HB      PHE 535  12.862  -1.935   0.710
  212    HB3  PHE 535           1HB      PHE 535  11.861  -3.249   1.305
  213    HD1  PHE 535           2HD      PHE 535  13.675  -5.480   0.139
  214    HD2  PHE 535           1HD      PHE 535  14.433  -2.002   2.466
  215    HE1  PHE 535           2HE      PHE 535  15.682  -6.549   1.079
  216    HE2  PHE 535           1HE      PHE 535  16.441  -3.056   3.404
  217    HZ   PHE 535           HZ       PHE 535  17.070  -5.338   2.716
  218    H    GLY 536           H        GLY 536  13.162  -1.505  -2.225
  219    HA2  GLY 536           2HA      GLY 536  10.511  -0.231  -2.366
  220    HA3  GLY 536           1HA      GLY 536  12.042   0.609  -2.543
  221    HA   PRO 537           HA       PRO 537  12.271   0.183  -6.931
  222    HB2  PRO 537           2HB      PRO 537  14.207  -2.073  -6.827
  223    HB3  PRO 537           1HB      PRO 537  14.325  -0.527  -7.674
  224    HG2  PRO 537           2HG      PRO 537  15.720  -0.998  -5.446
  225    HG3  PRO 537           1HG      PRO 537  15.041   0.602  -5.791
  226    HD2  PRO 537           2HD      PRO 537  14.121  -1.482  -3.874
  227    HD3  PRO 537           1HD      PRO 537  14.053   0.287  -3.739
  228    H    ALA 538           H        ALA 538  12.226  -2.913  -5.254
  229    HA   ALA 538           HA       ALA 538  10.789  -4.179  -7.459
  230    HB1  ALA 538           1HB      ALA 538  11.868  -5.990  -6.774
  231    HB2  ALA 538           2HB      ALA 538  10.996  -5.930  -5.243
  232    HB3  ALA 538           3HB      ALA 538  12.538  -5.093  -5.411
  233    H    ALA 539           H        ALA 539  10.069  -2.484  -4.627
  234    HA   ALA 539           HA       ALA 539   7.699  -3.890  -3.866
  235    HB1  ALA 539           1HB      ALA 539   7.393  -1.412  -2.790
  236    HB2  ALA 539           2HB      ALA 539   9.143  -1.496  -2.992
  237    HB3  ALA 539           3HB      ALA 539   8.304  -2.728  -2.049
  238    H    GLU 540           H        GLU 540   5.799  -3.828  -4.819
  239    HA   GLU 540           HA       GLU 540   5.073  -1.461  -6.414
  240    HB2  GLU 540           2HB      GLU 540   4.202  -4.278  -7.052
  241    HB3  GLU 540           1HB      GLU 540   4.020  -2.840  -8.050
  242    HG2  GLU 540           2HG      GLU 540   6.681  -2.859  -7.789
  243    HG3  GLU 540           1HG      GLU 540   6.358  -4.587  -7.642
  244    H    GLY 541           H        GLY 541   4.215  -3.706  -3.974
  245    HA2  GLY 541           2HA      GLY 541   1.510  -2.532  -3.831
  246    HA3  GLY 541           1HA      GLY 541   1.861  -4.193  -3.372
  247    H    ILE 542           H        ILE 542   3.893  -1.422  -2.666
  248    HA   ILE 542           HA       ILE 542   3.019  -1.372   0.115
  249    HB   ILE 542           HB       ILE 542   5.962  -1.506  -0.319
  250   HG12  ILE 542          2HG1      ILE 542   5.722  -4.038   0.195
  251   HG13  ILE 542          1HG1      ILE 542   4.094  -3.856  -0.452
  252   HG21  ILE 542          1HG2      ILE 542   4.444  -1.117   1.863
  253   HG22  ILE 542          2HG2      ILE 542   6.052  -1.837   1.912
  254   HG23  ILE 542          3HG2      ILE 542   4.622  -2.870   1.925
  255   HD11  ILE 542          3HD1      ILE 542   5.096  -4.374  -2.391
  256   HD12  ILE 542          1HD1      ILE 542   6.688  -3.871  -1.824
  257   HD13  ILE 542          2HD1      ILE 542   5.536  -2.664  -2.399
  258    H    TYR 543           H        TYR 543   4.932  -0.067  -2.513
  259    HA   TYR 543           HA       TYR 543   5.294   2.436  -1.108
  260    HB2  TYR 543           2HB      TYR 543   7.132   2.705  -2.391
  261    HB3  TYR 543           1HB      TYR 543   6.985   0.978  -2.620
  262    HD1  TYR 543           2HD      TYR 543   5.555   0.226  -4.671
  263    HD2  TYR 543           1HD      TYR 543   7.273   4.092  -4.239
  264    HE1  TYR 543           2HE      TYR 543   5.403   0.557  -7.095
  265    HE2  TYR 543           1HE      TYR 543   7.134   4.434  -6.664
  266    HH   TYR 543           HH       TYR 543   5.789   3.561  -8.576
  267    H    ILE 544           H        ILE 544   3.791   1.070  -3.977
  268    HA   ILE 544           HA       ILE 544   2.460   1.960  -5.618
  269    HB   ILE 544           HB       ILE 544   0.995   3.091  -3.245
  270   HG12  ILE 544          2HG1      ILE 544  -0.186   0.851  -3.265
  271   HG13  ILE 544          1HG1      ILE 544   1.127   0.260  -4.277
  272   HG21  ILE 544          1HG2      ILE 544   0.209   2.258  -6.016
  273   HG22  ILE 544          2HG2      ILE 544  -0.059   3.802  -5.207
  274   HG23  ILE 544          3HG2      ILE 544  -0.974   2.377  -4.712
  275   HD11  ILE 544          3HD1      ILE 544   1.828   1.585  -1.719
  276   HD12  ILE 544          1HD1      ILE 544   2.619   0.256  -2.566
  277   HD13  ILE 544          2HD1      ILE 544   1.137  -0.037  -1.660
  278    H    GLU 545           H        GLU 545   2.186   4.502  -3.184
  279    HA   GLU 545           HA       GLU 545   2.481   6.747  -3.255
  280    HB2  GLU 545           2HB      GLU 545   4.154   6.273  -5.719
  281    HB3  GLU 545           1HB      GLU 545   4.227   7.651  -4.624
  282    HG2  GLU 545           2HG      GLU 545   4.829   5.973  -2.817
  283    HG3  GLU 545           1HG      GLU 545   5.096   4.825  -4.126
  284    H    GLY 546           H        GLY 546   0.412   7.325  -3.664
  285    HA2  GLY 546           2HA      GLY 546  -0.406   8.967  -5.528
  286    HA3  GLY 546           1HA      GLY 546  -0.483   7.472  -6.446
  287    H    LEU 547           H        LEU 547  -1.205   6.482  -3.422
  288    HA   LEU 547           HA       LEU 547  -4.067   7.159  -3.701
  289    HB2  LEU 547           2HB      LEU 547  -4.747   4.957  -3.326
  290    HB3  LEU 547           1HB      LEU 547  -3.451   4.843  -4.500
  291    HG   LEU 547           HG       LEU 547  -3.124   4.326  -1.546
  292   HD11  LEU 547          1HD1      LEU 547  -3.541   2.439  -3.854
  293   HD12  LEU 547          2HD1      LEU 547  -4.547   2.626  -2.418
  294   HD13  LEU 547          3HD1      LEU 547  -2.927   1.942  -2.277
  295   HD21  LEU 547          3HD2      LEU 547  -1.285   4.527  -3.815
  296   HD22  LEU 547          1HD2      LEU 547  -1.096   3.061  -2.854
  297   HD23  LEU 547          2HD2      LEU 547  -0.972   4.642  -2.085
  298    H    MET 548           H        MET 548  -1.395   7.109  -1.680
  299    HA   MET 548           HA       MET 548  -2.606   6.573   0.819
  300    HB2  MET 548           2HB      MET 548  -0.249   8.405   0.553
  301    HB3  MET 548           1HB      MET 548  -0.599   7.227   1.806
  302    HG2  MET 548           2HG      MET 548   0.616   5.704   0.782
  303    HG3  MET 548           1HG      MET 548  -0.327   5.872  -0.695
  304    HE1  MET 548           3HE      MET 548   0.748   9.356  -0.855
  305    HE2  MET 548           1HE      MET 548  -0.030   8.278  -2.014
  306    HE3  MET 548           2HE      MET 548   1.568   8.936  -2.357
  307    H    HIS 549           H        HIS 549  -4.576   7.810   0.566
  308    HA   HIS 549           HA       HIS 549  -4.204  10.589   1.441
  309    HB2  HIS 549           2HB      HIS 549  -6.509   9.894  -0.332
  310    HB3  HIS 549           1HB      HIS 549  -5.726  11.449  -0.083
  311    HD1  HIS 549           1HD      HIS 549  -6.248   9.446  -2.751
  312    HD2  HIS 549           2HD      HIS 549  -2.718  10.765  -1.005
  313    HE1  HIS 549           1HE      HIS 549  -4.499   9.244  -4.538
  314    HE2  HIS 549           2HE      HIS 549  -2.354   9.980  -3.444
  315    H    ASN 550           H        ASN 550  -4.798   8.043   2.827
  316    HA   ASN 550           HA       ASN 550  -6.187   7.212   4.434
  317    HB2  ASN 550           2HB      ASN 550  -7.190  10.057   4.636
  318    HB3  ASN 550           1HB      ASN 550  -7.247   8.821   5.888
  319   HD21  ASN 550          1HD2      ASN 550  -5.994   9.657   7.429
  320   HD22  ASN 550          2HD2      ASN 550  -4.341  10.116   7.222
  321    H    GLN 551           H        GLN 551  -7.199   6.308   2.327
  322    HA   GLN 551           HA       GLN 551  -9.845   7.329   1.766
  323    HB2  GLN 551           2HB      GLN 551  -9.139   4.742   0.570
  324    HB3  GLN 551           1HB      GLN 551  -9.761   6.197  -0.182
  325    HG2  GLN 551           2HG      GLN 551  -7.762   6.434  -1.110
  326    HG3  GLN 551           1HG      GLN 551  -7.162   6.874   0.485
  327   HE21  GLN 551          1HE2      GLN 551  -7.233   4.466   1.790
  328   HE22  GLN 551          2HE2      GLN 551  -6.130   3.364   1.052
  329    H    ASP 552           H        ASP 552  -8.922   3.963   2.185
  330    HA   ASP 552           HA       ASP 552  -9.811   2.253   3.383
  331    HB2  ASP 552           2HB      ASP 552  -9.524   4.218   5.203
  332    HB3  ASP 552           1HB      ASP 552 -11.273   4.017   5.269
  333    H    GLY 553           H        GLY 553 -11.444   4.037   1.393
  334    HA2  GLY 553           2HA      GLY 553 -14.063   2.828   2.035
  335    HA3  GLY 553           1HA      GLY 553 -13.886   4.370   1.206
  336    H    LEU 554           H        LEU 554 -11.688   3.526  -0.438
  337    HA   LEU 554           HA       LEU 554 -13.194   2.145  -2.498
  338    HB2  LEU 554           2HB      LEU 554 -11.268   2.708  -3.924
  339    HB3  LEU 554           1HB      LEU 554 -11.966   4.110  -3.140
  340    HG   LEU 554           HG       LEU 554  -9.974   3.396  -1.376
  341   HD11  LEU 554          1HD1      LEU 554  -9.298   1.769  -3.288
  342   HD12  LEU 554          2HD1      LEU 554  -8.064   2.726  -2.469
  343   HD13  LEU 554          3HD1      LEU 554  -8.661   3.225  -4.051
  344   HD21  LEU 554          3HD2      LEU 554  -8.724   5.300  -2.442
  345   HD22  LEU 554          1HD2      LEU 554 -10.390   5.652  -1.985
  346   HD23  LEU 554          2HD2      LEU 554  -9.986   5.344  -3.673
  347    H    ILE 555           H        ILE 555 -11.485   1.110   0.043
  348    HA   ILE 555           HA       ILE 555 -10.741  -1.388  -1.267
  349    HB   ILE 555           HB       ILE 555  -8.603  -1.450  -0.012
  350   HG12  ILE 555          2HG1      ILE 555  -9.174   0.244   1.696
  351   HG13  ILE 555          1HG1      ILE 555  -7.662   0.602   0.887
  352   HG21  ILE 555          1HG2      ILE 555  -7.526  -0.684  -1.806
  353   HG22  ILE 555          2HG2      ILE 555  -8.192   0.941  -1.624
  354   HG23  ILE 555          3HG2      ILE 555  -9.133  -0.313  -2.434
  355   HD11  ILE 555          3HD1      ILE 555 -10.122   2.133   0.990
  356   HD12  ILE 555          1HD1      ILE 555  -9.436   1.983  -0.627
  357   HD13  ILE 555          2HD1      ILE 555  -8.465   2.653   0.682
  358    H    CYS 556           H        CYS 556 -11.118   0.438   1.733
  359    HA   CYS 556           HA       CYS 556 -11.694  -2.076   3.127
  360    HB2  CYS 556           2HB      CYS 556  -9.879  -0.203   3.832
  361    HB3  CYS 556           1HB      CYS 556 -11.289   0.407   4.694
  362    H    GLY 557           H        GLY 557 -13.781  -1.504   1.723
  363    HA2  GLY 557           2HA      GLY 557 -15.591   0.103   3.406
  364    HA3  GLY 557           1HA      GLY 557 -15.834  -0.218   1.694
  365    H    LEU 558           H        LEU 558 -15.835  -2.728   1.245
  366    HA   LEU 558           HA       LEU 558 -17.251  -4.155   3.355
  367    HB2  LEU 558           2HB      LEU 558 -19.083  -4.781   1.894
  368    HB3  LEU 558           1HB      LEU 558 -18.997  -3.041   2.074
  369    HG   LEU 558           HG       LEU 558 -17.961  -4.550  -0.326
  370   HD11  LEU 558          1HD1      LEU 558 -20.342  -2.807  -0.495
  371   HD12  LEU 558          2HD1      LEU 558 -20.554  -4.382   0.270
  372   HD13  LEU 558          3HD1      LEU 558 -19.944  -4.279  -1.381
  373   HD21  LEU 558          3HD2      LEU 558 -18.422  -1.973  -1.083
  374   HD22  LEU 558          1HD2      LEU 558 -16.851  -2.621  -0.617
  375   HD23  LEU 558          2HD2      LEU 558 -17.834  -1.762   0.567
  376    H    ARG 559           H        ARG 559 -16.077  -4.342  -0.007
  377    HA   ARG 559           HA       ARG 559 -14.298  -6.424   0.402
  378    HB2  ARG 559           2HB      ARG 559 -15.460  -8.373  -0.480
  379    HB3  ARG 559           1HB      ARG 559 -16.316  -7.769   0.932
  380    HG2  ARG 559           2HG      ARG 559 -17.227  -6.629  -1.600
  381    HG3  ARG 559           1HG      ARG 559 -17.465  -8.374  -1.458
  382    HD2  ARG 559           2HD      ARG 559 -18.232  -6.638   0.834
  383    HD3  ARG 559           1HD      ARG 559 -19.270  -6.651  -0.591
  384    HE   ARG 559           HE       ARG 559 -19.017  -8.712   1.365
  385   HH11  ARG 559          1HH1      ARG 559 -19.665  -8.119  -2.013
  386   HH12  ARG 559          2HH1      ARG 559 -20.572  -9.579  -2.224
  387   HH21  ARG 559          1HH2      ARG 559 -20.211 -10.632   1.089
  388   HH22  ARG 559          2HH2      ARG 559 -20.885 -11.004  -0.462
  389    H    GLN 560           H        GLN 560 -14.641  -4.051  -1.086
  390    HA   GLN 560           HA       GLN 560 -14.795  -4.840  -3.870
  391    HB2  GLN 560           2HB      GLN 560 -14.857  -2.559  -4.400
  392    HB3  GLN 560           1HB      GLN 560 -15.744  -2.671  -2.888
  393    HG2  GLN 560           2HG      GLN 560 -12.843  -1.893  -3.057
  394    HG3  GLN 560           1HG      GLN 560 -14.171  -0.737  -3.077
  395   HE21  GLN 560          1HE2      GLN 560 -12.783  -3.370  -1.176
  396   HE22  GLN 560          2HE2      GLN 560 -13.239  -2.739   0.362
  Start of MODEL   14
    1    H1   ALA 507           1HT      ALA 507 -12.304 -10.907  -4.195
    2    H2   ALA 507           2HT      ALA 507 -12.193 -12.400  -5.034
    3    H3   ALA 507           3HT      ALA 507 -12.312 -12.381  -3.321
    4    HA   ALA 507           HA       ALA 507 -14.342 -11.766  -5.335
    5    HB1  ALA 507           1HB      ALA 507 -15.650 -13.336  -3.890
    6    HB2  ALA 507           2HB      ALA 507 -14.170 -13.631  -2.978
    7    HB3  ALA 507           3HB      ALA 507 -14.252 -14.057  -4.687
    8    H    GLN 508           H        GLN 508 -13.324 -11.194  -2.011
    9    HA   GLN 508           HA       GLN 508 -14.842  -8.791  -1.850
   10    HB2  GLN 508           2HB      GLN 508 -15.933 -11.279  -0.643
   11    HB3  GLN 508           1HB      GLN 508 -16.040  -9.809   0.317
   12    HG2  GLN 508           2HG      GLN 508 -17.013  -8.811  -1.907
   13    HG3  GLN 508           1HG      GLN 508 -17.372 -10.503  -2.247
   14   HE21  GLN 508          1HE2      GLN 508 -17.499  -8.446   0.646
   15   HE22  GLN 508          2HE2      GLN 508 -19.130  -8.838   1.061
   16    HA   PRO 509           HA       PRO 509 -11.236  -9.497   1.120
   17    HB2  PRO 509           2HB      PRO 509  -9.367  -7.994  -0.111
   18    HB3  PRO 509           1HB      PRO 509  -9.625  -9.694  -0.520
   19    HG2  PRO 509           2HG      PRO 509 -10.595  -7.239  -1.933
   20    HG3  PRO 509           1HG      PRO 509  -9.907  -8.724  -2.616
   21    HD2  PRO 509           2HD      PRO 509 -12.583  -8.219  -2.533
   22    HD3  PRO 509           1HD      PRO 509 -11.902  -9.857  -2.480
   23    H    LYS 510           H        LYS 510 -11.409  -8.224   2.846
   24    HA   LYS 510           HA       LYS 510 -12.285  -5.462   2.527
   25    HB2  LYS 510           2HB      LYS 510 -12.630  -5.507   4.955
   26    HB3  LYS 510           1HB      LYS 510 -13.450  -6.847   4.166
   27    HG2  LYS 510           2HG      LYS 510 -11.009  -7.926   4.796
   28    HG3  LYS 510           1HG      LYS 510 -11.333  -6.860   6.164
   29    HD2  LYS 510           2HD      LYS 510 -12.260  -8.966   6.726
   30    HD3  LYS 510           1HD      LYS 510 -13.620  -7.927   6.294
   31    HE2  LYS 510           2HE      LYS 510 -12.455  -9.434   4.059
   32    HE3  LYS 510           1HE      LYS 510 -13.203 -10.427   5.309
   33    HZ1  LYS 510           3HZ      LYS 510 -15.082  -8.602   5.011
   34    HZ2  LYS 510           1HZ      LYS 510 -15.023 -10.004   4.064
   35    HZ3  LYS 510           2HZ      LYS 510 -14.427  -8.544   3.453
   36    H    CYS 511           H        CYS 511 -10.851  -3.889   2.394
   37    HA   CYS 511           HA       CYS 511  -8.970  -2.641   2.652
   38    HB2  CYS 511           2HB      CYS 511  -9.255  -4.056   5.242
   39    HB3  CYS 511           1HB      CYS 511  -7.688  -3.324   4.921
   40    H    ASN 512           H        ASN 512  -7.958  -3.581   0.841
   41    HA   ASN 512           HA       ASN 512  -6.216  -5.851   1.205
   42    HB2  ASN 512           2HB      ASN 512  -6.506  -4.089  -1.232
   43    HB3  ASN 512           1HB      ASN 512  -5.728  -5.663  -1.160
   44   HD21  ASN 512          1HD2      ASN 512  -8.823  -4.021  -0.747
   45   HD22  ASN 512          2HD2      ASN 512  -9.800  -5.371  -1.185
   46    HA   PRO 513           HA       PRO 513  -2.879  -2.515   0.922
   47    HB2  PRO 513           2HB      PRO 513  -3.596  -0.044   0.019
   48    HB3  PRO 513           1HB      PRO 513  -3.267  -1.412  -1.046
   49    HG2  PRO 513           2HG      PRO 513  -5.783  -0.088  -0.604
   50    HG3  PRO 513           1HG      PRO 513  -5.437  -1.445  -1.687
   51    HD2  PRO 513           2HD      PRO 513  -6.537  -1.463   1.069
   52    HD3  PRO 513           1HD      PRO 513  -6.785  -2.613  -0.260
   53    H    ASN 514           H        ASN 514  -5.336  -2.335   2.921
   54    HA   ASN 514           HA       ASN 514  -4.273  -0.059   4.455
   55    HB2  ASN 514           2HB      ASN 514  -7.061  -0.895   3.859
   56    HB3  ASN 514           1HB      ASN 514  -6.744  -0.375   5.511
   57   HD21  ASN 514          1HD2      ASN 514  -6.885   0.586   2.171
   58   HD22  ASN 514          2HD2      ASN 514  -6.817   2.288   2.456
   59    H    LEU 515           H        LEU 515  -2.904  -2.181   4.776
   60    HA   LEU 515           HA       LEU 515  -4.010  -3.734   6.999
   61    HB2  LEU 515           2HB      LEU 515  -1.437  -4.479   5.733
   62    HB3  LEU 515           1HB      LEU 515  -2.715  -5.499   6.352
   63    HG   LEU 515           HG       LEU 515  -2.724  -5.901   4.056
   64   HD11  LEU 515          1HD1      LEU 515  -4.906  -4.472   5.184
   65   HD12  LEU 515          2HD1      LEU 515  -4.923  -5.704   3.923
   66   HD13  LEU 515          3HD1      LEU 515  -4.748  -4.005   3.493
   67   HD21  LEU 515          3HD2      LEU 515  -1.781  -4.529   2.589
   68   HD22  LEU 515          1HD2      LEU 515  -1.576  -3.336   3.874
   69   HD23  LEU 515          2HD2      LEU 515  -3.028  -3.316   2.873
   70    H    HIS 516           H        HIS 516  -1.037  -2.035   6.003
   71    HA   HIS 516           HA       HIS 516  -0.611  -0.855   8.506
   72    HB2  HIS 516           2HB      HIS 516   0.871  -2.199   9.634
   73    HB3  HIS 516           1HB      HIS 516  -0.129  -3.427   8.864
   74    HD1  HIS 516           1HD      HIS 516   0.947  -4.843   7.020
   75    HD2  HIS 516           2HD      HIS 516   3.436  -1.906   8.563
   76    HE1  HIS 516           1HE      HIS 516   3.204  -5.292   6.018
   77    HE2  HIS 516           2HE      HIS 516   4.700  -3.487   6.945
   78    H    TYR 517           H        TYR 517   1.361  -2.359   5.936
   79    HA   TYR 517           HA       TYR 517   3.396  -0.485   5.902
   80    HB2  TYR 517           2HB      TYR 517   3.110  -1.303   3.216
   81    HB3  TYR 517           1HB      TYR 517   4.276  -1.851   4.399
   82    HD1  TYR 517           2HD      TYR 517   0.592  -2.615   4.351
   83    HD2  TYR 517           1HD      TYR 517   4.560  -4.053   3.779
   84    HE1  TYR 517           2HE      TYR 517  -0.264  -4.905   4.141
   85    HE2  TYR 517           1HE      TYR 517   3.700  -6.342   3.547
   86    HH   TYR 517           HH       TYR 517   0.379  -7.030   3.176
   87    H    TRP 518           H        TRP 518   0.201  -0.112   4.695
   88    HA   TRP 518           HA       TRP 518   1.077   2.328   3.295
   89    HB2  TRP 518           2HB      TRP 518  -1.539   1.152   2.560
   90    HB3  TRP 518           1HB      TRP 518  -0.342   1.933   1.557
   91    HD1  TRP 518           HD       TRP 518   0.979  -1.055   3.431
   92    HE1  TRP 518           1HE      TRP 518   1.277  -2.986   1.839
   93    HE3  TRP 518           3HE      TRP 518  -1.458   0.877  -0.616
   94    HZ2  TRP 518           2HZ      TRP 518   0.552  -3.676  -0.803
   95    HZ3  TRP 518           3HZ      TRP 518  -1.608  -0.497  -2.651
   96    HH2  TRP 518           HH       TRP 518  -0.618  -2.727  -2.744
   97    H    THR 519           H        THR 519  -1.436   0.835   5.224
   98    HA   THR 519           HA       THR 519  -3.150   3.004   5.541
   99    HB   THR 519           HB       THR 519  -3.751   0.757   6.249
  100    HG1  THR 519           1HG      THR 519  -3.645   2.457   8.515
  101   HG21  THR 519          3HG2      THR 519  -2.153   0.916   8.729
  102   HG22  THR 519          1HG2      THR 519  -1.314   0.451   7.248
  103   HG23  THR 519          2HG2      THR 519  -2.698  -0.488   7.814
  104    H    THR 520           H        THR 520  -0.119   2.277   7.056
  105    HA   THR 520           HA       THR 520  -0.426   4.450   8.982
  106    HB   THR 520           HB       THR 520   1.260   2.050   8.766
  107    HG1  THR 520           1HG      THR 520   0.561   1.871  10.724
  108   HG21  THR 520          3HG2      THR 520   3.175   3.361   8.648
  109   HG22  THR 520          1HG2      THR 520   2.958   3.104  10.381
  110   HG23  THR 520          2HG2      THR 520   2.480   4.636   9.649
  111    H    GLN 521           H        GLN 521   2.281   3.413   6.937
  112    HA   GLN 521           HA       GLN 521   2.972   6.223   6.550
  113    HB2  GLN 521           2HB      GLN 521   5.181   5.472   6.010
  114    HB3  GLN 521           1HB      GLN 521   4.663   4.631   7.461
  115    HG2  GLN 521           2HG      GLN 521   4.759   2.624   6.498
  116    HG3  GLN 521           1HG      GLN 521   4.083   3.198   4.980
  117   HE21  GLN 521          1HE2      GLN 521   5.990   5.201   4.398
  118   HE22  GLN 521          2HE2      GLN 521   7.490   4.433   4.037
  119    H    ASP 522           H        ASP 522   4.463   6.103   4.307
  120    HA   ASP 522           HA       ASP 522   2.418   5.943   2.250
  121    HB2  ASP 522           2HB      ASP 522   5.185   7.114   2.323
  122    HB3  ASP 522           1HB      ASP 522   4.231   7.035   0.845
  123    H    GLU 523           H        GLU 523   3.832   3.537   3.391
  124    HA   GLU 523           HA       GLU 523   4.430   1.477   2.623
  125    HB2  GLU 523           2HB      GLU 523   4.132   2.558  -0.173
  126    HB3  GLU 523           1HB      GLU 523   4.015   0.885   0.352
  127    HG2  GLU 523           2HG      GLU 523   1.888   1.107   1.062
  128    HG3  GLU 523           1HG      GLU 523   2.113   2.778   1.571
  129    H    GLY 524           H        GLY 524   6.190   4.138   2.431
  130    HA2  GLY 524           2HA      GLY 524   8.635   3.594   2.690
  131    HA3  GLY 524           1HA      GLY 524   8.476   2.829   1.116
  132    H    ALA 525           H        ALA 525   6.599   5.674   1.565
  133    HA   ALA 525           HA       ALA 525   8.427   7.075  -0.224
  134    HB1  ALA 525           1HB      ALA 525   6.652   8.075  -1.188
  135    HB2  ALA 525           2HB      ALA 525   5.783   8.246   0.338
  136    HB3  ALA 525           3HB      ALA 525   5.793   6.695  -0.503
  137    H    ALA 526           H        ALA 526   7.755   7.002   3.032
  138    HA   ALA 526           HA       ALA 526   8.081   9.818   3.465
  139    HB1  ALA 526           1HB      ALA 526   6.570   8.230   4.826
  140    HB2  ALA 526           2HB      ALA 526   7.493   9.468   5.678
  141    HB3  ALA 526           3HB      ALA 526   8.063   7.799   5.660
  142    H    ILE 527           H        ILE 527  10.208   7.952   2.351
  143    HA   ILE 527           HA       ILE 527  12.369   8.861   4.106
  144    HB   ILE 527           HB       ILE 527  13.282   6.482   2.998
  145   HG12  ILE 527          2HG1      ILE 527  10.837   6.027   2.494
  146   HG13  ILE 527          1HG1      ILE 527  11.671   4.792   3.425
  147   HG21  ILE 527          1HG2      ILE 527  13.373   5.694   5.281
  148   HG22  ILE 527          2HG2      ILE 527  12.187   6.904   5.773
  149   HG23  ILE 527          3HG2      ILE 527  13.786   7.407   5.225
  150   HD11  ILE 527          3HD1      ILE 527  10.518   6.629   5.242
  151   HD12  ILE 527          1HD1      ILE 527  10.115   4.932   4.984
  152   HD13  ILE 527          2HD1      ILE 527   9.299   6.186   4.050
  153    H    GLY 528           H        GLY 528  11.594   7.380   0.961
  154    HA2  GLY 528           2HA      GLY 528  12.521   9.281  -0.736
  155    HA3  GLY 528           1HA      GLY 528  13.989   8.449  -0.252
  156    H    LEU 529           H        LEU 529  12.516   5.895  -0.001
  157    HA   LEU 529           HA       LEU 529  11.788   4.138  -1.207
  158    HB2  LEU 529           2HB      LEU 529  10.666   6.156  -2.590
  159    HB3  LEU 529           1HB      LEU 529  11.729   5.490  -3.816
  160    HG   LEU 529           HG       LEU 529   9.355   4.259  -2.504
  161   HD11  LEU 529          1HD1      LEU 529   9.483   3.368  -5.057
  162   HD12  LEU 529          2HD1      LEU 529  10.308   4.920  -5.201
  163   HD13  LEU 529          3HD1      LEU 529   8.667   4.850  -4.562
  164   HD21  LEU 529          3HD2      LEU 529  11.616   2.701  -3.733
  165   HD22  LEU 529          1HD2      LEU 529  10.068   2.040  -3.208
  166   HD23  LEU 529          2HD2      LEU 529  11.189   2.717  -2.020
  167    H    ALA 530           H        ALA 530  14.376   6.087  -2.422
  168    HA   ALA 530           HA       ALA 530  15.438   4.003  -4.060
  169    HB1  ALA 530           1HB      ALA 530  15.776   6.680  -4.073
  170    HB2  ALA 530           2HB      ALA 530  16.873   5.546  -4.862
  171    HB3  ALA 530           3HB      ALA 530  17.257   6.173  -3.259
  172    H    TRP 531           H        TRP 531  15.671   4.851  -0.762
  173    HA   TRP 531           HA       TRP 531  18.165   3.937   0.009
  174    HB2  TRP 531           2HB      TRP 531  17.041   3.428   2.221
  175    HB3  TRP 531           1HB      TRP 531  16.776   5.056   1.612
  176    HD1  TRP 531           HD       TRP 531  14.350   5.149   0.038
  177    HE1  TRP 531           1HE      TRP 531  12.067   4.310   0.790
  178    HE3  TRP 531           3HE      TRP 531  15.850   1.948   3.725
  179    HZ2  TRP 531           2HZ      TRP 531  11.002   2.524   2.711
  180    HZ3  TRP 531           3HZ      TRP 531  14.130   0.714   4.982
  181    HH2  TRP 531           HH       TRP 531  11.756   0.999   4.485
  182    H    ILE 532           H        ILE 532  15.407   2.207  -1.070
  183    HA   ILE 532           HA       ILE 532  16.667  -0.363  -0.426
  184    HB   ILE 532           HB       ILE 532  14.373  -1.297  -0.647
  185   HG12  ILE 532          2HG1      ILE 532  13.829   1.491  -1.397
  186   HG13  ILE 532          1HG1      ILE 532  12.953   0.037  -1.797
  187   HG21  ILE 532          1HG2      ILE 532  13.567  -0.344   1.537
  188   HG22  ILE 532          2HG2      ILE 532  14.884   0.828   1.416
  189   HG23  ILE 532          3HG2      ILE 532  15.246  -0.895   1.536
  190   HD11  ILE 532          3HD1      ILE 532  11.478   0.303  -0.110
  191   HD12  ILE 532          1HD1      ILE 532  11.947   1.990  -0.298
  192   HD13  ILE 532          2HD1      ILE 532  12.670   1.013   0.973
  193    HA   PRO 533           HA       PRO 533  16.880  -0.488  -4.922
  194    HB2  PRO 533           2HB      PRO 533  18.808  -2.305  -5.143
  195    HB3  PRO 533           1HB      PRO 533  19.145  -0.694  -4.498
  196    HG2  PRO 533           2HG      PRO 533  18.825  -3.284  -3.055
  197    HG3  PRO 533           1HG      PRO 533  19.930  -1.940  -2.720
  198    HD2  PRO 533           2HD      PRO 533  17.485  -2.432  -1.434
  199    HD3  PRO 533           1HD      PRO 533  18.414  -0.922  -1.372
  200    H    TYR 534           H        TYR 534  14.832  -2.152  -3.454
  201    HA   TYR 534           HA       TYR 534  13.932  -3.738  -5.525
  202    HB2  TYR 534           2HB      TYR 534  14.431  -6.045  -4.585
  203    HB3  TYR 534           1HB      TYR 534  15.786  -5.217  -5.342
  204    HD1  TYR 534           1HD      TYR 534  14.235  -5.787  -1.982
  205    HD2  TYR 534           2HD      TYR 534  17.796  -5.047  -4.198
  206    HE1  TYR 534           1HE      TYR 534  15.565  -6.087   0.059
  207    HE2  TYR 534           2HE      TYR 534  19.132  -5.347  -2.157
  208    HH   TYR 534           HH       TYR 534  18.769  -5.158   0.327
  209    H    PHE 535           H        PHE 535  14.242  -3.417  -2.071
  210    HA   PHE 535           HA       PHE 535  11.855  -4.792  -1.405
  211    HB2  PHE 535           2HB      PHE 535  13.416  -4.690   0.289
  212    HB3  PHE 535           1HB      PHE 535  13.786  -3.005   0.013
  213    HD1  PHE 535           2HD      PHE 535  12.125  -1.286   0.716
  214    HD2  PHE 535           1HD      PHE 535  11.862  -5.352   1.903
  215    HE1  PHE 535           2HE      PHE 535  10.657  -0.630   2.577
  216    HE2  PHE 535           1HE      PHE 535  10.391  -4.713   3.777
  217    HZ   PHE 535           HZ       PHE 535   9.795  -2.344   4.111
  218    H    GLY 536           H        GLY 536  12.521  -1.638  -2.519
  219    HA2  GLY 536           2HA      GLY 536   9.765  -0.790  -1.847
  220    HA3  GLY 536           1HA      GLY 536  11.110   0.326  -2.003
  221    HA   PRO 537           HA       PRO 537  10.433   1.137  -6.267
  222    HB2  PRO 537           2HB      PRO 537  13.005  -0.189  -6.975
  223    HB3  PRO 537           1HB      PRO 537  12.434   1.437  -7.365
  224    HG2  PRO 537           2HG      PRO 537  14.287   1.045  -5.482
  225    HG3  PRO 537           1HG      PRO 537  13.039   2.291  -5.296
  226    HD2  PRO 537           2HD      PRO 537  13.270  -0.377  -3.991
  227    HD3  PRO 537           1HD      PRO 537  12.627   1.147  -3.347
  228    H    ALA 538           H        ALA 538  11.828  -2.058  -5.652
  229    HA   ALA 538           HA       ALA 538  10.416  -3.202  -7.935
  230    HB1  ALA 538           1HB      ALA 538  12.040  -4.815  -6.014
  231    HB2  ALA 538           2HB      ALA 538  12.844  -3.746  -7.164
  232    HB3  ALA 538           3HB      ALA 538  11.800  -5.041  -7.747
  233    H    ALA 539           H        ALA 539  10.005  -2.778  -4.577
  234    HA   ALA 539           HA       ALA 539   8.703  -4.965  -3.629
  235    HB1  ALA 539           1HB      ALA 539   7.310  -2.505  -2.920
  236    HB2  ALA 539           2HB      ALA 539   9.064  -2.382  -2.796
  237    HB3  ALA 539           3HB      ALA 539   8.205  -3.638  -1.906
  238    H    GLU 540           H        GLU 540   7.143  -2.313  -5.423
  239    HA   GLU 540           HA       GLU 540   5.330  -2.260  -6.777
  240    HB2  GLU 540           2HB      GLU 540   5.281  -5.254  -6.495
  241    HB3  GLU 540           1HB      GLU 540   4.448  -4.307  -7.717
  242    HG2  GLU 540           2HG      GLU 540   7.185  -3.616  -7.823
  243    HG3  GLU 540           1HG      GLU 540   7.079  -5.374  -7.764
  244    H    GLY 541           H        GLY 541   4.710  -4.846  -4.389
  245    HA2  GLY 541           2HA      GLY 541   2.074  -3.626  -3.906
  246    HA3  GLY 541           1HA      GLY 541   2.507  -5.286  -3.535
  247    H    ILE 542           H        ILE 542   4.651  -2.690  -2.700
  248    HA   ILE 542           HA       ILE 542   3.667  -2.590   0.037
  249    HB   ILE 542           HB       ILE 542   6.577  -3.058  -0.201
  250   HG12  ILE 542          2HG1      ILE 542   6.137  -5.559   0.002
  251   HG13  ILE 542          1HG1      ILE 542   4.512  -5.217  -0.588
  252   HG21  ILE 542          1HG2      ILE 542   4.468  -3.205   1.806
  253   HG22  ILE 542          2HG2      ILE 542   6.198  -2.911   1.997
  254   HG23  ILE 542          3HG2      ILE 542   5.593  -4.563   1.868
  255   HD11  ILE 542          3HD1      ILE 542   6.085  -3.923  -2.417
  256   HD12  ILE 542          1HD1      ILE 542   5.387  -5.532  -2.616
  257   HD13  ILE 542          2HD1      ILE 542   7.041  -5.356  -2.029
  258    H    TYR 543           H        TYR 543   4.802  -0.967  -2.593
  259    HA   TYR 543           HA       TYR 543   5.811   1.194  -0.945
  260    HB2  TYR 543           2HB      TYR 543   7.656   1.430  -2.226
  261    HB3  TYR 543           1HB      TYR 543   7.385  -0.269  -2.550
  262    HD1  TYR 543           2HD      TYR 543   6.153  -0.916  -4.643
  263    HD2  TYR 543           1HD      TYR 543   7.615   3.019  -3.962
  264    HE1  TYR 543           2HE      TYR 543   5.996  -0.444  -7.052
  265    HE2  TYR 543           1HE      TYR 543   7.463   3.506  -6.362
  266    HH   TYR 543           HH       TYR 543   5.811   1.473  -8.550
  267    H    ILE 544           H        ILE 544   4.287   0.249  -3.982
  268    HA   ILE 544           HA       ILE 544   3.115   1.443  -5.559
  269    HB   ILE 544           HB       ILE 544   1.545   2.272  -3.128
  270   HG12  ILE 544          2HG1      ILE 544   0.337   0.012  -3.757
  271   HG13  ILE 544          1HG1      ILE 544   1.923  -0.411  -4.390
  272   HG21  ILE 544          1HG2      ILE 544  -0.347   1.783  -4.787
  273   HG22  ILE 544          2HG2      ILE 544   0.909   1.834  -6.024
  274   HG23  ILE 544          3HG2      ILE 544   0.598   3.252  -5.024
  275   HD11  ILE 544          3HD1      ILE 544   2.874   0.093  -2.150
  276   HD12  ILE 544          1HD1      ILE 544   1.734  -1.249  -2.167
  277   HD13  ILE 544          2HD1      ILE 544   1.232   0.328  -1.561
  278    H    GLU 545           H        GLU 545   2.782   3.628  -2.800
  279    HA   GLU 545           HA       GLU 545   3.141   5.854  -2.543
  280    HB2  GLU 545           2HB      GLU 545   5.050   5.550  -4.860
  281    HB3  GLU 545           1HB      GLU 545   5.028   6.857  -3.679
  282    HG2  GLU 545           2HG      GLU 545   5.287   4.874  -1.980
  283    HG3  GLU 545           1HG      GLU 545   5.954   4.050  -3.389
  284    H    GLY 546           H        GLY 546   1.005   4.962  -4.197
  285    HA2  GLY 546           2HA      GLY 546   0.558   7.443  -5.675
  286    HA3  GLY 546           1HA      GLY 546   0.412   5.938  -6.569
  287    H    LEU 547           H        LEU 547  -0.516   5.658  -3.308
  288    HA   LEU 547           HA       LEU 547  -3.259   6.471  -3.709
  289    HB2  LEU 547           2HB      LEU 547  -4.313   4.433  -3.815
  290    HB3  LEU 547           1HB      LEU 547  -2.894   4.164  -4.808
  291    HG   LEU 547           HG       LEU 547  -3.272   3.246  -1.957
  292   HD11  LEU 547          1HD1      LEU 547  -4.553   1.995  -3.658
  293   HD12  LEU 547          2HD1      LEU 547  -3.302   1.023  -2.883
  294   HD13  LEU 547          3HD1      LEU 547  -3.044   1.658  -4.507
  295   HD21  LEU 547          3HD2      LEU 547  -1.036   3.363  -1.887
  296   HD22  LEU 547          1HD2      LEU 547  -0.890   3.540  -3.634
  297   HD23  LEU 547          2HD2      LEU 547  -1.087   1.937  -2.923
  298    H    MET 548           H        MET 548  -0.736   5.416  -1.620
  299    HA   MET 548           HA       MET 548  -2.294   4.954   0.699
  300    HB2  MET 548           2HB      MET 548   0.019   5.489   1.838
  301    HB3  MET 548           1HB      MET 548  -0.225   3.995   0.950
  302    HG2  MET 548           2HG      MET 548   1.922   4.966   0.427
  303    HG3  MET 548           1HG      MET 548   0.888   4.960  -0.996
  304    HE1  MET 548           3HE      MET 548   0.397   7.956  -2.267
  305    HE2  MET 548           1HE      MET 548   1.118   6.356  -2.441
  306    HE3  MET 548           2HE      MET 548   2.150   7.783  -2.355
  307    H    HIS 549           H        HIS 549  -3.595   7.001   0.100
  308    HA   HIS 549           HA       HIS 549  -2.442   9.309   1.519
  309    HB2  HIS 549           2HB      HIS 549  -4.819   9.629  -0.249
  310    HB3  HIS 549           1HB      HIS 549  -3.509  10.754   0.081
  311    HD1  HIS 549           1HD      HIS 549  -4.698   9.688  -2.766
  312    HD2  HIS 549           2HD      HIS 549  -1.064   8.742  -0.989
  313    HE1  HIS 549           1HE      HIS 549  -3.202   8.960  -4.649
  314    HE2  HIS 549           2HE      HIS 549  -0.972   8.512  -3.564
  315    H    ASN 550           H        ASN 550  -5.380   7.416   1.002
  316    HA   ASN 550           HA       ASN 550  -6.202   7.296   3.630
  317    HB2  ASN 550           2HB      ASN 550  -6.862   9.850   2.349
  318    HB3  ASN 550           1HB      ASN 550  -8.259   9.027   3.036
  319   HD21  ASN 550          1HD2      ASN 550  -7.803   8.111   5.294
  320   HD22  ASN 550          2HD2      ASN 550  -7.006   9.187   6.387
  321    H    GLN 551           H        GLN 551  -8.174   8.373   0.899
  322    HA   GLN 551           HA       GLN 551 -10.044   7.448  -0.023
  323    HB2  GLN 551           2HB      GLN 551  -9.039   4.869  -0.662
  324    HB3  GLN 551           1HB      GLN 551  -9.196   6.274  -1.698
  325    HG2  GLN 551           2HG      GLN 551  -6.964   5.756  -1.896
  326    HG3  GLN 551           1HG      GLN 551  -6.953   7.018  -0.670
  327   HE21  GLN 551          1HE2      GLN 551  -7.775   3.585  -0.355
  328   HE22  GLN 551          2HE2      GLN 551  -6.537   3.219   0.789
  329    H    ASP 552           H        ASP 552  -8.879   4.343   1.100
  330    HA   ASP 552           HA       ASP 552  -9.794   2.730   2.405
  331    HB2  ASP 552           2HB      ASP 552 -10.117   5.126   3.846
  332    HB3  ASP 552           1HB      ASP 552 -11.668   4.298   3.954
  333    H    GLY 553           H        GLY 553 -11.184   3.941  -0.037
  334    HA2  GLY 553           2HA      GLY 553 -13.813   2.682   0.445
  335    HA3  GLY 553           1HA      GLY 553 -13.621   4.112  -0.559
  336    H    LEU 554           H        LEU 554 -11.130   3.156  -1.741
  337    HA   LEU 554           HA       LEU 554 -12.267   1.634  -3.889
  338    HB2  LEU 554           2HB      LEU 554 -10.013   1.800  -4.867
  339    HB3  LEU 554           1HB      LEU 554 -10.663   3.354  -4.384
  340    HG   LEU 554           HG       LEU 554  -9.222   2.557  -2.151
  341   HD11  LEU 554          1HD1      LEU 554  -8.332   0.766  -3.837
  342   HD12  LEU 554          2HD1      LEU 554  -7.217   1.615  -2.767
  343   HD13  LEU 554          3HD1      LEU 554  -7.371   2.112  -4.451
  344   HD21  LEU 554          3HD2      LEU 554  -9.272   4.802  -2.966
  345   HD22  LEU 554          1HD2      LEU 554  -8.477   4.335  -4.469
  346   HD23  LEU 554          2HD2      LEU 554  -7.591   4.271  -2.947
  347    H    ILE 555           H        ILE 555 -11.146   0.720  -0.928
  348    HA   ILE 555           HA       ILE 555 -10.587  -1.991  -1.857
  349    HB   ILE 555           HB       ILE 555  -8.716  -2.216  -0.299
  350   HG12  ILE 555          2HG1      ILE 555  -9.431  -0.438   1.288
  351   HG13  ILE 555          1HG1      ILE 555  -7.750  -0.302   0.819
  352   HG21  ILE 555          1HG2      ILE 555  -8.706  -0.817  -2.733
  353   HG22  ILE 555          2HG2      ILE 555  -7.377  -1.701  -1.985
  354   HG23  ILE 555          3HG2      ILE 555  -7.581   0.022  -1.666
  355   HD11  ILE 555          3HD1      ILE 555  -9.025   1.262  -1.022
  356   HD12  ILE 555          1HD1      ILE 555  -8.177   1.825   0.416
  357   HD13  ILE 555          2HD1      ILE 555  -9.921   1.565   0.465
  358    H    CYS 556           H        CYS 556 -11.279   0.199   0.806
  359    HA   CYS 556           HA       CYS 556 -12.516  -2.023   2.268
  360    HB2  CYS 556           2HB      CYS 556 -10.543  -0.220   3.078
  361    HB3  CYS 556           1HB      CYS 556 -12.013   0.366   3.851
  362    H    GLY 557           H        GLY 557 -14.346  -1.416   0.667
  363    HA2  GLY 557           2HA      GLY 557 -16.477  -0.343   2.034
  364    HA3  GLY 557           1HA      GLY 557 -15.772   1.017   1.178
  365    H    LEU 558           H        LEU 558 -14.961  -0.741  -1.094
  366    HA   LEU 558           HA       LEU 558 -17.015  -0.269  -2.840
  367    HB2  LEU 558           2HB      LEU 558 -16.036  -2.343  -4.099
  368    HB3  LEU 558           1HB      LEU 558 -15.099  -0.873  -3.928
  369    HG   LEU 558           HG       LEU 558 -14.688  -2.828  -1.768
  370   HD11  LEU 558          1HD1      LEU 558 -14.240  -3.538  -4.621
  371   HD12  LEU 558          2HD1      LEU 558 -14.709  -4.558  -3.260
  372   HD13  LEU 558          3HD1      LEU 558 -13.037  -4.023  -3.426
  373   HD21  LEU 558          3HD2      LEU 558 -13.082  -1.276  -1.585
  374   HD22  LEU 558          1HD2      LEU 558 -13.207  -0.799  -3.278
  375   HD23  LEU 558          2HD2      LEU 558 -12.268  -2.221  -2.830
  376    H    ARG 559           H        ARG 559 -16.343  -3.496  -1.472
  377    HA   ARG 559           HA       ARG 559 -19.037  -4.030  -0.814
  378    HB2  ARG 559           2HB      ARG 559 -19.576  -5.688  -2.506
  379    HB3  ARG 559           1HB      ARG 559 -19.217  -4.153  -3.291
  380    HG2  ARG 559           2HG      ARG 559 -16.903  -5.912  -2.944
  381    HG3  ARG 559           1HG      ARG 559 -18.161  -6.548  -4.009
  382    HD2  ARG 559           2HD      ARG 559 -18.008  -4.011  -4.903
  383    HD3  ARG 559           1HD      ARG 559 -16.350  -4.246  -4.354
  384    HE   ARG 559           HE       ARG 559 -16.007  -5.687  -6.101
  385   HH11  ARG 559          1HH1      ARG 559 -19.436  -5.153  -5.729
  386   HH12  ARG 559          2HH1      ARG 559 -19.849  -5.979  -7.194
  387   HH21  ARG 559          1HH2      ARG 559 -16.549  -6.774  -8.026
  388   HH22  ARG 559          2HH2      ARG 559 -18.211  -6.901  -8.497
  389    H    GLN 560           H        GLN 560 -16.473  -4.211   0.314
  390    HA   GLN 560           HA       GLN 560 -15.983  -7.078   0.581
  391    HB2  GLN 560           2HB      GLN 560 -13.946  -6.206   1.903
  392    HB3  GLN 560           1HB      GLN 560 -13.957  -6.009   0.156
  393    HG2  GLN 560           2HG      GLN 560 -13.148  -4.026   1.444
  394    HG3  GLN 560           1HG      GLN 560 -14.469  -3.701   0.324
  395   HE21  GLN 560          1HE2      GLN 560 -16.170  -2.651   1.074
  396   HE22  GLN 560          2HE2      GLN 560 -16.554  -2.407   2.740
  Start of MODEL   15
    1    H1   ALA 507           1HT      ALA 507 -12.261 -11.925  -6.263
    2    H2   ALA 507           2HT      ALA 507 -10.706 -11.199  -6.252
    3    H3   ALA 507           3HT      ALA 507 -11.253 -12.038  -7.645
    4    HA   ALA 507           HA       ALA 507 -11.304  -9.541  -7.658
    5    HB1  ALA 507           1HB      ALA 507 -13.786  -9.780  -8.630
    6    HB2  ALA 507           2HB      ALA 507 -13.349 -11.486  -8.534
    7    HB3  ALA 507           3HB      ALA 507 -12.358 -10.373  -9.478
    8    H    GLN 508           H        GLN 508 -11.789 -10.233  -4.848
    9    HA   GLN 508           HA       GLN 508 -13.486  -8.020  -4.198
   10    HB2  GLN 508           2HB      GLN 508 -14.477 -10.815  -3.915
   11    HB3  GLN 508           1HB      GLN 508 -14.851  -9.681  -2.625
   12    HG2  GLN 508           2HG      GLN 508 -15.699  -8.146  -4.500
   13    HG3  GLN 508           1HG      GLN 508 -15.683  -9.601  -5.497
   14   HE21  GLN 508          1HE2      GLN 508 -17.783  -7.767  -4.146
   15   HE22  GLN 508          2HE2      GLN 508 -18.906  -8.897  -3.480
   16    HA   PRO 509           HA       PRO 509 -10.242  -9.433  -1.074
   17    HB2  PRO 509           2HB      PRO 509  -8.295  -7.651  -1.578
   18    HB3  PRO 509           1HB      PRO 509  -8.434  -9.161  -2.487
   19    HG2  PRO 509           2HG      PRO 509  -9.304  -6.402  -3.255
   20    HG3  PRO 509           1HG      PRO 509  -8.484  -7.630  -4.236
   21    HD2  PRO 509           2HD      PRO 509 -11.175  -7.156  -4.346
   22    HD3  PRO 509           1HD      PRO 509 -10.439  -8.728  -4.715
   23    H    LYS 510           H        LYS 510 -11.346  -8.702   0.685
   24    HA   LYS 510           HA       LYS 510 -12.176  -6.023   1.066
   25    HB2  LYS 510           2HB      LYS 510 -11.803  -8.268   3.054
   26    HB3  LYS 510           1HB      LYS 510 -12.587  -6.738   3.419
   27    HG2  LYS 510           2HG      LYS 510 -14.512  -7.395   2.520
   28    HG3  LYS 510           1HG      LYS 510 -13.717  -8.011   1.071
   29    HD2  LYS 510           2HD      LYS 510 -13.039  -9.792   3.132
   30    HD3  LYS 510           1HD      LYS 510 -14.757  -9.449   3.339
   31    HE2  LYS 510           2HE      LYS 510 -14.875  -9.859   0.774
   32    HE3  LYS 510           1HE      LYS 510 -13.335 -10.683   1.015
   33    HZ1  LYS 510           3HZ      LYS 510 -14.652 -11.874   2.898
   34    HZ2  LYS 510           1HZ      LYS 510 -14.815 -12.387   1.294
   35    HZ3  LYS 510           2HZ      LYS 510 -16.005 -11.411   1.996
   36    H    CYS 511           H        CYS 511 -10.929  -4.326   1.463
   37    HA   CYS 511           HA       CYS 511  -9.215  -3.014   2.182
   38    HB2  CYS 511           2HB      CYS 511  -9.856  -4.786   4.350
   39    HB3  CYS 511           1HB      CYS 511  -8.125  -4.468   4.352
   40    H    ASN 512           H        ASN 512  -7.753  -3.141   0.545
   41    HA   ASN 512           HA       ASN 512  -5.891  -5.376   0.484
   42    HB2  ASN 512           2HB      ASN 512  -6.111  -3.121  -1.507
   43    HB3  ASN 512           1HB      ASN 512  -5.227  -4.627  -1.703
   44   HD21  ASN 512          1HD2      ASN 512  -8.482  -3.345  -1.173
   45   HD22  ASN 512          2HD2      ASN 512  -9.300  -4.587  -2.046
   46    HA   PRO 513           HA       PRO 513  -2.887  -1.855   1.368
   47    HB2  PRO 513           2HB      PRO 513  -3.592   0.664   0.750
   48    HB3  PRO 513           1HB      PRO 513  -3.200  -0.530  -0.491
   49    HG2  PRO 513           2HG      PRO 513  -5.780   0.675   0.099
   50    HG3  PRO 513           1HG      PRO 513  -5.320  -0.351  -1.268
   51    HD2  PRO 513           2HD      PRO 513  -6.620  -1.096   1.277
   52    HD3  PRO 513           1HD      PRO 513  -6.624  -1.933  -0.287
   53    H    ASN 514           H        ASN 514  -5.581  -2.121   3.058
   54    HA   ASN 514           HA       ASN 514  -4.886   0.002   4.977
   55    HB2  ASN 514           2HB      ASN 514  -7.484  -0.905   3.912
   56    HB3  ASN 514           1HB      ASN 514  -7.440  -0.684   5.659
   57   HD21  ASN 514          1HD2      ASN 514  -7.290   0.861   2.562
   58   HD22  ASN 514          2HD2      ASN 514  -7.397   2.485   3.138
   59    H    LEU 515           H        LEU 515  -3.367  -2.041   5.251
   60    HA   LEU 515           HA       LEU 515  -4.570  -3.741   7.331
   61    HB2  LEU 515           2HB      LEU 515  -2.074  -4.619   6.017
   62    HB3  LEU 515           1HB      LEU 515  -3.440  -5.561   6.570
   63    HG   LEU 515           HG       LEU 515  -3.388  -5.825   4.237
   64   HD11  LEU 515          1HD1      LEU 515  -5.566  -4.715   5.483
   65   HD12  LEU 515          2HD1      LEU 515  -5.552  -5.441   3.876
   66   HD13  LEU 515          3HD1      LEU 515  -5.366  -3.699   4.058
   67   HD21  LEU 515          3HD2      LEU 515  -2.400  -4.367   2.886
   68   HD22  LEU 515          1HD2      LEU 515  -2.192  -3.272   4.252
   69   HD23  LEU 515          2HD2      LEU 515  -3.633  -3.156   3.241
   70    H    HIS 516           H        HIS 516  -1.369  -2.525   6.291
   71    HA   HIS 516           HA       HIS 516  -0.814  -1.266   8.749
   72    HB2  HIS 516           2HB      HIS 516   0.450  -2.770   9.940
   73    HB3  HIS 516           1HB      HIS 516  -0.715  -3.864   9.199
   74    HD1  HIS 516           1HD      HIS 516   0.148  -5.433   7.348
   75    HD2  HIS 516           2HD      HIS 516   3.033  -2.912   8.933
   76    HE1  HIS 516           1HE      HIS 516   2.317  -6.206   6.356
   77    HE2  HIS 516           2HE      HIS 516   4.060  -4.654   7.308
   78    H    TYR 517           H        TYR 517   0.950  -3.135   6.263
   79    HA   TYR 517           HA       TYR 517   3.256  -1.635   6.161
   80    HB2  TYR 517           2HB      TYR 517   2.690  -2.376   3.471
   81    HB3  TYR 517           1HB      TYR 517   3.853  -3.070   4.577
   82    HD1  TYR 517           1HD      TYR 517   0.092  -3.341   4.720
   83    HD2  TYR 517           2HD      TYR 517   3.812  -5.301   4.035
   84    HE1  TYR 517           1HE      TYR 517  -1.072  -5.491   4.568
   85    HE2  TYR 517           2HE      TYR 517   2.647  -7.458   3.889
   86    HH   TYR 517           HH       TYR 517   0.244  -8.330   4.925
   87    H    TRP 518           H        TRP 518   0.182  -0.567   5.260
   88    HA   TRP 518           HA       TRP 518   1.374   1.596   3.666
   89    HB2  TRP 518           2HB      TRP 518  -1.500   0.822   3.347
   90    HB3  TRP 518           1HB      TRP 518  -0.410   1.537   2.181
   91    HD1  TRP 518           HD       TRP 518   0.363  -1.752   3.988
   92    HE1  TRP 518           1HE      TRP 518   0.495  -3.599   2.280
   93    HE3  TRP 518           3HE      TRP 518  -1.174   0.848  -0.127
   94    HZ2  TRP 518           2HZ      TRP 518  -0.009  -3.984  -0.467
   95    HZ3  TRP 518           3HZ      TRP 518  -1.332  -0.352  -2.269
   96    HH2  TRP 518           HH       TRP 518  -0.758  -2.719  -2.437
   97    H    THR 519           H        THR 519  -1.111   0.649   5.936
   98    HA   THR 519           HA       THR 519  -2.059   3.293   6.454
   99    HB   THR 519           HB       THR 519  -3.458   1.299   6.785
  100    HG1  THR 519           1HG      THR 519  -4.407   2.059   8.579
  101   HG21  THR 519          3HG2      THR 519  -1.225   0.458   8.443
  102   HG22  THR 519          1HG2      THR 519  -2.523  -0.489   7.716
  103   HG23  THR 519          2HG2      THR 519  -2.785   0.321   9.259
  104    H    THR 520           H        THR 520   0.583   1.416   7.619
  105    HA   THR 520           HA       THR 520   0.827   2.864  10.102
  106    HB   THR 520           HB       THR 520   1.613   0.397   9.439
  107    HG1  THR 520           1HG      THR 520   3.083   1.984  11.257
  108   HG21  THR 520          3HG2      THR 520   4.079   0.297   9.396
  109   HG22  THR 520          1HG2      THR 520   4.115   2.032   9.079
  110   HG23  THR 520          2HG2      THR 520   3.379   0.934   7.910
  111    H    GLN 521           H        GLN 521   2.872   2.599   7.193
  112    HA   GLN 521           HA       GLN 521   4.145   5.106   7.978
  113    HB2  GLN 521           2HB      GLN 521   5.991   4.500   6.651
  114    HB3  GLN 521           1HB      GLN 521   5.499   3.023   7.468
  115    HG2  GLN 521           2HG      GLN 521   4.661   2.077   5.526
  116    HG3  GLN 521           1HG      GLN 521   4.544   3.629   4.708
  117   HE21  GLN 521          1HE2      GLN 521   6.601   4.725   4.183
  118   HE22  GLN 521          2HE2      GLN 521   7.965   3.745   3.773
  119    H    ASP 522           H        ASP 522   5.092   5.728   5.358
  120    HA   ASP 522           HA       ASP 522   2.632   6.881   4.269
  121    HB2  ASP 522           2HB      ASP 522   5.480   7.719   4.314
  122    HB3  ASP 522           1HB      ASP 522   4.459   8.281   2.997
  123    H    GLU 523           H        GLU 523   3.403   4.182   3.714
  124    HA   GLU 523           HA       GLU 523   3.799   2.705   2.004
  125    HB2  GLU 523           2HB      GLU 523   1.889   4.733   1.122
  126    HB3  GLU 523           1HB      GLU 523   2.694   3.916  -0.215
  127    HG2  GLU 523           2HG      GLU 523   2.035   1.761   0.724
  128    HG3  GLU 523           1HG      GLU 523   1.205   2.599   2.032
  129    H    GLY 524           H        GLY 524   6.104   3.254   2.190
  130    HA2  GLY 524           2HA      GLY 524   8.026   3.319   0.823
  131    HA3  GLY 524           1HA      GLY 524   7.100   4.205  -0.385
  132    H    ALA 525           H        ALA 525   5.988   5.941   1.789
  133    HA   ALA 525           HA       ALA 525   6.416   8.011   2.587
  134    HB1  ALA 525           1HB      ALA 525   9.173   7.529   3.363
  135    HB2  ALA 525           2HB      ALA 525   8.054   6.276   3.900
  136    HB3  ALA 525           3HB      ALA 525   7.777   7.958   4.353
  137    H    ALA 526           H        ALA 526   7.662   7.140  -0.191
  138    HA   ALA 526           HA       ALA 526   8.957   8.084  -1.802
  139    HB1  ALA 526           1HB      ALA 526   8.405  10.800  -0.763
  140    HB2  ALA 526           2HB      ALA 526   7.014   9.790  -1.158
  141    HB3  ALA 526           3HB      ALA 526   8.220  10.151  -2.393
  142    H    ILE 527           H        ILE 527  10.079   7.726   1.043
  143    HA   ILE 527           HA       ILE 527  11.935   9.671   1.654
  144    HB   ILE 527           HB       ILE 527  13.328   7.515   2.404
  145   HG12  ILE 527          2HG1      ILE 527  11.933   5.647   2.957
  146   HG13  ILE 527          1HG1      ILE 527  10.492   6.489   2.405
  147   HG21  ILE 527          1HG2      ILE 527  12.489   9.217   3.889
  148   HG22  ILE 527          2HG2      ILE 527  12.112   7.621   4.537
  149   HG23  ILE 527          3HG2      ILE 527  10.854   8.571   3.745
  150   HD11  ILE 527          3HD1      ILE 527  12.712   5.965   0.490
  151   HD12  ILE 527          1HD1      ILE 527  10.984   6.145   0.189
  152   HD13  ILE 527          2HD1      ILE 527  11.602   4.667   0.928
  153    H    GLY 528           H        GLY 528  11.971   7.413  -0.968
  154    HA2  GLY 528           2HA      GLY 528  13.787   8.633  -2.549
  155    HA3  GLY 528           1HA      GLY 528  14.813   7.710  -1.465
  156    H    LEU 529           H        LEU 529  13.602   5.358  -1.190
  157    HA   LEU 529           HA       LEU 529  13.103   3.347  -2.132
  158    HB2  LEU 529           2HB      LEU 529  12.463   5.040  -4.526
  159    HB3  LEU 529           1HB      LEU 529  12.312   3.298  -4.526
  160    HG   LEU 529           HG       LEU 529  10.573   3.365  -2.888
  161   HD11  LEU 529          1HD1      LEU 529  11.193   6.303  -2.678
  162   HD12  LEU 529          2HD1      LEU 529  11.371   5.074  -1.427
  163   HD13  LEU 529          3HD1      LEU 529   9.763   5.538  -1.983
  164   HD21  LEU 529          3HD2      LEU 529  10.348   5.205  -5.217
  165   HD22  LEU 529          1HD2      LEU 529   9.013   5.118  -4.068
  166   HD23  LEU 529          2HD2      LEU 529   9.548   3.664  -4.913
  167    H    ALA 530           H        ALA 530  15.400   5.459  -3.542
  168    HA   ALA 530           HA       ALA 530  16.627   3.431  -5.151
  169    HB1  ALA 530           1HB      ALA 530  16.694   6.136  -5.254
  170    HB2  ALA 530           2HB      ALA 530  17.864   5.085  -6.052
  171    HB3  ALA 530           3HB      ALA 530  18.243   5.794  -4.482
  172    H    TRP 531           H        TRP 531  16.868   4.548  -1.933
  173    HA   TRP 531           HA       TRP 531  19.461   3.713  -1.241
  174    HB2  TRP 531           2HB      TRP 531  18.600   3.806   1.088
  175    HB3  TRP 531           1HB      TRP 531  18.157   5.236   0.162
  176    HD1  TRP 531           HD       TRP 531  15.569   4.903  -1.056
  177    HE1  TRP 531           1HE      TRP 531  13.449   4.147   0.130
  178    HE3  TRP 531           3HE      TRP 531  17.681   2.609   2.994
  179    HZ2  TRP 531           2HZ      TRP 531  12.721   2.776   2.490
  180    HZ3  TRP 531           3HZ      TRP 531  16.194   1.603   4.678
  181    HH2  TRP 531           HH       TRP 531  13.765   1.685   4.431
  182    H    ILE 532           H        ILE 532  16.651   1.964  -2.002
  183    HA   ILE 532           HA       ILE 532  17.792  -0.478  -0.859
  184    HB   ILE 532           HB       ILE 532  15.386  -1.256  -0.725
  185   HG12  ILE 532          2HG1      ILE 532  14.995   1.667  -1.315
  186   HG13  ILE 532          1HG1      ILE 532  14.161   0.287  -2.011
  187   HG21  ILE 532          1HG2      ILE 532  16.684  -0.725   1.234
  188   HG22  ILE 532          2HG2      ILE 532  15.053  -0.088   1.444
  189   HG23  ILE 532          3HG2      ILE 532  16.376   0.997   1.008
  190   HD11  ILE 532          3HD1      ILE 532  12.527   0.493  -0.538
  191   HD12  ILE 532          1HD1      ILE 532  13.301   1.960   0.052
  192   HD13  ILE 532          2HD1      ILE 532  13.661   0.408   0.808
  193    HA   PRO 533           HA       PRO 533  17.518  -1.854  -5.072
  194    HB2  PRO 533           2HB      PRO 533  18.477  -4.318  -4.768
  195    HB3  PRO 533           1HB      PRO 533  19.495  -2.902  -4.478
  196    HG2  PRO 533           2HG      PRO 533  18.123  -4.684  -2.512
  197    HG3  PRO 533           1HG      PRO 533  19.738  -3.959  -2.431
  198    HD2  PRO 533           2HD      PRO 533  17.467  -2.968  -1.169
  199    HD3  PRO 533           1HD      PRO 533  18.939  -2.039  -1.507
  200    H    TYR 534           H        TYR 534  15.736  -3.458  -2.516
  201    HA   TYR 534           HA       TYR 534  13.823  -4.367  -4.521
  202    HB2  TYR 534           2HB      TYR 534  13.735  -6.649  -3.577
  203    HB3  TYR 534           1HB      TYR 534  15.293  -6.273  -4.305
  204    HD1  TYR 534           1HD      TYR 534  13.570  -6.231  -0.996
  205    HD2  TYR 534           2HD      TYR 534  17.228  -6.724  -3.110
  206    HE1  TYR 534           1HE      TYR 534  14.688  -6.868   1.100
  207    HE2  TYR 534           2HE      TYR 534  18.357  -7.362  -1.020
  208    HH   TYR 534           HH       TYR 534  16.963  -6.903   2.036
  209    H    PHE 535           H        PHE 535  14.205  -2.718  -1.764
  210    HA   PHE 535           HA       PHE 535  11.948  -3.814  -0.303
  211    HB2  PHE 535           2HB      PHE 535  13.646  -1.369   0.182
  212    HB3  PHE 535           1HB      PHE 535  12.358  -1.902   1.248
  213    HD1  PHE 535           1HD      PHE 535  15.492  -3.146  -0.329
  214    HD2  PHE 535           2HD      PHE 535  12.893  -3.233   3.036
  215    HE1  PHE 535           1HE      PHE 535  17.108  -4.544   0.875
  216    HE2  PHE 535           2HE      PHE 535  14.503  -4.637   4.248
  217    HZ   PHE 535           HZ       PHE 535  16.617  -5.298   3.170
  218    H    GLY 536           H        GLY 536  12.740  -0.977  -2.226
  219    HA2  GLY 536           2HA      GLY 536   9.910  -0.151  -2.125
  220    HA3  GLY 536           1HA      GLY 536  11.256   0.929  -2.447
  221    HA   PRO 537           HA       PRO 537  11.182   0.421  -6.826
  222    HB2  PRO 537           2HB      PRO 537  13.555  -1.377  -6.837
  223    HB3  PRO 537           1HB      PRO 537  13.279   0.127  -7.723
  224    HG2  PRO 537           2HG      PRO 537  14.909   0.058  -5.612
  225    HG3  PRO 537           1HG      PRO 537  13.861   1.455  -5.914
  226    HD2  PRO 537           2HD      PRO 537  13.574  -0.741  -3.921
  227    HD3  PRO 537           1HD      PRO 537  13.151   0.978  -3.777
  228    H    ALA 538           H        ALA 538  11.965  -2.578  -5.132
  229    HA   ALA 538           HA       ALA 538  10.592  -4.171  -7.157
  230    HB1  ALA 538           1HB      ALA 538  12.770  -4.914  -6.212
  231    HB2  ALA 538           2HB      ALA 538  11.473  -6.095  -6.025
  232    HB3  ALA 538           3HB      ALA 538  11.976  -5.112  -4.649
  233    H    ALA 539           H        ALA 539   9.963  -2.697  -4.138
  234    HA   ALA 539           HA       ALA 539   8.203  -4.360  -2.853
  235    HB1  ALA 539           1HB      ALA 539   8.895  -1.626  -2.745
  236    HB2  ALA 539           2HB      ALA 539   8.073  -2.593  -1.524
  237    HB3  ALA 539           3HB      ALA 539   7.135  -1.722  -2.737
  238    H    GLU 540           H        GLU 540   6.878  -1.632  -4.686
  239    HA   GLU 540           HA       GLU 540   5.194  -1.461  -6.193
  240    HB2  GLU 540           2HB      GLU 540   5.065  -4.463  -6.219
  241    HB3  GLU 540           1HB      GLU 540   4.434  -3.361  -7.430
  242    HG2  GLU 540           2HG      GLU 540   6.814  -2.614  -7.805
  243    HG3  GLU 540           1HG      GLU 540   7.301  -3.985  -6.810
  244    H    GLY 541           H        GLY 541   4.647  -3.987  -3.748
  245    HA2  GLY 541           2HA      GLY 541   1.876  -3.010  -3.499
  246    HA3  GLY 541           1HA      GLY 541   2.405  -4.627  -3.065
  247    H    ILE 542           H        ILE 542   4.172  -1.716  -2.254
  248    HA   ILE 542           HA       ILE 542   3.171  -1.723   0.475
  249    HB   ILE 542           HB       ILE 542   6.134  -1.790   0.201
  250   HG12  ILE 542          2HG1      ILE 542   5.983  -4.312   0.669
  251   HG13  ILE 542          1HG1      ILE 542   4.343  -4.206   0.039
  252   HG21  ILE 542          1HG2      ILE 542   4.684  -3.169   2.373
  253   HG22  ILE 542          2HG2      ILE 542   4.522  -1.415   2.300
  254   HG23  ILE 542          3HG2      ILE 542   6.120  -2.148   2.435
  255   HD11  ILE 542          3HD1      ILE 542   5.802  -2.938  -1.898
  256   HD12  ILE 542          1HD1      ILE 542   5.277  -4.622  -1.939
  257   HD13  ILE 542          2HD1      ILE 542   6.893  -4.217  -1.361
  258    H    TYR 543           H        TYR 543   5.191  -0.359  -2.039
  259    HA   TYR 543           HA       TYR 543   5.432   2.143  -0.601
  260    HB2  TYR 543           2HB      TYR 543   7.345   2.433  -1.763
  261    HB3  TYR 543           1HB      TYR 543   7.224   0.706  -2.019
  262    HD1  TYR 543           2HD      TYR 543   5.893  -0.021  -4.147
  263    HD2  TYR 543           1HD      TYR 543   7.614   3.824  -3.594
  264    HE1  TYR 543           2HE      TYR 543   5.881   0.326  -6.576
  265    HE2  TYR 543           1HE      TYR 543   7.611   4.185  -6.021
  266    HH   TYR 543           HH       TYR 543   7.536   2.092  -8.195
  267    H    ILE 544           H        ILE 544   4.113   0.789  -3.574
  268    HA   ILE 544           HA       ILE 544   2.897   1.703  -5.293
  269    HB   ILE 544           HB       ILE 544   1.247   2.803  -3.039
  270   HG12  ILE 544          2HG1      ILE 544   0.145   0.533  -3.056
  271   HG13  ILE 544          1HG1      ILE 544   1.523  -0.049  -3.982
  272   HG21  ILE 544          1HG2      ILE 544   0.776   2.036  -5.871
  273   HG22  ILE 544          2HG2      ILE 544   0.171   3.419  -4.960
  274   HG23  ILE 544          3HG2      ILE 544  -0.534   1.822  -4.710
  275   HD11  ILE 544          3HD1      ILE 544   2.847  -0.126  -2.183
  276   HD12  ILE 544          1HD1      ILE 544   1.329  -0.141  -1.291
  277   HD13  ILE 544          2HD1      ILE 544   2.207   1.372  -1.511
  278    H    GLU 545           H        GLU 545   2.442   4.197  -2.832
  279    HA   GLU 545           HA       GLU 545   2.731   6.446  -2.837
  280    HB2  GLU 545           2HB      GLU 545   4.512   6.069  -5.238
  281    HB3  GLU 545           1HB      GLU 545   4.539   7.388  -4.071
  282    HG2  GLU 545           2HG      GLU 545   5.092   5.637  -2.328
  283    HG3  GLU 545           1HG      GLU 545   5.383   4.536  -3.672
  284    H    GLY 546           H        GLY 546   0.596   5.219  -4.285
  285    HA2  GLY 546           2HA      GLY 546  -0.016   7.445  -6.101
  286    HA3  GLY 546           1HA      GLY 546  -0.266   5.796  -6.651
  287    H    LEU 547           H        LEU 547  -0.949   5.629  -3.464
  288    HA   LEU 547           HA       LEU 547  -3.680   6.666  -3.679
  289    HB2  LEU 547           2HB      LEU 547  -4.759   4.649  -3.308
  290    HB3  LEU 547           1HB      LEU 547  -3.525   4.261  -4.488
  291    HG   LEU 547           HG       LEU 547  -3.355   3.693  -1.528
  292   HD11  LEU 547          1HD1      LEU 547  -3.412   1.304  -2.378
  293   HD12  LEU 547          2HD1      LEU 547  -3.989   1.968  -3.906
  294   HD13  LEU 547          3HD1      LEU 547  -4.932   2.197  -2.433
  295   HD21  LEU 547          3HD2      LEU 547  -1.152   3.807  -2.018
  296   HD22  LEU 547          1HD2      LEU 547  -1.411   3.565  -3.745
  297   HD23  LEU 547          2HD2      LEU 547  -1.443   2.185  -2.647
  298    H    MET 548           H        MET 548  -0.965   6.135  -1.791
  299    HA   MET 548           HA       MET 548  -2.173   5.790   0.747
  300    HB2  MET 548           2HB      MET 548   0.170   6.764   1.497
  301    HB3  MET 548           1HB      MET 548   0.009   5.132   0.874
  302    HG2  MET 548           2HG      MET 548   1.944   6.218  -0.073
  303    HG3  MET 548           1HG      MET 548   0.754   5.898  -1.329
  304    HE1  MET 548           3HE      MET 548   0.343   7.128  -2.910
  305    HE2  MET 548           1HE      MET 548   1.494   8.425  -3.229
  306    HE3  MET 548           2HE      MET 548  -0.192   8.807  -2.885
  307    H    HIS 549           H        HIS 549  -3.834   7.528   0.278
  308    HA   HIS 549           HA       HIS 549  -2.875  10.022   1.498
  309    HB2  HIS 549           2HB      HIS 549  -5.091  10.541  -0.294
  310    HB3  HIS 549           1HB      HIS 549  -3.525  11.330  -0.198
  311    HD1  HIS 549           1HD      HIS 549  -5.459   9.899  -2.635
  312    HD2  HIS 549           2HD      HIS 549  -1.541   9.206  -1.447
  313    HE1  HIS 549           1HE      HIS 549  -4.338   8.835  -4.615
  314    HE2  HIS 549           2HE      HIS 549  -1.930   8.567  -3.923
  315    H    ASN 550           H        ASN 550  -4.149   7.751   2.695
  316    HA   ASN 550           HA       ASN 550  -5.840   7.220   4.128
  317    HB2  ASN 550           2HB      ASN 550  -5.047   9.557   4.940
  318    HB3  ASN 550           1HB      ASN 550  -6.562  10.134   4.254
  319   HD21  ASN 550          1HD2      ASN 550  -7.123  10.761   6.402
  320   HD22  ASN 550          2HD2      ASN 550  -7.741   9.594   7.516
  321    H    GLN 551           H        GLN 551  -7.224   6.104   2.812
  322    HA   GLN 551           HA       GLN 551  -9.494   7.632   1.747
  323    HB2  GLN 551           2HB      GLN 551  -9.337   5.262   0.251
  324    HB3  GLN 551           1HB      GLN 551  -9.032   6.897  -0.306
  325    HG2  GLN 551           2HG      GLN 551  -7.022   6.114  -0.863
  326    HG3  GLN 551           1HG      GLN 551  -6.645   6.268   0.849
  327   HE21  GLN 551          1HE2      GLN 551  -6.518   4.427   2.118
  328   HE22  GLN 551          2HE2      GLN 551  -6.482   2.834   1.454
  329    H    ASP 552           H        ASP 552  -8.817   4.196   1.995
  330    HA   ASP 552           HA       ASP 552  -9.862   2.484   3.072
  331    HB2  ASP 552           2HB      ASP 552  -9.845   4.502   4.939
  332    HB3  ASP 552           1HB      ASP 552 -11.559   4.109   4.837
  333    H    GLY 553           H        GLY 553 -11.045   4.007   0.800
  334    HA2  GLY 553           2HA      GLY 553 -13.801   2.994   1.095
  335    HA3  GLY 553           1HA      GLY 553 -13.484   4.557   0.356
  336    H    LEU 554           H        LEU 554 -11.120   3.748  -1.036
  337    HA   LEU 554           HA       LEU 554 -12.351   2.545  -3.351
  338    HB2  LEU 554           2HB      LEU 554 -10.221   3.029  -4.437
  339    HB3  LEU 554           1HB      LEU 554 -10.849   4.436  -3.599
  340    HG   LEU 554           HG       LEU 554  -9.228   3.327  -1.681
  341   HD11  LEU 554          1HD1      LEU 554  -8.520   1.871  -3.828
  342   HD12  LEU 554          2HD1      LEU 554  -7.406   2.304  -2.534
  343   HD13  LEU 554          3HD1      LEU 554  -7.434   3.246  -4.024
  344   HD21  LEU 554          3HD2      LEU 554  -7.573   5.101  -2.499
  345   HD22  LEU 554          1HD2      LEU 554  -9.191   5.637  -2.047
  346   HD23  LEU 554          2HD2      LEU 554  -8.766   5.456  -3.749
  347    H    ILE 555           H        ILE 555 -11.124   1.236  -0.640
  348    HA   ILE 555           HA       ILE 555 -10.346  -1.228  -2.005
  349    HB   ILE 555           HB       ILE 555  -8.505  -1.586  -0.416
  350   HG12  ILE 555          2HG1      ILE 555  -9.303  -0.135   1.406
  351   HG13  ILE 555          1HG1      ILE 555  -7.658   0.249   0.945
  352   HG21  ILE 555          1HG2      ILE 555  -7.325   0.764  -1.356
  353   HG22  ILE 555          2HG2      ILE 555  -8.542   0.325  -2.556
  354   HG23  ILE 555          3HG2      ILE 555  -7.289  -0.834  -2.104
  355   HD11  ILE 555          3HD1      ILE 555  -9.058   1.958  -0.613
  356   HD12  ILE 555          1HD1      ILE 555  -8.354   2.350   0.951
  357   HD13  ILE 555          2HD1      ILE 555 -10.050   1.892   0.841
  358    H    CYS 556           H        CYS 556 -11.166   0.377   1.025
  359    HA   CYS 556           HA       CYS 556 -12.286  -2.144   2.013
  360    HB2  CYS 556           2HB      CYS 556 -10.447  -0.476   3.208
  361    HB3  CYS 556           1HB      CYS 556 -11.961   0.033   3.952
  362    H    GLY 557           H        GLY 557 -14.437  -2.277   1.943
  363    HA2  GLY 557           2HA      GLY 557 -16.042   0.027   2.715
  364    HA3  GLY 557           1HA      GLY 557 -16.278  -0.558   1.078
  365    H    LEU 558           H        LEU 558 -16.747  -2.977   0.928
  366    HA   LEU 558           HA       LEU 558 -18.262  -3.908   3.254
  367    HB2  LEU 558           2HB      LEU 558 -20.158  -4.533   1.901
  368    HB3  LEU 558           1HB      LEU 558 -19.846  -2.816   1.738
  369    HG   LEU 558           HG       LEU 558 -19.010  -4.889  -0.291
  370   HD11  LEU 558          1HD1      LEU 558 -21.573  -4.219   0.220
  371   HD12  LEU 558          2HD1      LEU 558 -20.965  -4.661  -1.375
  372   HD13  LEU 558          3HD1      LEU 558 -21.133  -2.962  -0.937
  373   HD21  LEU 558          3HD2      LEU 558 -17.699  -3.225  -0.998
  374   HD22  LEU 558          1HD2      LEU 558 -18.483  -2.046   0.054
  375   HD23  LEU 558          2HD2      LEU 558 -19.187  -2.432  -1.515
  376    H    ARG 559           H        ARG 559 -17.052  -4.798   0.014
  377    HA   ARG 559           HA       ARG 559 -15.656  -7.047   0.919
  378    HB2  ARG 559           2HB      ARG 559 -17.047  -8.880   0.225
  379    HB3  ARG 559           1HB      ARG 559 -17.973  -7.882   1.337
  380    HG2  ARG 559           2HG      ARG 559 -18.322  -7.058  -1.419
  381    HG3  ARG 559           1HG      ARG 559 -18.781  -8.744  -1.157
  382    HD2  ARG 559           2HD      ARG 559 -19.753  -7.032   0.965
  383    HD3  ARG 559           1HD      ARG 559 -20.308  -6.480  -0.615
  384    HE   ARG 559           HE       ARG 559 -20.635  -9.309  -0.135
  385   HH11  ARG 559          1HH1      ARG 559 -22.090  -6.145   0.114
  386   HH12  ARG 559          2HH1      ARG 559 -23.710  -6.756   0.150
  387   HH21  ARG 559          1HH2      ARG 559 -22.765 -10.113  -0.087
  388   HH22  ARG 559          2HH2      ARG 559 -24.093  -9.008   0.035
  389    H    GLN 560           H        GLN 560 -15.273  -4.931  -0.869
  390    HA   GLN 560           HA       GLN 560 -15.208  -6.217  -3.501
  391    HB2  GLN 560           2HB      GLN 560 -14.947  -4.074  -4.462
  392    HB3  GLN 560           1HB      GLN 560 -16.157  -3.885  -3.200
  393    HG2  GLN 560           2HG      GLN 560 -13.645  -3.374  -2.021
  394    HG3  GLN 560           1HG      GLN 560 -13.693  -2.502  -3.551
  395   HE21  GLN 560          1HE2      GLN 560 -15.410  -3.029  -0.529
  396   HE22  GLN 560          2HE2      GLN 560 -16.206  -1.497  -0.502
  Start of MODEL   16
    1    H1   ALA 507           1HT      ALA 507 -14.244 -14.961  -2.729
    2    H2   ALA 507           2HT      ALA 507 -15.017 -14.602  -1.239
    3    H3   ALA 507           3HT      ALA 507 -13.326 -14.365  -1.410
    4    HA   ALA 507           HA       ALA 507 -13.610 -12.613  -2.879
    5    HB1  ALA 507           1HB      ALA 507 -15.941 -11.887  -3.503
    6    HB2  ALA 507           2HB      ALA 507 -16.503 -13.440  -2.882
    7    HB3  ALA 507           3HB      ALA 507 -15.385 -13.387  -4.244
    8    H    GLN 508           H        GLN 508 -14.911 -10.462  -2.406
    9    HA   GLN 508           HA       GLN 508 -15.599  -8.858  -0.934
   10    HB2  GLN 508           2HB      GLN 508 -17.032 -10.692   0.077
   11    HB3  GLN 508           1HB      GLN 508 -15.724 -10.974   1.218
   12    HG2  GLN 508           2HG      GLN 508 -16.798  -9.511   2.504
   13    HG3  GLN 508           1HG      GLN 508 -16.080  -8.292   1.453
   14   HE21  GLN 508          1HE2      GLN 508 -17.484  -8.288  -0.758
   15   HE22  GLN 508          2HE2      GLN 508 -19.157  -7.972  -0.471
   16    HA   PRO 509           HA       PRO 509 -11.182  -9.134   0.601
   17    HB2  PRO 509           2HB      PRO 509 -10.614  -7.060  -1.375
   18    HB3  PRO 509           1HB      PRO 509  -9.853  -8.636  -1.171
   19    HG2  PRO 509           2HG      PRO 509 -11.422  -8.058  -3.282
   20    HG3  PRO 509           1HG      PRO 509 -11.353  -9.682  -2.572
   21    HD2  PRO 509           2HD      PRO 509 -13.398  -7.522  -2.160
   22    HD3  PRO 509           1HD      PRO 509 -13.638  -9.256  -2.455
   23    H    LYS 510           H        LYS 510 -12.422  -8.110   2.405
   24    HA   LYS 510           HA       LYS 510 -12.884  -5.310   2.460
   25    HB2  LYS 510           2HB      LYS 510 -13.227  -5.597   4.850
   26    HB3  LYS 510           1HB      LYS 510 -14.019  -6.898   3.972
   27    HG2  LYS 510           2HG      LYS 510 -11.652  -8.062   4.452
   28    HG3  LYS 510           1HG      LYS 510 -11.744  -6.982   5.844
   29    HD2  LYS 510           2HD      LYS 510 -12.823  -8.819   6.686
   30    HD3  LYS 510           1HD      LYS 510 -14.192  -7.942   6.001
   31    HE2  LYS 510           2HE      LYS 510 -14.224  -9.328   4.073
   32    HE3  LYS 510           1HE      LYS 510 -12.667 -10.046   4.484
   33    HZ1  LYS 510           3HZ      LYS 510 -13.602 -11.450   5.957
   34    HZ2  LYS 510           1HZ      LYS 510 -14.991 -11.201   5.023
   35    HZ3  LYS 510           2HZ      LYS 510 -14.775 -10.341   6.463
   36    H    CYS 511           H        CYS 511 -11.306  -3.876   2.234
   37    HA   CYS 511           HA       CYS 511  -9.388  -2.713   2.570
   38    HB2  CYS 511           2HB      CYS 511  -9.918  -4.016   5.110
   39    HB3  CYS 511           1HB      CYS 511  -8.193  -3.773   4.854
   40    H    ASN 512           H        ASN 512  -8.170  -3.335   0.877
   41    HA   ASN 512           HA       ASN 512  -6.613  -5.792   1.073
   42    HB2  ASN 512           2HB      ASN 512  -6.888  -3.962  -1.313
   43    HB3  ASN 512           1HB      ASN 512  -6.186  -5.573  -1.292
   44   HD21  ASN 512          1HD2      ASN 512  -9.195  -3.838  -0.621
   45   HD22  ASN 512          2HD2      ASN 512 -10.242  -5.107  -1.127
   46    HA   PRO 513           HA       PRO 513  -3.150  -2.620   0.764
   47    HB2  PRO 513           2HB      PRO 513  -3.741  -0.106  -0.118
   48    HB3  PRO 513           1HB      PRO 513  -3.504  -1.490  -1.189
   49    HG2  PRO 513           2HG      PRO 513  -5.935  -0.031  -0.715
   50    HG3  PRO 513           1HG      PRO 513  -5.683  -1.408  -1.797
   51    HD2  PRO 513           2HD      PRO 513  -6.737  -1.350   0.969
   52    HD3  PRO 513           1HD      PRO 513  -7.074  -2.488  -0.348
   53    H    ASN 514           H        ASN 514  -5.534  -2.321   2.820
   54    HA   ASN 514           HA       ASN 514  -4.318  -0.110   4.333
   55    HB2  ASN 514           2HB      ASN 514  -7.156  -0.818   3.836
   56    HB3  ASN 514           1HB      ASN 514  -6.759  -0.330   5.479
   57   HD21  ASN 514          1HD2      ASN 514  -6.815   0.659   2.126
   58   HD22  ASN 514          2HD2      ASN 514  -6.735   2.356   2.433
   59    H    LEU 515           H        LEU 515  -3.093  -2.382   4.520
   60    HA   LEU 515           HA       LEU 515  -4.178  -3.911   6.755
   61    HB2  LEU 515           2HB      LEU 515  -1.616  -4.643   5.450
   62    HB3  LEU 515           1HB      LEU 515  -2.885  -5.671   6.076
   63    HG   LEU 515           HG       LEU 515  -2.965  -6.046   3.787
   64   HD11  LEU 515          1HD1      LEU 515  -5.103  -4.721   4.984
   65   HD12  LEU 515          2HD1      LEU 515  -5.143  -5.725   3.535
   66   HD13  LEU 515          3HD1      LEU 515  -4.932  -3.981   3.393
   67   HD21  LEU 515          3HD2      LEU 515  -2.025  -4.689   2.300
   68   HD22  LEU 515          1HD2      LEU 515  -1.719  -3.538   3.602
   69   HD23  LEU 515          2HD2      LEU 515  -3.199  -3.421   2.651
   70    H    HIS 516           H        HIS 516  -1.168  -2.246   5.805
   71    HA   HIS 516           HA       HIS 516  -0.737  -1.140   8.346
   72    HB2  HIS 516           2HB      HIS 516   0.770  -2.535   9.408
   73    HB3  HIS 516           1HB      HIS 516  -0.307  -3.709   8.656
   74    HD1  HIS 516           1HD      HIS 516   0.647  -5.148   6.769
   75    HD2  HIS 516           2HD      HIS 516   3.293  -2.305   8.219
   76    HE1  HIS 516           1HE      HIS 516   2.840  -5.657   5.662
   77    HE2  HIS 516           2HE      HIS 516   4.479  -4.040   6.697
   78    H    TYR 517           H        TYR 517   1.161  -2.557   5.668
   79    HA   TYR 517           HA       TYR 517   3.239  -0.715   5.756
   80    HB2  TYR 517           2HB      TYR 517   3.014  -1.434   3.042
   81    HB3  TYR 517           1HB      TYR 517   4.145  -2.033   4.234
   82    HD1  TYR 517           1HD      TYR 517   0.460  -2.755   4.037
   83    HD2  TYR 517           2HD      TYR 517   4.433  -4.219   3.576
   84    HE1  TYR 517           1HE      TYR 517  -0.409  -5.029   3.709
   85    HE2  TYR 517           2HE      TYR 517   3.563  -6.491   3.246
   86    HH   TYR 517           HH       TYR 517   1.048  -7.385   2.339
   87    H    TRP 518           H        TRP 518   0.078  -0.300   4.447
   88    HA   TRP 518           HA       TRP 518   1.000   2.197   3.185
   89    HB2  TRP 518           2HB      TRP 518  -1.625   1.108   2.361
   90    HB3  TRP 518           1HB      TRP 518  -0.383   1.882   1.405
   91    HD1  TRP 518           HD       TRP 518   0.962  -1.126   3.155
   92    HE1  TRP 518           1HE      TRP 518   1.175  -3.049   1.543
   93    HE3  TRP 518           3HE      TRP 518  -1.699   0.822  -0.738
   94    HZ2  TRP 518           2HZ      TRP 518   0.311  -3.725  -1.066
   95    HZ3  TRP 518           3HZ      TRP 518  -1.958  -0.541  -2.771
   96    HH2  TRP 518           HH       TRP 518  -0.968  -2.769  -2.931
   97    H    THR 519           H        THR 519  -1.519   0.671   5.073
   98    HA   THR 519           HA       THR 519  -3.224   2.845   5.435
   99    HB   THR 519           HB       THR 519  -3.887   0.613   6.072
  100    HG1  THR 519           1HG      THR 519  -4.838   1.112   7.990
  101   HG21  THR 519          3HG2      THR 519  -2.888  -0.721   7.628
  102   HG22  THR 519          1HG2      THR 519  -2.156   0.633   8.487
  103   HG23  THR 519          2HG2      THR 519  -1.478   0.095   6.949
  104    H    THR 520           H        THR 520  -0.178   2.105   6.903
  105    HA   THR 520           HA       THR 520  -0.530   4.204   8.908
  106    HB   THR 520           HB       THR 520   1.103   1.782   8.697
  107    HG1  THR 520           1HG      THR 520   0.889   1.915  10.948
  108   HG21  THR 520          3HG2      THR 520   3.051   3.071   8.580
  109   HG22  THR 520          1HG2      THR 520   2.841   2.741  10.301
  110   HG23  THR 520          2HG2      THR 520   2.396   4.316   9.644
  111    H    GLN 521           H        GLN 521   2.185   3.207   6.839
  112    HA   GLN 521           HA       GLN 521   2.960   6.012   6.642
  113    HB2  GLN 521           2HB      GLN 521   5.148   5.233   6.057
  114    HB3  GLN 521           1HB      GLN 521   4.596   4.312   7.446
  115    HG2  GLN 521           2HG      GLN 521   4.587   2.369   6.335
  116    HG3  GLN 521           1HG      GLN 521   4.028   3.097   4.836
  117   HE21  GLN 521          1HE2      GLN 521   5.974   4.970   4.347
  118   HE22  GLN 521          2HE2      GLN 521   7.487   4.190   4.074
  119    H    ASP 522           H        ASP 522   4.465   6.009   4.412
  120    HA   ASP 522           HA       ASP 522   2.449   6.128   2.335
  121    HB2  ASP 522           2HB      ASP 522   4.762   7.585   2.980
  122    HB3  ASP 522           1HB      ASP 522   5.076   6.827   1.425
  123    H    GLU 523           H        GLU 523   3.587   3.520   3.277
  124    HA   GLU 523           HA       GLU 523   4.038   1.488   2.353
  125    HB2  GLU 523           2HB      GLU 523   3.885   2.836  -0.339
  126    HB3  GLU 523           1HB      GLU 523   3.659   1.130   0.017
  127    HG2  GLU 523           2HG      GLU 523   1.568   1.469   0.955
  128    HG3  GLU 523           1HG      GLU 523   1.859   3.188   1.214
  129    H    GLY 524           H        GLY 524   6.023   4.008   2.391
  130    HA2  GLY 524           2HA      GLY 524   8.406   3.321   2.654
  131    HA3  GLY 524           1HA      GLY 524   8.226   2.550   1.085
  132    H    ALA 525           H        ALA 525   6.622   5.580   1.622
  133    HA   ALA 525           HA       ALA 525   8.618   6.836  -0.128
  134    HB1  ALA 525           1HB      ALA 525   6.985   7.820  -1.315
  135    HB2  ALA 525           2HB      ALA 525   6.003   8.145   0.113
  136    HB3  ALA 525           3HB      ALA 525   5.980   6.545  -0.626
  137    H    ALA 526           H        ALA 526   7.959   6.758   3.034
  138    HA   ALA 526           HA       ALA 526   8.104   9.591   3.492
  139    HB1  ALA 526           1HB      ALA 526   7.925   8.936   5.915
  140    HB2  ALA 526           2HB      ALA 526   7.723   7.276   5.358
  141    HB3  ALA 526           3HB      ALA 526   6.545   8.507   4.905
  142    H    ILE 527           H        ILE 527  10.308   7.640   2.533
  143    HA   ILE 527           HA       ILE 527  12.390   8.705   4.309
  144    HB   ILE 527           HB       ILE 527  13.300   6.268   3.130
  145   HG12  ILE 527          2HG1      ILE 527  11.713   4.760   4.453
  146   HG13  ILE 527          1HG1      ILE 527  10.614   6.123   4.499
  147   HG21  ILE 527          1HG2      ILE 527  12.945   7.429   5.835
  148   HG22  ILE 527          2HG2      ILE 527  14.397   6.815   5.044
  149   HG23  ILE 527          3HG2      ILE 527  13.216   5.690   5.717
  150   HD11  ILE 527          3HD1      ILE 527  10.714   4.196   2.566
  151   HD12  ILE 527          1HD1      ILE 527  11.599   5.530   1.830
  152   HD13  ILE 527          2HD1      ILE 527   9.952   5.777   2.409
  153    H    GLY 528           H        GLY 528  11.690   7.355   1.083
  154    HA2  GLY 528           2HA      GLY 528  12.613   9.242  -0.545
  155    HA3  GLY 528           1HA      GLY 528  14.125   8.567   0.032
  156    H    LEU 529           H        LEU 529  12.558   5.889   0.137
  157    HA   LEU 529           HA       LEU 529  12.165   4.091  -1.195
  158    HB2  LEU 529           2HB      LEU 529  11.395   6.292  -2.806
  159    HB3  LEU 529           1HB      LEU 529  12.302   5.192  -3.825
  160    HG   LEU 529           HG       LEU 529   9.699   4.748  -2.425
  161   HD11  LEU 529          1HD1      LEU 529  10.767   4.725  -5.181
  162   HD12  LEU 529          2HD1      LEU 529   9.206   5.273  -4.572
  163   HD13  LEU 529          3HD1      LEU 529   9.507   3.550  -4.802
  164   HD21  LEU 529          3HD2      LEU 529  10.734   2.836  -1.660
  165   HD22  LEU 529          1HD2      LEU 529  11.773   2.708  -3.078
  166   HD23  LEU 529          2HD2      LEU 529  10.060   2.300  -3.202
  167    H    ALA 530           H        ALA 530  14.425   6.285  -2.749
  168    HA   ALA 530           HA       ALA 530  15.990   4.125  -3.768
  169    HB1  ALA 530           1HB      ALA 530  15.841   6.128  -5.075
  170    HB2  ALA 530           2HB      ALA 530  17.515   5.888  -4.577
  171    HB3  ALA 530           3HB      ALA 530  16.513   7.086  -3.756
  172    H    TRP 531           H        TRP 531  15.847   3.798  -1.082
  173    HA   TRP 531           HA       TRP 531  18.577   4.407  -0.164
  174    HB2  TRP 531           2HB      TRP 531  17.568   4.125   2.174
  175    HB3  TRP 531           1HB      TRP 531  17.107   5.581   1.296
  176    HD1  TRP 531           HD       TRP 531  14.720   5.259  -0.139
  177    HE1  TRP 531           1HE      TRP 531  12.542   4.229   0.694
  178    HE3  TRP 531           3HE      TRP 531  16.567   2.588   3.794
  179    HZ2  TRP 531           2HZ      TRP 531  11.684   2.509   2.788
  180    HZ3  TRP 531           3HZ      TRP 531  15.003   1.282   5.174
  181    HH2  TRP 531           HH       TRP 531  12.611   1.246   4.681
  182    H    ILE 532           H        ILE 532  16.243   2.065  -0.960
  183    HA   ILE 532           HA       ILE 532  17.804  -0.077   0.317
  184    HB   ILE 532           HB       ILE 532  15.760  -1.463  -0.060
  185   HG12  ILE 532          2HG1      ILE 532  14.951   0.871  -1.507
  186   HG13  ILE 532          1HG1      ILE 532  14.148  -0.683  -1.387
  187   HG21  ILE 532          1HG2      ILE 532  14.471  -0.417   1.810
  188   HG22  ILE 532          2HG2      ILE 532  15.570   0.958   1.709
  189   HG23  ILE 532          3HG2      ILE 532  16.193  -0.638   2.128
  190   HD11  ILE 532          3HD1      ILE 532  13.744   1.748   0.315
  191   HD12  ILE 532          1HD1      ILE 532  13.133   0.157   0.769
  192   HD13  ILE 532          2HD1      ILE 532  12.578   0.924  -0.718
  193    HA   PRO 533           HA       PRO 533  19.009  -1.658  -3.619
  194    HB2  PRO 533           2HB      PRO 533  18.671  -4.351  -3.333
  195    HB3  PRO 533           1HB      PRO 533  20.005  -3.453  -2.602
  196    HG2  PRO 533           2HG      PRO 533  17.433  -4.363  -1.372
  197    HG3  PRO 533           1HG      PRO 533  19.074  -4.409  -0.700
  198    HD2  PRO 533           2HD      PRO 533  17.296  -2.511  -0.000
  199    HD3  PRO 533           1HD      PRO 533  19.034  -2.173  -0.117
  200    H    TYR 534           H        TYR 534  16.036  -3.246  -2.441
  201    HA   TYR 534           HA       TYR 534  14.645  -2.553  -4.863
  202    HB2  TYR 534           2HB      TYR 534  14.102  -4.996  -5.370
  203    HB3  TYR 534           1HB      TYR 534  15.709  -4.425  -5.807
  204    HD1  TYR 534           1HD      TYR 534  13.807  -6.412  -3.338
  205    HD2  TYR 534           2HD      TYR 534  17.656  -5.372  -4.821
  206    HE1  TYR 534           1HE      TYR 534  14.801  -8.233  -2.018
  207    HE2  TYR 534           2HE      TYR 534  18.661  -7.192  -3.508
  208    HH   TYR 534           HH       TYR 534  17.301  -9.661  -2.442
  209    H    PHE 535           H        PHE 535  14.507  -2.947  -1.644
  210    HA   PHE 535           HA       PHE 535  12.124  -4.403  -1.240
  211    HB2  PHE 535           2HB      PHE 535  12.981  -2.154   0.558
  212    HB3  PHE 535           1HB      PHE 535  12.201  -3.670   0.984
  213    HD1  PHE 535           1HD      PHE 535  14.127  -5.390  -0.748
  214    HD2  PHE 535           2HD      PHE 535  14.726  -2.352   2.171
  215    HE1  PHE 535           1HE      PHE 535  16.324  -6.354  -0.199
  216    HE2  PHE 535           2HE      PHE 535  16.923  -3.307   2.723
  217    HZ   PHE 535           HZ       PHE 535  17.725  -5.310   1.538
  218    H    GLY 536           H        GLY 536  12.739  -1.141  -2.233
  219    HA2  GLY 536           2HA      GLY 536   9.880  -0.493  -1.939
  220    HA3  GLY 536           1HA      GLY 536  11.172   0.689  -2.052
  221    HA   PRO 537           HA       PRO 537  10.939   1.148  -6.429
  222    HB2  PRO 537           2HB      PRO 537  13.443  -0.400  -6.871
  223    HB3  PRO 537           1HB      PRO 537  13.012   1.224  -7.419
  224    HG2  PRO 537           2HG      PRO 537  14.722   0.863  -5.404
  225    HG3  PRO 537           1HG      PRO 537  13.554   2.198  -5.386
  226    HD2  PRO 537           2HD      PRO 537  13.526  -0.374  -3.876
  227    HD3  PRO 537           1HD      PRO 537  12.961   1.235  -3.383
  228    H    ALA 538           H        ALA 538  12.055  -2.081  -5.495
  229    HA   ALA 538           HA       ALA 538  10.659  -3.268  -7.774
  230    HB1  ALA 538           1HB      ALA 538  11.985  -5.115  -7.529
  231    HB2  ALA 538           2HB      ALA 538  12.130  -4.917  -5.782
  232    HB3  ALA 538           3HB      ALA 538  13.052  -3.877  -6.868
  233    H    ALA 539           H        ALA 539   9.913  -2.411  -4.657
  234    HA   ALA 539           HA       ALA 539   8.594  -4.568  -3.537
  235    HB1  ALA 539           1HB      ALA 539   8.946  -1.942  -2.879
  236    HB2  ALA 539           2HB      ALA 539   7.958  -3.091  -1.980
  237    HB3  ALA 539           3HB      ALA 539   7.207  -2.021  -3.164
  238    H    GLU 540           H        GLU 540   7.036  -1.958  -5.399
  239    HA   GLU 540           HA       GLU 540   5.298  -1.947  -6.849
  240    HB2  GLU 540           2HB      GLU 540   5.446  -4.949  -6.712
  241    HB3  GLU 540           1HB      GLU 540   4.573  -4.010  -7.911
  242    HG2  GLU 540           2HG      GLU 540   6.787  -3.001  -8.557
  243    HG3  GLU 540           1HG      GLU 540   7.542  -4.221  -7.533
  244    H    GLY 541           H        GLY 541   4.735  -4.666  -4.597
  245    HA2  GLY 541           2HA      GLY 541   2.000  -3.649  -4.207
  246    HA3  GLY 541           1HA      GLY 541   2.537  -5.281  -3.851
  247    H    ILE 542           H        ILE 542   4.523  -2.646  -2.854
  248    HA   ILE 542           HA       ILE 542   3.393  -2.663  -0.160
  249    HB   ILE 542           HB       ILE 542   6.340  -2.876  -0.288
  250   HG12  ILE 542          2HG1      ILE 542   6.088  -5.422  -0.178
  251   HG13  ILE 542          1HG1      ILE 542   4.486  -5.176  -0.870
  252   HG21  ILE 542          1HG2      ILE 542   4.834  -4.519   1.598
  253   HG22  ILE 542          2HG2      ILE 542   4.470  -2.796   1.702
  254   HG23  ILE 542          3HG2      ILE 542   6.132  -3.360   1.885
  255   HD11  ILE 542          3HD1      ILE 542   5.527  -5.367  -2.833
  256   HD12  ILE 542          1HD1      ILE 542   7.115  -5.060  -2.129
  257   HD13  ILE 542          2HD1      ILE 542   6.058  -3.707  -2.548
  258    H    TYR 543           H        TYR 543   4.721  -0.959  -2.722
  259    HA   TYR 543           HA       TYR 543   5.354   1.292  -1.000
  260    HB2  TYR 543           2HB      TYR 543   7.305   1.627  -2.077
  261    HB3  TYR 543           1HB      TYR 543   7.155  -0.073  -2.464
  262    HD1  TYR 543           1HD      TYR 543   5.861  -0.608  -4.669
  263    HD2  TYR 543           2HD      TYR 543   7.674   3.139  -3.790
  264    HE1  TYR 543           1HE      TYR 543   5.931  -0.078  -7.073
  265    HE2  TYR 543           2HE      TYR 543   7.753   3.680  -6.181
  266    HH   TYR 543           HH       TYR 543   6.087   1.811  -8.543
  267    H    ILE 544           H        ILE 544   4.028   0.184  -4.050
  268    HA   ILE 544           HA       ILE 544   2.857   1.229  -5.721
  269    HB   ILE 544           HB       ILE 544   1.285   2.291  -3.385
  270   HG12  ILE 544          2HG1      ILE 544   0.021   0.085  -3.659
  271   HG13  ILE 544          1HG1      ILE 544   1.439  -0.488  -4.531
  272   HG21  ILE 544          1HG2      ILE 544   0.604   1.578  -6.223
  273   HG22  ILE 544          2HG2      ILE 544   0.440   3.139  -5.420
  274   HG23  ILE 544          3HG2      ILE 544  -0.620   1.802  -4.972
  275   HD11  ILE 544          3HD1      ILE 544   2.213   0.709  -2.040
  276   HD12  ILE 544          1HD1      ILE 544   2.491  -0.926  -2.635
  277   HD13  ILE 544          2HD1      ILE 544   0.999  -0.541  -1.780
  278    H    GLU 545           H        GLU 545   2.504   3.645  -3.174
  279    HA   GLU 545           HA       GLU 545   2.875   5.879  -3.101
  280    HB2  GLU 545           2HB      GLU 545   4.770   5.396  -5.399
  281    HB3  GLU 545           1HB      GLU 545   4.750   6.794  -4.327
  282    HG2  GLU 545           2HG      GLU 545   5.088   5.069  -2.447
  283    HG3  GLU 545           1HG      GLU 545   5.586   3.986  -3.745
  284    H    GLY 546           H        GLY 546   0.913   6.628  -3.650
  285    HA2  GLY 546           2HA      GLY 546   0.342   8.372  -5.511
  286    HA3  GLY 546           1HA      GLY 546   0.240   6.913  -6.484
  287    H    LEU 547           H        LEU 547  -0.757   5.784  -3.634
  288    HA   LEU 547           HA       LEU 547  -3.539   6.695  -4.014
  289    HB2  LEU 547           2HB      LEU 547  -4.377   4.536  -3.938
  290    HB3  LEU 547           1HB      LEU 547  -2.949   4.389  -4.942
  291    HG   LEU 547           HG       LEU 547  -3.033   3.681  -2.011
  292   HD11  LEU 547          1HD1      LEU 547  -4.495   2.219  -3.321
  293   HD12  LEU 547          2HD1      LEU 547  -3.072   1.362  -2.726
  294   HD13  LEU 547          3HD1      LEU 547  -3.155   1.867  -4.414
  295   HD21  LEU 547          3HD2      LEU 547  -0.955   2.332  -3.073
  296   HD22  LEU 547          1HD2      LEU 547  -0.814   3.921  -2.319
  297   HD23  LEU 547          2HD2      LEU 547  -0.933   3.786  -4.073
  298    H    MET 548           H        MET 548  -1.008   6.322  -1.848
  299    HA   MET 548           HA       MET 548  -2.385   5.637   0.521
  300    HB2  MET 548           2HB      MET 548   0.025   7.420   0.569
  301    HB3  MET 548           1HB      MET 548  -0.430   6.143   1.684
  302    HG2  MET 548           2HG      MET 548   0.794   4.667   0.597
  303    HG3  MET 548           1HG      MET 548   0.014   5.052  -0.933
  304    HE1  MET 548           3HE      MET 548   1.236   8.493  -0.755
  305    HE2  MET 548           1HE      MET 548   0.450   7.456  -1.947
  306    HE3  MET 548           2HE      MET 548   2.090   8.037  -2.229
  307    H    HIS 549           H        HIS 549  -4.295   6.979   0.188
  308    HA   HIS 549           HA       HIS 549  -3.917   9.624   1.408
  309    HB2  HIS 549           2HB      HIS 549  -6.060   9.277  -0.645
  310    HB3  HIS 549           1HB      HIS 549  -5.207  10.737  -0.157
  311    HD1  HIS 549           1HD      HIS 549  -5.606   9.044  -3.058
  312    HD2  HIS 549           2HD      HIS 549  -2.177   9.976  -0.908
  313    HE1  HIS 549           1HE      HIS 549  -3.725   8.937  -4.717
  314    HE2  HIS 549           2HE      HIS 549  -1.671   9.601  -3.418
  315    H    ASN 550           H        ASN 550  -4.611   7.157   2.615
  316    HA   ASN 550           HA       ASN 550  -6.048   6.389   4.208
  317    HB2  ASN 550           2HB      ASN 550  -7.741   8.836   3.657
  318    HB3  ASN 550           1HB      ASN 550  -7.784   7.815   5.090
  319   HD21  ASN 550          1HD2      ASN 550  -7.499   9.935   6.132
  320   HD22  ASN 550          2HD2      ASN 550  -5.891  10.520   6.364
  321    H    GLN 551           H        GLN 551  -8.113   8.015   1.806
  322    HA   GLN 551           HA       GLN 551  -9.999   7.307   0.744
  323    HB2  GLN 551           2HB      GLN 551  -8.980   4.750  -0.138
  324    HB3  GLN 551           1HB      GLN 551  -9.321   6.195  -1.063
  325    HG2  GLN 551           2HG      GLN 551  -7.090   5.924  -1.465
  326    HG3  GLN 551           1HG      GLN 551  -7.059   7.033  -0.097
  327   HE21  GLN 551          1HE2      GLN 551  -7.644   3.533  -0.103
  328   HE22  GLN 551          2HE2      GLN 551  -6.272   3.136   0.864
  329    H    ASP 552           H        ASP 552  -8.967   4.043   1.514
  330    HA   ASP 552           HA       ASP 552 -10.010   2.317   2.560
  331    HB2  ASP 552           2HB      ASP 552 -10.230   4.571   4.304
  332    HB3  ASP 552           1HB      ASP 552 -11.730   3.657   4.404
  333    H    GLY 553           H        GLY 553 -11.387   4.006   0.376
  334    HA2  GLY 553           2HA      GLY 553 -14.114   2.959   0.811
  335    HA3  GLY 553           1HA      GLY 553 -13.753   4.391  -0.147
  336    H    LEU 554           H        LEU 554 -11.440   3.291  -1.407
  337    HA   LEU 554           HA       LEU 554 -12.722   1.853  -3.548
  338    HB2  LEU 554           2HB      LEU 554 -10.468   1.976  -4.588
  339    HB3  LEU 554           1HB      LEU 554 -11.120   3.537  -4.122
  340    HG   LEU 554           HG       LEU 554  -9.574   2.543  -1.932
  341   HD11  LEU 554          1HD1      LEU 554  -7.443   2.174  -2.850
  342   HD12  LEU 554          2HD1      LEU 554  -7.947   2.697  -4.456
  343   HD13  LEU 554          3HD1      LEU 554  -8.535   1.169  -3.802
  344   HD21  LEU 554          3HD2      LEU 554 -10.037   4.891  -2.418
  345   HD22  LEU 554          1HD2      LEU 554  -9.074   4.787  -3.892
  346   HD23  LEU 554          2HD2      LEU 554  -8.302   4.593  -2.317
  347    H    ILE 555           H        ILE 555 -11.435   0.922  -0.643
  348    HA   ILE 555           HA       ILE 555 -11.051  -1.802  -1.578
  349    HB   ILE 555           HB       ILE 555  -8.988  -2.064  -0.253
  350   HG12  ILE 555          2HG1      ILE 555  -7.772   0.214   0.129
  351   HG13  ILE 555          1HG1      ILE 555  -9.405   0.874   0.156
  352   HG21  ILE 555          1HG2      ILE 555  -8.321   0.117  -2.126
  353   HG22  ILE 555          2HG2      ILE 555  -9.230  -1.245  -2.782
  354   HG23  ILE 555          3HG2      ILE 555  -7.669  -1.518  -2.010
  355   HD11  ILE 555          3HD1      ILE 555  -9.775  -1.083   1.872
  356   HD12  ILE 555          1HD1      ILE 555  -9.111   0.472   2.362
  357   HD13  ILE 555          2HD1      ILE 555  -8.040  -0.899   2.089
  358    H    CYS 556           H        CYS 556 -11.632   0.456   1.019
  359    HA   CYS 556           HA       CYS 556 -12.575  -1.788   2.666
  360    HB2  CYS 556           2HB      CYS 556 -10.636   0.086   3.324
  361    HB3  CYS 556           1HB      CYS 556 -12.077   0.692   4.126
  362    H    GLY 557           H        GLY 557 -14.346  -0.889   0.839
  363    HA2  GLY 557           2HA      GLY 557 -16.667  -0.412   2.080
  364    HA3  GLY 557           1HA      GLY 557 -15.981   1.203   2.035
  365    H    LEU 558           H        LEU 558 -15.873  -1.373  -0.415
  366    HA   LEU 558           HA       LEU 558 -17.384   0.416  -2.206
  367    HB2  LEU 558           2HB      LEU 558 -16.058  -0.327  -4.074
  368    HB3  LEU 558           1HB      LEU 558 -15.005   0.314  -2.830
  369    HG   LEU 558           HG       LEU 558 -15.493  -2.640  -3.099
  370   HD11  LEU 558          1HD1      LEU 558 -13.751  -2.886  -4.608
  371   HD12  LEU 558          2HD1      LEU 558 -13.130  -1.261  -4.310
  372   HD13  LEU 558          3HD1      LEU 558 -14.619  -1.482  -5.230
  373   HD21  LEU 558          3HD2      LEU 558 -14.084  -2.798  -1.392
  374   HD22  LEU 558          1HD2      LEU 558 -14.114  -1.042  -1.248
  375   HD23  LEU 558          2HD2      LEU 558 -12.883  -1.824  -2.236
  376    H    ARG 559           H        ARG 559 -16.577  -2.905  -1.363
  377    HA   ARG 559           HA       ARG 559 -19.178  -3.875  -1.658
  378    HB2  ARG 559           2HB      ARG 559 -19.014  -5.201  -3.688
  379    HB3  ARG 559           1HB      ARG 559 -18.733  -3.508  -4.075
  380    HG2  ARG 559           2HG      ARG 559 -16.270  -4.875  -3.431
  381    HG3  ARG 559           1HG      ARG 559 -17.129  -5.661  -4.760
  382    HD2  ARG 559           2HD      ARG 559 -16.797  -2.692  -4.751
  383    HD3  ARG 559           1HD      ARG 559 -15.450  -3.719  -5.240
  384    HE   ARG 559           HE       ARG 559 -17.811  -3.151  -6.742
  385   HH11  ARG 559          1HH1      ARG 559 -15.362  -5.569  -6.165
  386   HH12  ARG 559          2HH1      ARG 559 -15.539  -6.300  -7.725
  387   HH21  ARG 559          1HH2      ARG 559 -18.044  -4.111  -8.794
  388   HH22  ARG 559          2HH2      ARG 559 -17.060  -5.471  -9.219
  389    H    GLN 560           H        GLN 560 -17.000  -4.003   0.100
  390    HA   GLN 560           HA       GLN 560 -16.367  -6.869   0.098
  391    HB2  GLN 560           2HB      GLN 560 -14.438  -6.104   1.607
  392    HB3  GLN 560           1HB      GLN 560 -14.327  -5.752  -0.110
  393    HG2  GLN 560           2HG      GLN 560 -13.608  -3.880   1.330
  394    HG3  GLN 560           1HG      GLN 560 -14.931  -3.470   0.242
  395   HE21  GLN 560          1HE2      GLN 560 -16.582  -2.441   1.092
  396   HE22  GLN 560          2HE2      GLN 560 -17.002  -2.397   2.767
  Start of MODEL   17
    1    H1   ALA 507           1HT      ALA 507 -11.470 -11.774  -4.236
    2    H2   ALA 507           2HT      ALA 507 -11.344 -10.308  -5.119
    3    H3   ALA 507           3HT      ALA 507 -11.150 -11.813  -5.919
    4    HA   ALA 507           HA       ALA 507 -13.262 -10.946  -6.416
    5    HB1  ALA 507           1HB      ALA 507 -13.267 -13.269  -4.501
    6    HB2  ALA 507           2HB      ALA 507 -13.192 -13.316  -6.262
    7    HB3  ALA 507           3HB      ALA 507 -14.671 -12.792  -5.456
    8    H    GLN 508           H        GLN 508 -12.953 -11.442  -2.900
    9    HA   GLN 508           HA       GLN 508 -14.575  -9.058  -2.458
   10    HB2  GLN 508           2HB      GLN 508 -15.250 -11.805  -1.406
   11    HB3  GLN 508           1HB      GLN 508 -15.870 -10.333  -0.674
   12    HG2  GLN 508           2HG      GLN 508 -16.272 -10.511  -3.568
   13    HG3  GLN 508           1HG      GLN 508 -17.108 -11.746  -2.629
   14   HE21  GLN 508          1HE2      GLN 508 -16.364  -8.354  -1.938
   15   HE22  GLN 508          2HE2      GLN 508 -18.002  -7.865  -1.680
   16    HA   PRO 509           HA       PRO 509 -11.071  -9.841   0.594
   17    HB2  PRO 509           2HB      PRO 509  -9.109  -8.337  -0.404
   18    HB3  PRO 509           1HB      PRO 509  -9.410  -9.964  -1.022
   19    HG2  PRO 509           2HG      PRO 509 -10.211  -7.321  -2.178
   20    HG3  PRO 509           1HG      PRO 509  -9.543  -8.744  -2.998
   21    HD2  PRO 509           2HD      PRO 509 -12.220  -8.119  -2.927
   22    HD3  PRO 509           1HD      PRO 509 -11.583  -9.759  -3.152
   23    H    LYS 510           H        LYS 510 -12.066  -8.695   2.210
   24    HA   LYS 510           HA       LYS 510 -12.774  -5.970   2.086
   25    HB2  LYS 510           2HB      LYS 510 -12.909  -6.148   4.586
   26    HB3  LYS 510           1HB      LYS 510 -13.833  -7.365   3.715
   27    HG2  LYS 510           2HG      LYS 510 -11.370  -8.559   4.087
   28    HG3  LYS 510           1HG      LYS 510 -11.648  -7.680   5.591
   29    HD2  LYS 510           2HD      LYS 510 -12.703  -9.652   6.082
   30    HD3  LYS 510           1HD      LYS 510 -14.048  -8.754   5.375
   31    HE2  LYS 510           2HE      LYS 510 -14.165 -10.100   3.578
   32    HE3  LYS 510           1HE      LYS 510 -12.411 -10.227   3.437
   33    HZ1  LYS 510           3HZ      LYS 510 -13.974 -12.237   4.196
   34    HZ2  LYS 510           1HZ      LYS 510 -13.600 -11.585   5.712
   35    HZ3  LYS 510           2HZ      LYS 510 -12.360 -12.087   4.679
   36    H    CYS 511           H        CYS 511 -11.398  -4.341   1.837
   37    HA   CYS 511           HA       CYS 511  -9.618  -2.953   2.115
   38    HB2  CYS 511           2HB      CYS 511  -8.698  -4.416   4.554
   39    HB3  CYS 511           1HB      CYS 511  -8.757  -2.684   4.244
   40    H    ASN 512           H        ASN 512  -8.144  -3.260   0.589
   41    HA   ASN 512           HA       ASN 512  -6.528  -5.678   0.604
   42    HB2  ASN 512           2HB      ASN 512  -6.661  -3.583  -1.558
   43    HB3  ASN 512           1HB      ASN 512  -5.948  -5.186  -1.675
   44   HD21  ASN 512          1HD2      ASN 512  -9.019  -3.545  -1.024
   45   HD22  ASN 512          2HD2      ASN 512 -10.013  -4.753  -1.750
   46    HA   PRO 513           HA       PRO 513  -3.135  -2.430   0.905
   47    HB2  PRO 513           2HB      PRO 513  -3.799   0.191   0.430
   48    HB3  PRO 513           1HB      PRO 513  -3.389  -0.979  -0.827
   49    HG2  PRO 513           2HG      PRO 513  -5.924   0.272  -0.373
   50    HG3  PRO 513           1HG      PRO 513  -5.515  -0.942  -1.595
   51    HD2  PRO 513           2HD      PRO 513  -6.782  -1.296   1.068
   52    HD3  PRO 513           1HD      PRO 513  -6.972  -2.247  -0.419
   53    H    ASN 514           H        ASN 514  -5.935  -2.018   2.720
   54    HA   ASN 514           HA       ASN 514  -4.595  -0.239   4.637
   55    HB2  ASN 514           2HB      ASN 514  -7.458  -0.762   3.962
   56    HB3  ASN 514           1HB      ASN 514  -7.070  -0.355   5.631
   57   HD21  ASN 514          1HD2      ASN 514  -7.430   0.807   2.425
   58   HD22  ASN 514          2HD2      ASN 514  -7.089   2.467   2.751
   59    H    LEU 515           H        LEU 515  -3.322  -2.318   4.943
   60    HA   LEU 515           HA       LEU 515  -4.615  -3.851   7.077
   61    HB2  LEU 515           2HB      LEU 515  -2.780  -5.589   5.823
   62    HB3  LEU 515           1HB      LEU 515  -4.517  -5.742   5.957
   63    HG   LEU 515           HG       LEU 515  -3.749  -6.027   3.670
   64   HD11  LEU 515          1HD1      LEU 515  -5.092  -3.596   3.115
   65   HD12  LEU 515          2HD1      LEU 515  -5.800  -4.314   4.556
   66   HD13  LEU 515          3HD1      LEU 515  -5.709  -5.240   3.060
   67   HD21  LEU 515          3HD2      LEU 515  -3.149  -3.472   2.782
   68   HD22  LEU 515          1HD2      LEU 515  -2.030  -4.821   2.959
   69   HD23  LEU 515          2HD2      LEU 515  -2.214  -3.655   4.264
   70    H    HIS 516           H        HIS 516  -1.578  -2.545   5.798
   71    HA   HIS 516           HA       HIS 516  -0.472  -2.449   8.419
   72    HB2  HIS 516           2HB      HIS 516   1.476  -4.101   7.590
   73    HB3  HIS 516           1HB      HIS 516   0.065  -4.661   8.485
   74    HD1  HIS 516           1HD      HIS 516   0.214  -7.012   7.341
   75    HD2  HIS 516           2HD      HIS 516  -0.363  -3.849   4.715
   76    HE1  HIS 516           1HE      HIS 516  -0.452  -8.054   5.146
   77    HE2  HIS 516           2HE      HIS 516  -0.684  -6.132   3.556
   78    H    TYR 517           H        TYR 517   1.297  -3.240   5.456
   79    HA   TYR 517           HA       TYR 517   3.161  -1.181   5.796
   80    HB2  TYR 517           2HB      TYR 517   2.768  -2.361   3.107
   81    HB3  TYR 517           1HB      TYR 517   4.258  -1.988   3.961
   82    HD1  TYR 517           2HD      TYR 517   1.497  -4.401   3.666
   83    HD2  TYR 517           1HD      TYR 517   5.334  -3.624   5.323
   84    HE1  TYR 517           2HE      TYR 517   1.726  -6.784   4.242
   85    HE2  TYR 517           1HE      TYR 517   5.572  -6.001   5.914
   86    HH   TYR 517           HH       TYR 517   4.571  -8.229   5.015
   87    H    TRP 518           H        TRP 518   0.150  -0.513   5.162
   88    HA   TRP 518           HA       TRP 518   0.850   1.755   3.466
   89    HB2  TRP 518           2HB      TRP 518  -1.835   0.707   2.933
   90    HB3  TRP 518           1HB      TRP 518  -0.633   1.301   1.820
   91    HD1  TRP 518           HD       TRP 518  -0.014  -1.830   3.963
   92    HE1  TRP 518           1HE      TRP 518   0.209  -3.806   2.392
   93    HE3  TRP 518           3HE      TRP 518  -1.302   0.452  -0.424
   94    HZ2  TRP 518           2HZ      TRP 518  -0.148  -4.393  -0.348
   95    HZ3  TRP 518           3HZ      TRP 518  -1.351  -0.902  -2.478
   96    HH2  TRP 518           HH       TRP 518  -0.784  -3.274  -2.440
   97    H    THR 519           H        THR 519  -1.405   0.192   5.628
   98    HA   THR 519           HA       THR 519  -2.859   2.625   6.177
   99    HB   THR 519           HB       THR 519  -4.180   0.709   6.406
  100    HG1  THR 519           1HG      THR 519  -4.528   2.068   8.160
  101   HG21  THR 519          3HG2      THR 519  -1.927  -0.480   7.982
  102   HG22  THR 519          1HG2      THR 519  -2.681  -1.076   6.505
  103   HG23  THR 519          2HG2      THR 519  -3.568  -1.129   8.027
  104    H    THR 520           H        THR 520   0.086   1.342   7.264
  105    HA   THR 520           HA       THR 520  -0.082   2.734   9.826
  106    HB   THR 520           HB       THR 520   1.064   0.337   9.176
  107    HG1  THR 520           1HG      THR 520   1.885   0.435  11.255
  108   HG21  THR 520          3HG2      THR 520   3.502   0.635   9.664
  109   HG22  THR 520          1HG2      THR 520   3.304   2.346   9.282
  110   HG23  THR 520          2HG2      THR 520   2.996   1.123   8.048
  111    H    GLN 521           H        GLN 521   2.254   2.561   7.121
  112    HA   GLN 521           HA       GLN 521   3.110   5.268   7.823
  113    HB2  GLN 521           2HB      GLN 521   5.147   4.843   6.701
  114    HB3  GLN 521           1HB      GLN 521   4.796   3.401   7.640
  115    HG2  GLN 521           2HG      GLN 521   4.265   2.152   5.749
  116    HG3  GLN 521           1HG      GLN 521   4.035   3.585   4.755
  117   HE21  GLN 521          1HE2      GLN 521   6.000   4.923   4.373
  118   HE22  GLN 521          2HE2      GLN 521   7.500   4.092   4.161
  119    H    ASP 522           H        ASP 522   4.261   5.825   5.265
  120    HA   ASP 522           HA       ASP 522   1.820   6.568   3.828
  121    HB2  ASP 522           2HB      ASP 522   4.499   7.784   4.154
  122    HB3  ASP 522           1HB      ASP 522   3.636   8.092   2.653
  123    H    GLU 523           H        GLU 523   2.942   3.956   3.539
  124    HA   GLU 523           HA       GLU 523   3.657   2.440   1.971
  125    HB2  GLU 523           2HB      GLU 523   1.938   4.387   0.523
  126    HB3  GLU 523           1HB      GLU 523   2.815   3.195  -0.425
  127    HG2  GLU 523           2HG      GLU 523   1.815   1.414   0.898
  128    HG3  GLU 523           1HG      GLU 523   0.925   2.616   1.825
  129    H    GLY 524           H        GLY 524   5.840   3.242   2.492
  130    HA2  GLY 524           2HA      GLY 524   7.949   3.386   1.447
  131    HA3  GLY 524           1HA      GLY 524   7.166   4.067   0.027
  132    H    ALA 525           H        ALA 525   5.607   5.837   1.983
  133    HA   ALA 525           HA       ALA 525   5.751   7.991   2.645
  134    HB1  ALA 525           1HB      ALA 525   7.012   8.265   4.476
  135    HB2  ALA 525           2HB      ALA 525   8.493   7.813   3.630
  136    HB3  ALA 525           3HB      ALA 525   7.404   6.562   4.231
  137    H    ALA 526           H        ALA 526   7.252   7.086   0.024
  138    HA   ALA 526           HA       ALA 526   8.547   8.049  -1.575
  139    HB1  ALA 526           1HB      ALA 526   6.431   9.610  -1.144
  140    HB2  ALA 526           2HB      ALA 526   7.672  10.004  -2.334
  141    HB3  ALA 526           3HB      ALA 526   7.705  10.761  -0.741
  142    H    ILE 527           H        ILE 527   9.520   7.962   1.343
  143    HA   ILE 527           HA       ILE 527  11.177  10.096   1.916
  144    HB   ILE 527           HB       ILE 527  12.662   8.142   2.942
  145   HG12  ILE 527          2HG1      ILE 527  11.421   6.177   3.505
  146   HG13  ILE 527          1HG1      ILE 527   9.948   6.834   2.807
  147   HG21  ILE 527          1HG2      ILE 527  11.200   8.240   4.943
  148   HG22  ILE 527          2HG2      ILE 527  10.001   9.085   3.965
  149   HG23  ILE 527          3HG2      ILE 527  11.580   9.817   4.252
  150   HD11  ILE 527          3HD1      ILE 527  10.644   6.430   0.645
  151   HD12  ILE 527          1HD1      ILE 527  11.295   5.046   1.521
  152   HD13  ILE 527          2HD1      ILE 527  12.350   6.393   1.092
  153    H    GLY 528           H        GLY 528  11.538   7.680  -0.526
  154    HA2  GLY 528           2HA      GLY 528  13.433   8.940  -2.015
  155    HA3  GLY 528           1HA      GLY 528  14.382   8.044  -0.841
  156    H    LEU 529           H        LEU 529  13.195   5.674  -0.619
  157    HA   LEU 529           HA       LEU 529  12.785   3.649  -1.579
  158    HB2  LEU 529           2HB      LEU 529  12.313   5.307  -4.038
  159    HB3  LEU 529           1HB      LEU 529  12.175   3.565  -4.023
  160    HG   LEU 529           HG       LEU 529  10.292   3.626  -2.577
  161   HD11  LEU 529          1HD1      LEU 529   9.419   5.763  -1.666
  162   HD12  LEU 529          2HD1      LEU 529  10.887   6.560  -2.237
  163   HD13  LEU 529          3HD1      LEU 529  10.988   5.302  -1.005
  164   HD21  LEU 529          3HD2      LEU 529   8.954   5.589  -3.864
  165   HD22  LEU 529          1HD2      LEU 529   9.285   4.000  -4.554
  166   HD23  LEU 529          2HD2      LEU 529  10.328   5.367  -4.946
  167    H    ALA 530           H        ALA 530  15.172   5.778  -2.754
  168    HA   ALA 530           HA       ALA 530  16.549   3.792  -4.292
  169    HB1  ALA 530           1HB      ALA 530  16.831   6.033  -5.023
  170    HB2  ALA 530           2HB      ALA 530  18.385   5.520  -4.365
  171    HB3  ALA 530           3HB      ALA 530  17.328   6.564  -3.415
  172    H    TRP 531           H        TRP 531  16.484   4.817  -1.037
  173    HA   TRP 531           HA       TRP 531  19.014   3.998  -0.132
  174    HB2  TRP 531           2HB      TRP 531  17.933   3.993   2.108
  175    HB3  TRP 531           1HB      TRP 531  17.560   5.450   1.193
  176    HD1  TRP 531           HD       TRP 531  15.103   5.168  -0.258
  177    HE1  TRP 531           1HE      TRP 531  12.893   4.331   0.681
  178    HE3  TRP 531           3HE      TRP 531  16.861   2.667   3.837
  179    HZ2  TRP 531           2HZ      TRP 531  11.967   2.819   2.888
  180    HZ3  TRP 531           3HZ      TRP 531  15.241   1.556   5.319
  181    HH2  TRP 531           HH       TRP 531  12.844   1.632   4.853
  182    H    ILE 532           H        ILE 532  16.346   2.215  -1.234
  183    HA   ILE 532           HA       ILE 532  17.413  -0.234  -0.034
  184    HB   ILE 532           HB       ILE 532  15.033  -1.076  -0.213
  185   HG12  ILE 532          2HG1      ILE 532  14.633   1.847  -0.784
  186   HG13  ILE 532          1HG1      ILE 532  13.909   0.462  -1.585
  187   HG21  ILE 532          1HG2      ILE 532  14.408   0.009   1.932
  188   HG22  ILE 532          2HG2      ILE 532  15.735   1.148   1.689
  189   HG23  ILE 532          3HG2      ILE 532  16.075  -0.571   1.901
  190   HD11  ILE 532          3HD1      ILE 532  13.075   0.467   1.135
  191   HD12  ILE 532          1HD1      ILE 532  12.109   0.678  -0.325
  192   HD13  ILE 532          2HD1      ILE 532  12.836   2.079   0.459
  193    HA   PRO 533           HA       PRO 533  17.679  -1.504  -4.279
  194    HB2  PRO 533           2HB      PRO 533  18.642  -3.958  -3.921
  195    HB3  PRO 533           1HB      PRO 533  19.585  -2.535  -3.464
  196    HG2  PRO 533           2HG      PRO 533  18.012  -4.400  -1.741
  197    HG3  PRO 533           1HG      PRO 533  19.586  -3.648  -1.431
  198    HD2  PRO 533           2HD      PRO 533  17.145  -2.739  -0.452
  199    HD3  PRO 533           1HD      PRO 533  18.630  -1.776  -0.559
  200    H    TYR 534           H        TYR 534  15.621  -3.206  -2.010
  201    HA   TYR 534           HA       TYR 534  13.989  -4.091  -4.257
  202    HB2  TYR 534           2HB      TYR 534  13.838  -6.400  -3.410
  203    HB3  TYR 534           1HB      TYR 534  15.473  -5.974  -3.905
  204    HD1  TYR 534           1HD      TYR 534  13.311  -6.086  -0.867
  205    HD2  TYR 534           2HD      TYR 534  17.238  -6.421  -2.468
  206    HE1  TYR 534           1HE      TYR 534  14.147  -6.772   1.342
  207    HE2  TYR 534           2HE      TYR 534  18.085  -7.108  -0.264
  208    HH   TYR 534           HH       TYR 534  17.495  -6.963   2.063
  209    H    PHE 535           H        PHE 535  14.005  -2.518  -1.433
  210    HA   PHE 535           HA       PHE 535  11.615  -3.693  -0.280
  211    HB2  PHE 535           2HB      PHE 535  13.207  -1.243   0.464
  212    HB3  PHE 535           1HB      PHE 535  11.803  -1.806   1.354
  213    HD1  PHE 535           2HD      PHE 535  15.111  -3.003   0.137
  214    HD2  PHE 535           1HD      PHE 535  12.130  -3.169   3.166
  215    HE1  PHE 535           2HE      PHE 535  16.580  -4.422   1.497
  216    HE2  PHE 535           1HE      PHE 535  13.596  -4.588   4.535
  217    HZ   PHE 535           HZ       PHE 535  15.826  -5.222   3.702
  218    H    GLY 536           H        GLY 536  12.555  -0.819  -2.076
  219    HA2  GLY 536           2HA      GLY 536   9.707  -0.069  -2.276
  220    HA3  GLY 536           1HA      GLY 536  11.037   1.074  -2.372
  221    HA   PRO 537           HA       PRO 537  11.545   0.788  -6.743
  222    HB2  PRO 537           2HB      PRO 537  13.954  -0.951  -6.522
  223    HB3  PRO 537           1HB      PRO 537  13.745   0.575  -7.385
  224    HG2  PRO 537           2HG      PRO 537  15.096   0.481  -5.090
  225    HG3  PRO 537           1HG      PRO 537  14.037   1.852  -5.471
  226    HD2  PRO 537           2HD      PRO 537  13.591  -0.434  -3.610
  227    HD3  PRO 537           1HD      PRO 537  13.086   1.260  -3.457
  228    H    ALA 538           H        ALA 538  12.264  -2.293  -5.152
  229    HA   ALA 538           HA       ALA 538  11.265  -3.832  -7.395
  230    HB1  ALA 538           1HB      ALA 538  12.148  -4.753  -4.660
  231    HB2  ALA 538           2HB      ALA 538  13.183  -4.636  -6.085
  232    HB3  ALA 538           3HB      ALA 538  11.842  -5.782  -6.062
  233    H    ALA 539           H        ALA 539  10.147  -2.639  -4.333
  234    HA   ALA 539           HA       ALA 539   8.011  -4.355  -3.825
  235    HB1  ALA 539           1HB      ALA 539   8.830  -1.678  -2.976
  236    HB2  ALA 539           2HB      ALA 539   8.197  -3.027  -2.034
  237    HB3  ALA 539           3HB      ALA 539   7.091  -1.963  -2.903
  238    H    GLU 540           H        GLU 540   5.735  -3.968  -4.068
  239    HA   GLU 540           HA       GLU 540   4.851  -2.196  -6.184
  240    HB2  GLU 540           2HB      GLU 540   4.361  -5.171  -6.410
  241    HB3  GLU 540           1HB      GLU 540   3.850  -3.928  -7.543
  242    HG2  GLU 540           2HG      GLU 540   6.346  -3.424  -7.815
  243    HG3  GLU 540           1HG      GLU 540   6.603  -4.982  -7.032
  244    H    GLY 541           H        GLY 541   4.169  -4.580  -3.721
  245    HA2  GLY 541           2HA      GLY 541   1.455  -3.455  -3.414
  246    HA3  GLY 541           1HA      GLY 541   1.880  -5.114  -3.007
  247    H    ILE 542           H        ILE 542   3.852  -2.307  -2.323
  248    HA   ILE 542           HA       ILE 542   3.078  -2.281   0.482
  249    HB   ILE 542           HB       ILE 542   6.005  -2.501  -0.094
  250   HG12  ILE 542          2HG1      ILE 542   5.718  -4.989   0.531
  251   HG13  ILE 542          1HG1      ILE 542   4.044  -4.777   0.022
  252   HG21  ILE 542          1HG2      ILE 542   4.871  -1.840   2.134
  253   HG22  ILE 542          2HG2      ILE 542   6.213  -2.984   2.155
  254   HG23  ILE 542          3HG2      ILE 542   4.555  -3.568   2.288
  255   HD11  ILE 542          3HD1      ILE 542   6.448  -5.079  -1.564
  256   HD12  ILE 542          1HD1      ILE 542   5.500  -3.669  -2.042
  257   HD13  ILE 542          2HD1      ILE 542   4.757  -5.272  -2.022
  258    H    TYR 543           H        TYR 543   4.963  -1.015  -2.190
  259    HA   TYR 543           HA       TYR 543   5.305   1.495  -0.786
  260    HB2  TYR 543           2HB      TYR 543   7.258   1.691  -1.885
  261    HB3  TYR 543           1HB      TYR 543   7.087  -0.034  -2.098
  262    HD1  TYR 543           1HD      TYR 543   5.835  -0.775  -4.268
  263    HD2  TYR 543           2HD      TYR 543   7.668   3.021  -3.732
  264    HE1  TYR 543           1HE      TYR 543   5.972  -0.509  -6.700
  265    HE2  TYR 543           2HE      TYR 543   7.811   3.305  -6.165
  266    HH   TYR 543           HH       TYR 543   7.812   1.993  -8.180
  267    H    ILE 544           H        ILE 544   4.129   0.159  -3.837
  268    HA   ILE 544           HA       ILE 544   2.907   1.014  -5.556
  269    HB   ILE 544           HB       ILE 544   1.285   2.241  -3.345
  270   HG12  ILE 544          2HG1      ILE 544   0.084   0.053  -3.285
  271   HG13  ILE 544          1HG1      ILE 544   1.360  -0.629  -4.286
  272   HG21  ILE 544          1HG2      ILE 544   0.700   1.287  -6.128
  273   HG22  ILE 544          2HG2      ILE 544   0.406   2.875  -5.425
  274   HG23  ILE 544          3HG2      ILE 544  -0.575   1.497  -4.929
  275   HD11  ILE 544          3HD1      ILE 544   2.822  -0.732  -2.573
  276   HD12  ILE 544          1HD1      ILE 544   1.333  -0.820  -1.636
  277   HD13  ILE 544          2HD1      ILE 544   2.191   0.712  -1.789
  278    H    GLU 545           H        GLU 545   2.518   3.640  -3.220
  279    HA   GLU 545           HA       GLU 545   2.916   5.873  -3.318
  280    HB2  GLU 545           2HB      GLU 545   4.518   5.615  -5.817
  281    HB3  GLU 545           1HB      GLU 545   4.780   6.653  -4.423
  282    HG2  GLU 545           2HG      GLU 545   4.996   3.916  -3.636
  283    HG3  GLU 545           1HG      GLU 545   6.021   4.221  -5.032
  284    H    GLY 546           H        GLY 546   0.724   4.585  -4.739
  285    HA2  GLY 546           2HA      GLY 546   0.103   6.810  -6.555
  286    HA3  GLY 546           1HA      GLY 546  -0.130   5.161  -7.113
  287    H    LEU 547           H        LEU 547  -0.850   4.914  -3.958
  288    HA   LEU 547           HA       LEU 547  -3.603   5.916  -4.231
  289    HB2  LEU 547           2HB      LEU 547  -4.625   3.897  -3.852
  290    HB3  LEU 547           1HB      LEU 547  -3.276   3.432  -4.869
  291    HG   LEU 547           HG       LEU 547  -3.388   3.149  -1.865
  292   HD11  LEU 547          1HD1      LEU 547  -3.437   1.014  -3.991
  293   HD12  LEU 547          2HD1      LEU 547  -4.863   1.604  -3.141
  294   HD13  LEU 547          3HD1      LEU 547  -3.578   0.791  -2.248
  295   HD21  LEU 547          3HD2      LEU 547  -1.160   3.193  -2.061
  296   HD22  LEU 547          1HD2      LEU 547  -1.211   2.992  -3.811
  297   HD23  LEU 547          2HD2      LEU 547  -1.342   1.584  -2.760
  298    H    MET 548           H        MET 548  -0.890   5.640  -2.333
  299    HA   MET 548           HA       MET 548  -2.090   5.381   0.224
  300    HB2  MET 548           2HB      MET 548   0.216   6.455   0.924
  301    HB3  MET 548           1HB      MET 548   0.109   4.792   0.373
  302    HG2  MET 548           2HG      MET 548   2.009   5.913  -0.618
  303    HG3  MET 548           1HG      MET 548   0.838   5.475  -1.856
  304    HE1  MET 548           3HE      MET 548   1.462   7.913  -3.889
  305    HE2  MET 548           1HE      MET 548  -0.235   8.262  -3.562
  306    HE3  MET 548           2HE      MET 548   0.353   6.601  -3.493
  307    H    HIS 549           H        HIS 549  -3.773   7.068  -0.524
  308    HA   HIS 549           HA       HIS 549  -2.889   9.711   0.435
  309    HB2  HIS 549           2HB      HIS 549  -5.365   9.615  -1.165
  310    HB3  HIS 549           1HB      HIS 549  -4.050  10.782  -1.193
  311    HD1  HIS 549           1HD      HIS 549  -5.599   8.957  -3.540
  312    HD2  HIS 549           2HD      HIS 549  -1.641   8.898  -2.282
  313    HE1  HIS 549           1HE      HIS 549  -4.302   7.986  -5.458
  314    HE2  HIS 549           2HE      HIS 549  -1.893   8.084  -4.724
  315    H    ASN 550           H        ASN 550  -3.947   7.357   1.912
  316    HA   ASN 550           HA       ASN 550  -5.381   6.907   3.618
  317    HB2  ASN 550           2HB      ASN 550  -5.728   9.908   3.524
  318    HB3  ASN 550           1HB      ASN 550  -6.379   8.879   4.796
  319   HD21  ASN 550          1HD2      ASN 550  -4.457  11.035   4.996
  320   HD22  ASN 550          2HD2      ASN 550  -3.026  10.351   5.680
  321    H    GLN 551           H        GLN 551  -6.719   5.745   2.116
  322    HA   GLN 551           HA       GLN 551  -9.204   7.134   1.404
  323    HB2  GLN 551           2HB      GLN 551  -8.995   4.529   0.188
  324    HB3  GLN 551           1HB      GLN 551  -9.183   6.098  -0.573
  325    HG2  GLN 551           2HG      GLN 551  -7.170   5.806  -1.442
  326    HG3  GLN 551           1HG      GLN 551  -6.509   6.026   0.175
  327   HE21  GLN 551          1HE2      GLN 551  -6.584   3.964   1.533
  328   HE22  GLN 551          2HE2      GLN 551  -6.090   2.513   0.742
  329    H    ASP 552           H        ASP 552  -8.495   3.724   1.864
  330    HA   ASP 552           HA       ASP 552  -9.449   2.103   3.140
  331    HB2  ASP 552           2HB      ASP 552  -8.746   3.739   4.967
  332    HB3  ASP 552           1HB      ASP 552 -10.420   4.287   4.984
  333    H    GLY 553           H        GLY 553 -11.051   3.902   1.186
  334    HA2  GLY 553           2HA      GLY 553 -13.711   2.925   2.025
  335    HA3  GLY 553           1HA      GLY 553 -13.481   4.451   1.182
  336    H    LEU 554           H        LEU 554 -11.447   3.425  -0.590
  337    HA   LEU 554           HA       LEU 554 -13.181   2.179  -2.558
  338    HB2  LEU 554           2HB      LEU 554 -11.272   2.567  -4.081
  339    HB3  LEU 554           1HB      LEU 554 -11.839   4.026  -3.292
  340    HG   LEU 554           HG       LEU 554  -9.836   3.182  -1.598
  341   HD11  LEU 554          1HD1      LEU 554  -9.354   1.524  -3.557
  342   HD12  LEU 554          2HD1      LEU 554  -8.031   2.356  -2.739
  343   HD13  LEU 554          3HD1      LEU 554  -8.609   2.939  -4.300
  344   HD21  LEU 554          3HD2      LEU 554  -9.764   5.116  -3.906
  345   HD22  LEU 554          1HD2      LEU 554  -8.510   5.006  -2.670
  346   HD23  LEU 554          2HD2      LEU 554 -10.153   5.463  -2.221
  347    H    ILE 555           H        ILE 555 -11.501   0.967  -0.113
  348    HA   ILE 555           HA       ILE 555 -10.984  -1.559  -1.468
  349    HB   ILE 555           HB       ILE 555  -8.819  -1.796  -0.268
  350   HG12  ILE 555          2HG1      ILE 555  -9.183  -0.077   1.460
  351   HG13  ILE 555          1HG1      ILE 555  -7.688   0.186   0.587
  352   HG21  ILE 555          1HG2      ILE 555  -9.310  -0.667  -2.678
  353   HG22  ILE 555          2HG2      ILE 555  -7.708  -1.080  -2.067
  354   HG23  ILE 555          3HG2      ILE 555  -8.315   0.571  -1.909
  355   HD11  ILE 555          3HD1      ILE 555 -10.047   1.869   0.788
  356   HD12  ILE 555          1HD1      ILE 555  -9.411   1.697  -0.846
  357   HD13  ILE 555          2HD1      ILE 555  -8.370   2.288   0.445
  358    H    CYS 556           H        CYS 556 -11.086   0.259   1.554
  359    HA   CYS 556           HA       CYS 556 -11.832  -2.192   2.977
  360    HB2  CYS 556           2HB      CYS 556  -9.822  -0.736   3.685
  361    HB3  CYS 556           1HB      CYS 556 -11.026   0.405   4.269
  362    H    GLY 557           H        GLY 557 -13.867  -1.210   1.484
  363    HA2  GLY 557           2HA      GLY 557 -16.070  -1.094   2.921
  364    HA3  GLY 557           1HA      GLY 557 -15.466   0.525   3.218
  365    H    LEU 558           H        LEU 558 -15.342  -1.316   0.181
  366    HA   LEU 558           HA       LEU 558 -16.991   0.808  -1.024
  367    HB2  LEU 558           2HB      LEU 558 -15.918   0.350  -3.134
  368    HB3  LEU 558           1HB      LEU 558 -14.700   0.664  -1.917
  369    HG   LEU 558           HG       LEU 558 -15.447  -2.161  -2.574
  370   HD11  LEU 558          1HD1      LEU 558 -14.097  -2.273  -4.434
  371   HD12  LEU 558          2HD1      LEU 558 -13.234  -0.787  -4.030
  372   HD13  LEU 558          3HD1      LEU 558 -14.882  -0.709  -4.653
  373   HD21  LEU 558          3HD2      LEU 558 -13.329  -0.733  -1.132
  374   HD22  LEU 558          1HD2      LEU 558 -12.768  -2.047  -2.166
  375   HD23  LEU 558          2HD2      LEU 558 -13.959  -2.362  -0.906
  376    H    ARG 559           H        ARG 559 -16.410  -2.661  -0.920
  377    HA   ARG 559           HA       ARG 559 -19.067  -3.430  -1.025
  378    HB2  ARG 559           2HB      ARG 559 -19.320  -4.252  -3.318
  379    HB3  ARG 559           1HB      ARG 559 -19.060  -2.512  -3.317
  380    HG2  ARG 559           2HG      ARG 559 -16.592  -4.045  -3.498
  381    HG3  ARG 559           1HG      ARG 559 -17.700  -4.336  -4.842
  382    HD2  ARG 559           2HD      ARG 559 -16.836  -1.608  -3.896
  383    HD3  ARG 559           1HD      ARG 559 -16.088  -2.479  -5.234
  384    HE   ARG 559           HE       ARG 559 -18.554  -1.039  -5.283
  385   HH11  ARG 559          1HH1      ARG 559 -16.844  -3.735  -6.689
  386   HH12  ARG 559          2HH1      ARG 559 -17.741  -3.693  -8.170
  387   HH21  ARG 559          1HH2      ARG 559 -19.735  -0.981  -7.230
  388   HH22  ARG 559          2HH2      ARG 559 -19.383  -2.129  -8.477
  389    H    GLN 560           H        GLN 560 -16.636  -4.093   0.214
  390    HA   GLN 560           HA       GLN 560 -16.229  -6.866  -0.651
  391    HB2  GLN 560           2HB      GLN 560 -14.070  -6.596   0.732
  392    HB3  GLN 560           1HB      GLN 560 -14.163  -5.825  -0.844
  393    HG2  GLN 560           2HG      GLN 560 -13.142  -4.406   0.904
  394    HG3  GLN 560           1HG      GLN 560 -14.556  -3.694   0.134
  395   HE21  GLN 560          1HE2      GLN 560 -15.905  -2.747   1.447
  396   HE22  GLN 560          2HE2      GLN 560 -16.161  -3.135   3.112
  Start of MODEL   18
    1    H1   ALA 507           1HT      ALA 507 -12.343 -12.086  -4.865
    2    H2   ALA 507           2HT      ALA 507 -12.054 -10.663  -5.780
    3    H3   ALA 507           3HT      ALA 507 -12.161 -12.185  -6.566
    4    HA   ALA 507           HA       ALA 507 -14.173 -11.307  -6.994
    5    HB1  ALA 507           1HB      ALA 507 -14.631 -12.685  -4.355
    6    HB2  ALA 507           2HB      ALA 507 -14.289 -13.527  -5.867
    7    HB3  ALA 507           3HB      ALA 507 -15.755 -12.558  -5.708
    8    H    GLN 508           H        GLN 508 -13.623 -10.804  -3.506
    9    HA   GLN 508           HA       GLN 508 -14.229  -8.036  -3.647
   10    HB2  GLN 508           2HB      GLN 508 -16.433  -9.894  -3.171
   11    HB3  GLN 508           1HB      GLN 508 -16.267  -8.699  -1.893
   12    HG2  GLN 508           2HG      GLN 508 -16.037  -7.155  -4.122
   13    HG3  GLN 508           1HG      GLN 508 -17.173  -8.394  -4.655
   14   HE21  GLN 508          1HE2      GLN 508 -18.437  -8.889  -2.211
   15   HE22  GLN 508          2HE2      GLN 508 -19.367  -7.497  -1.783
   16    HA   PRO 509           HA       PRO 509 -11.973  -9.611   0.125
   17    HB2  PRO 509           2HB      PRO 509  -9.653  -8.141  -0.785
   18    HB3  PRO 509           1HB      PRO 509  -9.825  -9.877  -0.529
   19    HG2  PRO 509           2HG      PRO 509  -9.512  -8.733  -2.991
   20    HG3  PRO 509           1HG      PRO 509 -10.340 -10.277  -2.720
   21    HD2  PRO 509           2HD      PRO 509 -11.503  -7.551  -3.150
   22    HD3  PRO 509           1HD      PRO 509 -12.040  -9.119  -3.787
   23    H    LYS 510           H        LYS 510 -12.441  -8.442   1.870
   24    HA   LYS 510           HA       LYS 510 -12.829  -5.604   1.755
   25    HB2  LYS 510           2HB      LYS 510 -12.624  -7.192   4.301
   26    HB3  LYS 510           1HB      LYS 510 -13.588  -5.761   3.974
   27    HG2  LYS 510           2HG      LYS 510 -15.309  -7.134   3.695
   28    HG3  LYS 510           1HG      LYS 510 -14.555  -7.618   2.174
   29    HD2  LYS 510           2HD      LYS 510 -13.351  -9.406   3.362
   30    HD3  LYS 510           1HD      LYS 510 -14.152  -8.932   4.861
   31    HE2  LYS 510           2HE      LYS 510 -16.232  -9.668   4.128
   32    HE3  LYS 510           1HE      LYS 510 -15.755  -9.629   2.431
   33    HZ1  LYS 510           3HZ      LYS 510 -14.054 -11.437   3.384
   34    HZ2  LYS 510           1HZ      LYS 510 -15.570 -11.833   2.744
   35    HZ3  LYS 510           2HZ      LYS 510 -15.365 -11.708   4.418
   36    H    CYS 511           H        CYS 511 -11.317  -4.092   1.975
   37    HA   CYS 511           HA       CYS 511  -9.368  -3.035   2.483
   38    HB2  CYS 511           2HB      CYS 511 -10.161  -4.388   4.823
   39    HB3  CYS 511           1HB      CYS 511  -8.432  -4.676   4.666
   40    H    ASN 512           H        ASN 512  -8.037  -3.446   0.803
   41    HA   ASN 512           HA       ASN 512  -6.543  -5.958   0.794
   42    HB2  ASN 512           2HB      ASN 512  -6.734  -3.980  -1.472
   43    HB3  ASN 512           1HB      ASN 512  -6.110  -5.622  -1.535
   44   HD21  ASN 512          1HD2      ASN 512  -9.056  -3.811  -0.746
   45   HD22  ASN 512          2HD2      ASN 512 -10.150  -4.997  -1.359
   46    HA   PRO 513           HA       PRO 513  -3.046  -2.815   0.720
   47    HB2  PRO 513           2HB      PRO 513  -3.646  -0.203   0.113
   48    HB3  PRO 513           1HB      PRO 513  -3.333  -1.461  -1.087
   49    HG2  PRO 513           2HG      PRO 513  -5.800  -0.098  -0.603
   50    HG3  PRO 513           1HG      PRO 513  -5.494  -1.410  -1.751
   51    HD2  PRO 513           2HD      PRO 513  -6.633  -1.529   0.993
   52    HD3  PRO 513           1HD      PRO 513  -6.941  -2.568  -0.413
   53    H    ASN 514           H        ASN 514  -5.729  -2.166   2.658
   54    HA   ASN 514           HA       ASN 514  -4.225  -0.288   4.342
   55    HB2  ASN 514           2HB      ASN 514  -7.123  -0.810   3.904
   56    HB3  ASN 514           1HB      ASN 514  -6.634  -0.348   5.531
   57   HD21  ASN 514          1HD2      ASN 514  -7.173   0.692   2.314
   58   HD22  ASN 514          2HD2      ASN 514  -6.808   2.362   2.548
   59    H    LEU 515           H        LEU 515  -2.941  -2.355   4.689
   60    HA   LEU 515           HA       LEU 515  -4.068  -3.729   7.020
   61    HB2  LEU 515           2HB      LEU 515  -2.317  -5.544   5.754
   62    HB3  LEU 515           1HB      LEU 515  -4.040  -5.687   6.019
   63    HG   LEU 515           HG       LEU 515  -3.455  -6.125   3.712
   64   HD11  LEU 515          1HD1      LEU 515  -4.792  -3.701   3.089
   65   HD12  LEU 515          2HD1      LEU 515  -5.414  -4.319   4.616
   66   HD13  LEU 515          3HD1      LEU 515  -5.436  -5.335   3.176
   67   HD21  LEU 515          3HD2      LEU 515  -1.749  -5.012   2.831
   68   HD22  LEU 515          1HD2      LEU 515  -1.861  -3.726   4.028
   69   HD23  LEU 515          2HD2      LEU 515  -2.869  -3.675   2.585
   70    H    HIS 516           H        HIS 516  -1.223  -2.285   5.569
   71    HA   HIS 516           HA       HIS 516   0.089  -2.094   8.047
   72    HB2  HIS 516           2HB      HIS 516   2.011  -3.770   7.244
   73    HB3  HIS 516           1HB      HIS 516   0.645  -4.306   8.219
   74    HD1  HIS 516           1HD      HIS 516   0.860  -6.717   7.187
   75    HD2  HIS 516           2HD      HIS 516   0.019  -3.714   4.447
   76    HE1  HIS 516           1HE      HIS 516   0.137  -7.891   5.079
   77    HE2  HIS 516           2HE      HIS 516  -0.230  -6.063   3.410
   78    H    TYR 517           H        TYR 517   1.775  -3.090   5.103
   79    HA   TYR 517           HA       TYR 517   3.573  -0.969   5.145
   80    HB2  TYR 517           2HB      TYR 517   2.988  -2.312   2.564
   81    HB3  TYR 517           1HB      TYR 517   4.533  -1.848   3.258
   82    HD1  TYR 517           1HD      TYR 517   1.839  -4.354   3.352
   83    HD2  TYR 517           2HD      TYR 517   5.778  -3.365   4.612
   84    HE1  TYR 517           1HE      TYR 517   2.201  -6.689   4.036
   85    HE2  TYR 517           2HE      TYR 517   6.146  -5.693   5.321
   86    HH   TYR 517           HH       TYR 517   4.887  -7.651   5.940
   87    H    TRP 518           H        TRP 518   0.463  -0.498   4.627
   88    HA   TRP 518           HA       TRP 518   0.951   1.718   2.781
   89    HB2  TRP 518           2HB      TRP 518  -1.704   0.444   2.604
   90    HB3  TRP 518           1HB      TRP 518  -0.715   1.122   1.342
   91    HD1  TRP 518           HD       TRP 518   0.342  -1.891   3.511
   92    HE1  TRP 518           1HE      TRP 518   0.661  -3.875   1.959
   93    HE3  TRP 518           3HE      TRP 518  -1.318   0.205  -0.844
   94    HZ2  TRP 518           2HZ      TRP 518   0.237  -4.529  -0.762
   95    HZ3  TRP 518           3HZ      TRP 518  -1.340  -1.177  -2.879
   96    HH2  TRP 518           HH       TRP 518  -0.578  -3.497  -2.837
   97    H    THR 519           H        THR 519  -1.073   0.222   5.208
   98    HA   THR 519           HA       THR 519  -2.562   2.632   5.747
   99    HB   THR 519           HB       THR 519  -3.652   0.494   6.040
  100    HG1  THR 519           1HG      THR 519  -4.124   2.270   7.515
  101   HG21  THR 519          3HG2      THR 519  -2.892  -1.262   7.183
  102   HG22  THR 519          1HG2      THR 519  -2.251  -0.266   8.489
  103   HG23  THR 519          2HG2      THR 519  -1.321  -0.482   7.007
  104    H    THR 520           H        THR 520   0.491   1.488   6.703
  105    HA   THR 520           HA       THR 520   0.399   2.970   9.224
  106    HB   THR 520           HB       THR 520   1.630   0.574   8.525
  107    HG1  THR 520           1HG      THR 520   2.263   2.206  10.745
  108   HG21  THR 520          3HG2      THR 520   3.725   2.715   8.764
  109   HG22  THR 520          1HG2      THR 520   3.587   1.439   7.555
  110   HG23  THR 520          2HG2      THR 520   4.020   1.037   9.215
  111    H    GLN 521           H        GLN 521   2.711   2.695   6.506
  112    HA   GLN 521           HA       GLN 521   3.513   5.454   7.050
  113    HB2  GLN 521           2HB      GLN 521   5.527   4.981   5.805
  114    HB3  GLN 521           1HB      GLN 521   5.274   3.716   6.997
  115    HG2  GLN 521           2HG      GLN 521   4.796   2.127   5.420
  116    HG3  GLN 521           1HG      GLN 521   4.267   3.309   4.231
  117   HE21  GLN 521          1HE2      GLN 521   6.318   5.019   3.983
  118   HE22  GLN 521          2HE2      GLN 521   7.746   4.201   3.463
  119    H    ASP 522           H        ASP 522   4.604   6.055   4.567
  120    HA   ASP 522           HA       ASP 522   2.163   6.539   3.018
  121    HB2  ASP 522           2HB      ASP 522   4.704   8.008   3.429
  122    HB3  ASP 522           1HB      ASP 522   3.880   8.209   1.888
  123    H    GLU 523           H        GLU 523   3.601   4.051   2.862
  124    HA   GLU 523           HA       GLU 523   4.631   2.617   1.386
  125    HB2  GLU 523           2HB      GLU 523   2.619   4.130  -0.250
  126    HB3  GLU 523           1HB      GLU 523   3.587   2.847  -0.961
  127    HG2  GLU 523           2HG      GLU 523   2.456   1.232   0.082
  128    HG3  GLU 523           1HG      GLU 523   2.311   2.163   1.570
  129    H    GLY 524           H        GLY 524   6.678   3.605   1.665
  130    HA2  GLY 524           2HA      GLY 524   8.663   4.063   0.457
  131    HA3  GLY 524           1HA      GLY 524   7.682   4.749  -0.834
  132    H    ALA 525           H        ALA 525   6.143   6.076   1.517
  133    HA   ALA 525           HA       ALA 525   6.013   8.325   1.987
  134    HB1  ALA 525           1HB      ALA 525   8.279   8.303   3.731
  135    HB2  ALA 525           2HB      ALA 525   7.389   6.782   3.821
  136    HB3  ALA 525           3HB      ALA 525   6.557   8.308   4.128
  137    H    ALA 526           H        ALA 526   7.714   8.000  -0.361
  138    HA   ALA 526           HA       ALA 526   9.337   9.066  -1.525
  139    HB1  ALA 526           1HB      ALA 526   7.297  10.733  -1.055
  140    HB2  ALA 526           2HB      ALA 526   8.701  11.184  -2.023
  141    HB3  ALA 526           3HB      ALA 526   8.608  11.665  -0.329
  142    H    ILE 527           H        ILE 527   9.942   8.363   1.397
  143    HA   ILE 527           HA       ILE 527  11.716  10.222   2.482
  144    HB   ILE 527           HB       ILE 527  12.827   8.060   3.416
  145   HG12  ILE 527          2HG1      ILE 527  11.208   6.872   1.535
  146   HG13  ILE 527          1HG1      ILE 527  11.958   6.047   2.895
  147   HG21  ILE 527          1HG2      ILE 527  10.091   9.085   4.048
  148   HG22  ILE 527          2HG2      ILE 527  11.613   9.403   4.880
  149   HG23  ILE 527          3HG2      ILE 527  10.848   7.820   5.015
  150   HD11  ILE 527          3HD1      ILE 527   9.179   7.098   2.650
  151   HD12  ILE 527          1HD1      ILE 527   9.861   6.570   4.186
  152   HD13  ILE 527          2HD1      ILE 527   9.694   5.428   2.852
  153    H    GLY 528           H        GLY 528  12.119   7.752   0.042
  154    HA2  GLY 528           2HA      GLY 528  14.255   8.987  -1.253
  155    HA3  GLY 528           1HA      GLY 528  14.957   7.862  -0.102
  156    H    LEU 529           H        LEU 529  12.957   5.837  -0.318
  157    HA   LEU 529           HA       LEU 529  12.390   4.027  -1.535
  158    HB2  LEU 529           2HB      LEU 529  11.998   6.158  -3.266
  159    HB3  LEU 529           1HB      LEU 529  12.938   5.008  -4.199
  160    HG   LEU 529           HG       LEU 529  10.182   4.725  -3.081
  161   HD11  LEU 529          1HD1      LEU 529   9.905   5.195  -5.266
  162   HD12  LEU 529          2HD1      LEU 529  10.240   3.475  -5.468
  163   HD13  LEU 529          3HD1      LEU 529  11.528   4.657  -5.696
  164   HD21  LEU 529          3HD2      LEU 529  11.122   2.790  -2.168
  165   HD22  LEU 529          1HD2      LEU 529  12.152   2.519  -3.574
  166   HD23  LEU 529          2HD2      LEU 529  10.409   2.260  -3.695
  167    H    ALA 530           H        ALA 530  15.222   5.628  -2.895
  168    HA   ALA 530           HA       ALA 530  16.308   3.170  -3.836
  169    HB1  ALA 530           1HB      ALA 530  17.142   5.998  -3.859
  170    HB2  ALA 530           2HB      ALA 530  17.147   4.801  -5.154
  171    HB3  ALA 530           3HB      ALA 530  18.434   4.800  -3.947
  172    H    TRP 531           H        TRP 531  16.399   4.806  -0.840
  173    HA   TRP 531           HA       TRP 531  18.778   4.249   0.330
  174    HB2  TRP 531           2HB      TRP 531  17.444   3.885   2.475
  175    HB3  TRP 531           1HB      TRP 531  17.140   5.390   1.617
  176    HD1  TRP 531           HD       TRP 531  14.974   4.936  -0.298
  177    HE1  TRP 531           1HE      TRP 531  12.666   4.065   0.318
  178    HE3  TRP 531           3HE      TRP 531  16.139   2.677   4.127
  179    HZ2  TRP 531           2HZ      TRP 531  11.452   2.603   2.424
  180    HZ3  TRP 531           3HZ      TRP 531  14.342   1.566   5.388
  181    HH2  TRP 531           HH       TRP 531  12.047   1.530   4.553
  182    H    ILE 532           H        ILE 532  16.301   1.967  -0.557
  183    HA   ILE 532           HA       ILE 532  17.786  -0.220   0.708
  184    HB   ILE 532           HB       ILE 532  15.767  -1.543   0.340
  185   HG12  ILE 532          2HG1      ILE 532  15.138   0.635  -1.445
  186   HG13  ILE 532          1HG1      ILE 532  14.390  -0.947  -1.317
  187   HG21  ILE 532          1HG2      ILE 532  14.290  -0.285   1.903
  188   HG22  ILE 532          2HG2      ILE 532  15.363   1.103   1.708
  189   HG23  ILE 532          3HG2      ILE 532  15.972  -0.391   2.426
  190   HD11  ILE 532          3HD1      ILE 532  12.856   1.011  -1.050
  191   HD12  ILE 532          1HD1      ILE 532  13.675   1.361   0.470
  192   HD13  ILE 532          2HD1      ILE 532  12.808  -0.162   0.265
  193    HA   PRO 533           HA       PRO 533  19.255  -1.816  -3.129
  194    HB2  PRO 533           2HB      PRO 533  18.872  -4.506  -2.826
  195    HB3  PRO 533           1HB      PRO 533  20.175  -3.607  -2.041
  196    HG2  PRO 533           2HG      PRO 533  17.536  -4.474  -0.930
  197    HG3  PRO 533           1HG      PRO 533  19.139  -4.520  -0.173
  198    HD2  PRO 533           2HD      PRO 533  17.348  -2.597   0.406
  199    HD3  PRO 533           1HD      PRO 533  19.092  -2.270   0.359
  200    H    TYR 534           H        TYR 534  16.188  -3.332  -2.107
  201    HA   TYR 534           HA       TYR 534  14.967  -2.670  -4.621
  202    HB2  TYR 534           2HB      TYR 534  14.488  -4.966  -5.334
  203    HB3  TYR 534           1HB      TYR 534  16.218  -4.645  -5.296
  204    HD1  TYR 534           2HD      TYR 534  13.451  -6.382  -3.584
  205    HD2  TYR 534           1HD      TYR 534  17.666  -5.852  -3.827
  206    HE1  TYR 534           2HE      TYR 534  13.775  -8.351  -2.146
  207    HE2  TYR 534           1HE      TYR 534  18.001  -7.819  -2.390
  208    HH   TYR 534           HH       TYR 534  16.825  -9.829  -1.713
  209    H    PHE 535           H        PHE 535  14.616  -3.002  -1.408
  210    HA   PHE 535           HA       PHE 535  12.191  -4.407  -1.116
  211    HB2  PHE 535           2HB      PHE 535  12.900  -2.077   0.639
  212    HB3  PHE 535           1HB      PHE 535  12.101  -3.580   1.069
  213    HD1  PHE 535           1HD      PHE 535  14.241  -5.300  -0.473
  214    HD2  PHE 535           2HD      PHE 535  14.446  -2.227   2.466
  215    HE1  PHE 535           1HE      PHE 535  16.390  -6.201   0.319
  216    HE2  PHE 535           2HE      PHE 535  16.594  -3.121   3.259
  217    HZ   PHE 535           HZ       PHE 535  17.569  -5.109   2.186
  218    H    GLY 536           H        GLY 536  12.917  -1.175  -2.162
  219    HA2  GLY 536           2HA      GLY 536  10.045  -0.528  -2.191
  220    HA3  GLY 536           1HA      GLY 536  11.335   0.659  -2.159
  221    HA   PRO 537           HA       PRO 537  11.758   1.059  -6.539
  222    HB2  PRO 537           2HB      PRO 537  14.063  -0.838  -6.659
  223    HB3  PRO 537           1HB      PRO 537  13.911   0.792  -7.330
  224    HG2  PRO 537           2HG      PRO 537  15.332   0.378  -5.124
  225    HG3  PRO 537           1HG      PRO 537  14.302   1.814  -5.278
  226    HD2  PRO 537           2HD      PRO 537  13.856  -0.682  -3.709
  227    HD3  PRO 537           1HD      PRO 537  13.410   0.990  -3.318
  228    H    ALA 538           H        ALA 538  12.500  -2.310  -5.652
  229    HA   ALA 538           HA       ALA 538  11.255  -3.350  -8.032
  230    HB1  ALA 538           1HB      ALA 538  13.220  -4.380  -6.768
  231    HB2  ALA 538           2HB      ALA 538  11.943  -5.471  -7.305
  232    HB3  ALA 538           3HB      ALA 538  12.018  -4.965  -5.618
  233    H    ALA 539           H        ALA 539  10.314  -2.639  -4.777
  234    HA   ALA 539           HA       ALA 539   8.108  -4.331  -4.472
  235    HB1  ALA 539           1HB      ALA 539   8.531  -3.349  -2.490
  236    HB2  ALA 539           2HB      ALA 539   7.339  -2.179  -3.056
  237    HB3  ALA 539           3HB      ALA 539   9.060  -1.838  -3.228
  238    H    GLU 540           H        GLU 540   5.980  -4.167  -4.988
  239    HA   GLU 540           HA       GLU 540   5.138  -1.889  -6.648
  240    HB2  GLU 540           2HB      GLU 540   4.366  -4.761  -7.177
  241    HB3  GLU 540           1HB      GLU 540   3.978  -3.358  -8.165
  242    HG2  GLU 540           2HG      GLU 540   6.656  -3.182  -8.144
  243    HG3  GLU 540           1HG      GLU 540   6.460  -4.928  -7.989
  244    H    GLY 541           H        GLY 541   4.401  -4.269  -4.256
  245    HA2  GLY 541           2HA      GLY 541   1.736  -3.060  -3.871
  246    HA3  GLY 541           1HA      GLY 541   2.091  -4.749  -3.524
  247    H    ILE 542           H        ILE 542   4.118  -1.976  -2.822
  248    HA   ILE 542           HA       ILE 542   3.493  -2.061   0.018
  249    HB   ILE 542           HB       ILE 542   6.388  -2.233  -0.709
  250   HG12  ILE 542          2HG1      ILE 542   6.142  -4.753  -0.175
  251   HG13  ILE 542          1HG1      ILE 542   4.453  -4.528  -0.626
  252   HG21  ILE 542          1HG2      ILE 542   5.517  -1.648   1.585
  253   HG22  ILE 542          2HG2      ILE 542   6.666  -2.985   1.514
  254   HG23  ILE 542          3HG2      ILE 542   4.943  -3.312   1.697
  255   HD11  ILE 542          3HD1      ILE 542   5.169  -5.001  -2.689
  256   HD12  ILE 542          1HD1      ILE 542   6.849  -4.648  -2.293
  257   HD13  ILE 542          2HD1      ILE 542   5.748  -3.330  -2.705
  258    H    TYR 543           H        TYR 543   5.260  -0.719  -2.690
  259    HA   TYR 543           HA       TYR 543   5.643   1.778  -1.263
  260    HB2  TYR 543           2HB      TYR 543   7.545   1.995  -2.446
  261    HB3  TYR 543           1HB      TYR 543   7.361   0.276  -2.721
  262    HD1  TYR 543           1HD      TYR 543   5.752  -0.266  -4.803
  263    HD2  TYR 543           2HD      TYR 543   8.033   3.287  -4.285
  264    HE1  TYR 543           1HE      TYR 543   5.703   0.113  -7.228
  265    HE2  TYR 543           2HE      TYR 543   7.997   3.677  -6.708
  266    HH   TYR 543           HH       TYR 543   6.908   1.294  -8.938
  267    H    ILE 544           H        ILE 544   4.017   0.326  -3.968
  268    HA   ILE 544           HA       ILE 544   2.745   1.159  -5.693
  269    HB   ILE 544           HB       ILE 544   1.379   2.612  -3.443
  270   HG12  ILE 544          2HG1      ILE 544   0.098   0.428  -3.192
  271   HG13  ILE 544          1HG1      ILE 544   1.401  -0.330  -4.101
  272   HG21  ILE 544          1HG2      ILE 544   0.254   3.132  -5.387
  273   HG22  ILE 544          2HG2      ILE 544  -0.622   1.705  -4.835
  274   HG23  ILE 544          3HG2      ILE 544   0.578   1.562  -6.119
  275   HD11  ILE 544          3HD1      ILE 544   1.272   0.032  -1.367
  276   HD12  ILE 544          1HD1      ILE 544   2.409   1.264  -1.915
  277   HD13  ILE 544          2HD1      ILE 544   2.689  -0.431  -2.306
  278    H    GLU 545           H        GLU 545   2.647   3.934  -3.511
  279    HA   GLU 545           HA       GLU 545   3.104   6.141  -3.795
  280    HB2  GLU 545           2HB      GLU 545   4.587   5.361  -6.301
  281    HB3  GLU 545           1HB      GLU 545   4.803   6.819  -5.336
  282    HG2  GLU 545           2HG      GLU 545   5.422   5.262  -3.429
  283    HG3  GLU 545           1HG      GLU 545   5.552   4.002  -4.655
  284    H    GLY 546           H        GLY 546   0.942   6.567  -4.130
  285    HA2  GLY 546           2HA      GLY 546   0.146   8.145  -6.158
  286    HA3  GLY 546           1HA      GLY 546  -0.174   6.540  -6.798
  287    H    LEU 547           H        LEU 547  -0.685   5.696  -3.889
  288    HA   LEU 547           HA       LEU 547  -3.369   6.897  -3.628
  289    HB2  LEU 547           2HB      LEU 547  -4.402   4.843  -3.329
  290    HB3  LEU 547           1HB      LEU 547  -3.269   4.539  -4.630
  291    HG   LEU 547           HG       LEU 547  -2.883   3.766  -1.736
  292   HD11  LEU 547          1HD1      LEU 547  -3.216   1.953  -4.107
  293   HD12  LEU 547          2HD1      LEU 547  -4.576   2.482  -3.117
  294   HD13  LEU 547          3HD1      LEU 547  -3.273   1.540  -2.393
  295   HD21  LEU 547          3HD2      LEU 547  -0.716   4.006  -2.372
  296   HD22  LEU 547          1HD2      LEU 547  -1.078   3.786  -4.084
  297   HD23  LEU 547          2HD2      LEU 547  -1.006   2.388  -3.011
  298    H    MET 548           H        MET 548  -0.483   5.920  -2.117
  299    HA   MET 548           HA       MET 548  -1.277   5.479   0.508
  300    HB2  MET 548           2HB      MET 548   1.121   6.542   0.981
  301    HB3  MET 548           1HB      MET 548   0.922   4.931   0.330
  302    HG2  MET 548           2HG      MET 548   2.643   5.930  -0.903
  303    HG3  MET 548           1HG      MET 548   1.252   5.946  -1.966
  304    HE1  MET 548           3HE      MET 548   0.336   9.463  -2.526
  305    HE2  MET 548           1HE      MET 548  -0.044   7.745  -2.636
  306    HE3  MET 548           2HE      MET 548   1.300   8.411  -3.561
  307    H    HIS 549           H        HIS 549  -2.645   6.810   1.521
  308    HA   HIS 549           HA       HIS 549  -1.755   9.179   2.657
  309    HB2  HIS 549           2HB      HIS 549  -3.646  10.597   1.346
  310    HB3  HIS 549           1HB      HIS 549  -1.943  10.601   0.911
  311    HD1  HIS 549           1HD      HIS 549  -5.281   9.383  -0.243
  312    HD2  HIS 549           2HD      HIS 549  -1.322   9.331  -1.500
  313    HE1  HIS 549           1HE      HIS 549  -5.348   8.663  -2.651
  314    HE2  HIS 549           2HE      HIS 549  -2.958   8.796  -3.428
  315    H    ASN 550           H        ASN 550  -4.885   8.173   1.258
  316    HA   ASN 550           HA       ASN 550  -6.003   7.151   3.573
  317    HB2  ASN 550           2HB      ASN 550  -5.691   9.909   3.847
  318    HB3  ASN 550           1HB      ASN 550  -7.389   9.702   3.430
  319   HD21  ASN 550          1HD2      ASN 550  -8.726   8.509   4.805
  320   HD22  ASN 550          2HD2      ASN 550  -8.294   8.200   6.448
  321    H    GLN 551           H        GLN 551  -7.309   5.809   2.516
  322    HA   GLN 551           HA       GLN 551  -9.254   6.970   0.652
  323    HB2  GLN 551           2HB      GLN 551  -8.252   4.199   0.179
  324    HB3  GLN 551           1HB      GLN 551  -8.943   5.344  -0.959
  325    HG2  GLN 551           2HG      GLN 551  -6.893   5.795  -1.640
  326    HG3  GLN 551           1HG      GLN 551  -6.591   6.544  -0.075
  327   HE21  GLN 551          1HE2      GLN 551  -6.757   4.068   1.423
  328   HE22  GLN 551          2HE2      GLN 551  -5.313   3.187   1.064
  329    H    ASP 552           H        ASP 552  -8.647   3.748   1.923
  330    HA   ASP 552           HA       ASP 552 -10.061   2.189   2.807
  331    HB2  ASP 552           2HB      ASP 552  -9.984   4.529   4.503
  332    HB3  ASP 552           1HB      ASP 552 -11.539   3.717   4.660
  333    H    GLY 553           H        GLY 553 -11.067   3.656   0.491
  334    HA2  GLY 553           2HA      GLY 553 -13.946   3.170   0.913
  335    HA3  GLY 553           1HA      GLY 553 -13.382   4.570   0.003
  336    H    LEU 554           H        LEU 554 -11.200   3.229  -1.246
  337    HA   LEU 554           HA       LEU 554 -12.644   1.867  -3.366
  338    HB2  LEU 554           2HB      LEU 554 -10.493   2.033  -4.575
  339    HB3  LEU 554           1HB      LEU 554 -11.104   3.585  -4.038
  340    HG   LEU 554           HG       LEU 554  -9.431   2.799  -1.957
  341   HD11  LEU 554          1HD1      LEU 554  -8.680   1.005  -3.651
  342   HD12  LEU 554          2HD1      LEU 554  -7.449   1.955  -2.818
  343   HD13  LEU 554          3HD1      LEU 554  -7.885   2.342  -4.481
  344   HD21  LEU 554          3HD2      LEU 554  -9.651   5.052  -2.831
  345   HD22  LEU 554          1HD2      LEU 554  -8.857   4.573  -4.332
  346   HD23  LEU 554          2HD2      LEU 554  -7.955   4.568  -2.816
  347    H    ILE 555           H        ILE 555 -11.141   0.978  -0.544
  348    HA   ILE 555           HA       ILE 555 -10.733  -1.746  -1.514
  349    HB   ILE 555           HB       ILE 555  -8.669  -1.972  -0.219
  350   HG12  ILE 555          2HG1      ILE 555  -9.088  -0.170   1.424
  351   HG13  ILE 555          1HG1      ILE 555  -7.514  -0.030   0.668
  352   HG21  ILE 555          1HG2      ILE 555  -8.968  -0.712  -2.671
  353   HG22  ILE 555          2HG2      ILE 555  -7.504  -1.460  -2.032
  354   HG23  ILE 555          3HG2      ILE 555  -7.788   0.269  -1.801
  355   HD11  ILE 555          3HD1      ILE 555  -9.059   1.503  -0.956
  356   HD12  ILE 555          1HD1      ILE 555  -8.036   2.094   0.350
  357   HD13  ILE 555          2HD1      ILE 555  -9.754   1.808   0.634
  358    H    CYS 556           H        CYS 556 -10.942   0.431   1.262
  359    HA   CYS 556           HA       CYS 556 -12.049  -1.781   2.837
  360    HB2  CYS 556           2HB      CYS 556  -9.844  -0.293   3.421
  361    HB3  CYS 556           1HB      CYS 556 -11.091   0.613   4.270
  362    H    GLY 557           H        GLY 557 -13.958  -0.830   1.373
  363    HA2  GLY 557           2HA      GLY 557 -15.236   1.417   2.760
  364    HA3  GLY 557           1HA      GLY 557 -15.726   0.753   1.211
  365    H    LEU 558           H        LEU 558 -16.179  -1.813   1.584
  366    HA   LEU 558           HA       LEU 558 -17.740  -2.202   4.002
  367    HB2  LEU 558           2HB      LEU 558 -19.780  -2.731   2.862
  368    HB3  LEU 558           1HB      LEU 558 -19.268  -1.123   2.391
  369    HG   LEU 558           HG       LEU 558 -18.727  -3.545   0.686
  370   HD11  LEU 558          1HD1      LEU 558 -21.069  -1.661   0.500
  371   HD12  LEU 558          2HD1      LEU 558 -21.144  -3.332   1.059
  372   HD13  LEU 558          3HD1      LEU 558 -20.690  -2.979  -0.609
  373   HD21  LEU 558          3HD2      LEU 558 -19.082  -1.133  -0.761
  374   HD22  LEU 558          1HD2      LEU 558 -17.621  -2.104  -0.583
  375   HD23  LEU 558          2HD2      LEU 558 -17.964  -0.810   0.563
  376    H    ARG 559           H        ARG 559 -16.762  -3.555   0.861
  377    HA   ARG 559           HA       ARG 559 -15.523  -5.805   1.913
  378    HB2  ARG 559           2HB      ARG 559 -17.116  -7.587   1.477
  379    HB3  ARG 559           1HB      ARG 559 -17.805  -6.447   2.625
  380    HG2  ARG 559           2HG      ARG 559 -18.431  -5.751  -0.115
  381    HG3  ARG 559           1HG      ARG 559 -18.992  -7.372   0.311
  382    HD2  ARG 559           2HD      ARG 559 -19.564  -4.862   1.884
  383    HD3  ARG 559           1HD      ARG 559 -20.680  -5.623   0.751
  384    HE   ARG 559           HE       ARG 559 -20.026  -7.596   2.533
  385   HH11  ARG 559          1HH1      ARG 559 -21.407  -4.399   2.765
  386   HH12  ARG 559          2HH1      ARG 559 -22.340  -4.769   4.176
  387   HH21  ARG 559          1HH2      ARG 559 -21.254  -8.083   4.389
  388   HH22  ARG 559          2HH2      ARG 559 -22.254  -6.860   5.098
  389    H    GLN 560           H        GLN 560 -15.142  -3.942  -0.145
  390    HA   GLN 560           HA       GLN 560 -15.301  -5.603  -2.563
  391    HB2  GLN 560           2HB      GLN 560 -15.204  -3.642  -3.870
  392    HB3  GLN 560           1HB      GLN 560 -16.326  -3.285  -2.567
  393    HG2  GLN 560           2HG      GLN 560 -13.685  -2.523  -1.780
  394    HG3  GLN 560           1HG      GLN 560 -14.056  -1.830  -3.358
  395   HE21  GLN 560          1HE2      GLN 560 -15.008  -2.011  -0.010
  396   HE22  GLN 560          2HE2      GLN 560 -15.997  -0.596  -0.009
  Start of MODEL   19
    1    H1   ALA 507           1HT      ALA 507 -15.610 -12.366  -5.143
    2    H2   ALA 507           2HT      ALA 507 -16.733 -13.366  -4.317
    3    H3   ALA 507           3HT      ALA 507 -15.301 -14.043  -4.975
    4    HA   ALA 507           HA       ALA 507 -15.272 -13.736  -2.567
    5    HB1  ALA 507           1HB      ALA 507 -13.306 -13.120  -4.525
    6    HB2  ALA 507           2HB      ALA 507 -13.080 -13.772  -2.902
    7    HB3  ALA 507           3HB      ALA 507 -13.089 -12.027  -3.159
    8    H    GLN 508           H        GLN 508 -13.913 -11.656  -1.379
    9    HA   GLN 508           HA       GLN 508 -15.159  -9.134  -1.774
   10    HB2  GLN 508           2HB      GLN 508 -16.365 -11.038   0.156
   11    HB3  GLN 508           1HB      GLN 508 -16.179  -9.377   0.703
   12    HG2  GLN 508           2HG      GLN 508 -17.260  -9.091  -1.810
   13    HG3  GLN 508           1HG      GLN 508 -18.069 -10.525  -1.179
   14   HE21  GLN 508          1HE2      GLN 508 -18.499  -7.389  -1.543
   15   HE22  GLN 508          2HE2      GLN 508 -19.421  -7.008  -0.132
   16    HA   PRO 509           HA       PRO 509 -11.157  -9.455   0.710
   17    HB2  PRO 509           2HB      PRO 509 -10.278  -7.519  -1.341
   18    HB3  PRO 509           1HB      PRO 509  -9.468  -8.971  -0.746
   19    HG2  PRO 509           2HG      PRO 509 -10.566  -8.893  -3.185
   20    HG3  PRO 509           1HG      PRO 509 -10.614 -10.363  -2.193
   21    HD2  PRO 509           2HD      PRO 509 -12.765  -8.341  -2.693
   22    HD3  PRO 509           1HD      PRO 509 -12.879 -10.110  -2.609
   23    H    LYS 510           H        LYS 510 -12.084  -8.328   2.423
   24    HA   LYS 510           HA       LYS 510 -12.733  -5.527   2.172
   25    HB2  LYS 510           2HB      LYS 510 -12.535  -7.190   4.688
   26    HB3  LYS 510           1HB      LYS 510 -13.352  -5.644   4.507
   27    HG2  LYS 510           2HG      LYS 510 -15.160  -6.557   3.472
   28    HG3  LYS 510           1HG      LYS 510 -14.228  -7.879   2.766
   29    HD2  LYS 510           2HD      LYS 510 -14.235  -8.016   5.656
   30    HD3  LYS 510           1HD      LYS 510 -15.877  -7.999   5.009
   31    HE2  LYS 510           2HE      LYS 510 -15.371 -10.256   5.015
   32    HE3  LYS 510           1HE      LYS 510 -14.980  -9.786   3.362
   33    HZ1  LYS 510           3HZ      LYS 510 -13.193 -11.087   4.116
   34    HZ2  LYS 510           1HZ      LYS 510 -13.108 -10.281   5.602
   35    HZ3  LYS 510           2HZ      LYS 510 -12.634  -9.492   4.184
   36    H    CYS 511           H        CYS 511 -11.226  -4.004   2.168
   37    HA   CYS 511           HA       CYS 511  -9.373  -2.789   2.686
   38    HB2  CYS 511           2HB      CYS 511  -9.929  -4.318   5.126
   39    HB3  CYS 511           1HB      CYS 511  -8.240  -3.848   4.963
   40    H    ASN 512           H        ASN 512  -8.229  -3.526   0.880
   41    HA   ASN 512           HA       ASN 512  -6.552  -5.871   1.146
   42    HB2  ASN 512           2HB      ASN 512  -6.721  -3.966  -1.191
   43    HB3  ASN 512           1HB      ASN 512  -5.983  -5.561  -1.180
   44   HD21  ASN 512          1HD2      ASN 512  -9.047  -3.860  -0.815
   45   HD22  ASN 512          2HD2      ASN 512 -10.041  -5.162  -1.353
   46    HA   PRO 513           HA       PRO 513  -3.178  -2.569   1.208
   47    HB2  PRO 513           2HB      PRO 513  -3.811  -0.045   0.408
   48    HB3  PRO 513           1HB      PRO 513  -3.472  -1.362  -0.719
   49    HG2  PRO 513           2HG      PRO 513  -5.980  -0.010  -0.277
   50    HG3  PRO 513           1HG      PRO 513  -5.617  -1.293  -1.441
   51    HD2  PRO 513           2HD      PRO 513  -6.832  -1.481   1.255
   52    HD3  PRO 513           1HD      PRO 513  -7.025  -2.543  -0.154
   53    H    ASN 514           H        ASN 514  -5.693  -2.480   3.122
   54    HA   ASN 514           HA       ASN 514  -4.670  -0.294   4.805
   55    HB2  ASN 514           2HB      ASN 514  -7.444  -1.022   4.033
   56    HB3  ASN 514           1HB      ASN 514  -7.198  -0.570   5.717
   57   HD21  ASN 514          1HD2      ASN 514  -7.295   0.520   2.441
   58   HD22  ASN 514          2HD2      ASN 514  -7.127   2.205   2.780
   59    H    LEU 515           H        LEU 515  -3.358  -2.449   5.147
   60    HA   LEU 515           HA       LEU 515  -4.629  -3.968   7.320
   61    HB2  LEU 515           2HB      LEU 515  -2.164  -5.030   6.108
   62    HB3  LEU 515           1HB      LEU 515  -3.618  -5.862   6.611
   63    HG   LEU 515           HG       LEU 515  -3.451  -6.182   4.284
   64   HD11  LEU 515          1HD1      LEU 515  -5.321  -4.255   3.605
   65   HD12  LEU 515          2HD1      LEU 515  -5.557  -4.504   5.335
   66   HD13  LEU 515          3HD1      LEU 515  -5.644  -5.872   4.227
   67   HD21  LEU 515          3HD2      LEU 515  -3.492  -3.426   3.364
   68   HD22  LEU 515          1HD2      LEU 515  -2.477  -4.776   2.852
   69   HD23  LEU 515          2HD2      LEU 515  -2.028  -3.819   4.264
   70    H    HIS 516           H        HIS 516  -1.446  -2.730   6.276
   71    HA   HIS 516           HA       HIS 516  -0.854  -1.534   8.751
   72    HB2  HIS 516           2HB      HIS 516   0.405  -3.061   9.911
   73    HB3  HIS 516           1HB      HIS 516  -0.726  -4.162   9.126
   74    HD1  HIS 516           1HD      HIS 516   0.206  -5.733   7.343
   75    HD2  HIS 516           2HD      HIS 516   2.981  -3.030   8.815
   76    HE1  HIS 516           1HE      HIS 516   2.393  -6.409   6.319
   77    HE2  HIS 516           2HE      HIS 516   4.070  -4.748   7.206
   78    H    TYR 517           H        TYR 517   0.870  -3.362   6.211
   79    HA   TYR 517           HA       TYR 517   3.164  -1.832   6.079
   80    HB2  TYR 517           2HB      TYR 517   2.538  -2.583   3.399
   81    HB3  TYR 517           1HB      TYR 517   3.751  -3.249   4.469
   82    HD1  TYR 517           1HD      TYR 517  -0.003  -3.598   4.691
   83    HD2  TYR 517           2HD      TYR 517   3.748  -5.484   3.967
   84    HE1  TYR 517           1HE      TYR 517  -1.122  -5.775   4.581
   85    HE2  TYR 517           2HE      TYR 517   2.628  -7.669   3.863
   86    HH   TYR 517           HH       TYR 517  -0.296  -8.211   3.274
   87    H    TRP 518           H        TRP 518   0.041  -0.876   5.164
   88    HA   TRP 518           HA       TRP 518   1.159   1.356   3.612
   89    HB2  TRP 518           2HB      TRP 518  -1.664   0.478   3.212
   90    HB3  TRP 518           1HB      TRP 518  -0.559   1.199   2.071
   91    HD1  TRP 518           HD       TRP 518   0.333  -2.045   3.899
   92    HE1  TRP 518           1HE      TRP 518   0.485  -3.911   2.211
   93    HE3  TRP 518           3HE      TRP 518  -1.393   0.455  -0.206
   94    HZ2  TRP 518           2HZ      TRP 518  -0.072  -4.340  -0.522
   95    HZ3  TRP 518           3HZ      TRP 518  -1.555  -0.774  -2.332
   96    HH2  TRP 518           HH       TRP 518  -0.905  -3.122  -2.488
   97    H    THR 519           H        THR 519  -1.497   0.280   5.641
   98    HA   THR 519           HA       THR 519  -2.605   2.806   6.189
   99    HB   THR 519           HB       THR 519  -3.849   0.764   6.580
  100    HG1  THR 519           1HG      THR 519  -3.315   2.037   9.057
  101   HG21  THR 519          3HG2      THR 519  -2.254   0.115   9.005
  102   HG22  THR 519          1HG2      THR 519  -1.692  -0.442   7.430
  103   HG23  THR 519          2HG2      THR 519  -3.286  -0.919   8.018
  104    H    THR 520           H        THR 520   0.127   1.150   7.530
  105    HA   THR 520           HA       THR 520   0.225   2.777   9.906
  106    HB   THR 520           HB       THR 520   1.163   0.320   9.428
  107    HG1  THR 520           1HG      THR 520   1.068   1.227  11.463
  108   HG21  THR 520          3HG2      THR 520   3.634   0.361   9.463
  109   HG22  THR 520          1HG2      THR 520   3.581   2.069   9.025
  110   HG23  THR 520          2HG2      THR 520   2.944   0.854   7.917
  111    H    GLN 521           H        GLN 521   2.368   2.436   7.076
  112    HA   GLN 521           HA       GLN 521   3.486   5.051   7.733
  113    HB2  GLN 521           2HB      GLN 521   5.399   4.464   6.497
  114    HB3  GLN 521           1HB      GLN 521   4.961   3.018   7.395
  115    HG2  GLN 521           2HG      GLN 521   4.252   1.901   5.500
  116    HG3  GLN 521           1HG      GLN 521   4.042   3.387   4.583
  117   HE21  GLN 521          1HE2      GLN 521   6.104   4.646   4.199
  118   HE22  GLN 521          2HE2      GLN 521   7.509   3.721   3.803
  119    H    ASP 522           H        ASP 522   4.478   5.660   5.187
  120    HA   ASP 522           HA       ASP 522   2.003   6.532   3.894
  121    HB2  ASP 522           2HB      ASP 522   4.686   7.689   4.238
  122    HB3  ASP 522           1HB      ASP 522   3.896   8.015   2.701
  123    H    GLU 523           H        GLU 523   3.019   3.915   3.471
  124    HA   GLU 523           HA       GLU 523   3.684   2.438   1.841
  125    HB2  GLU 523           2HB      GLU 523   1.828   4.380   0.554
  126    HB3  GLU 523           1HB      GLU 523   2.635   3.195  -0.466
  127    HG2  GLU 523           2HG      GLU 523   1.725   1.398   0.823
  128    HG3  GLU 523           1HG      GLU 523   1.021   2.533   1.972
  129    H    GLY 524           H        GLY 524   5.895   3.098   2.125
  130    HA2  GLY 524           2HA      GLY 524   7.888   3.289   0.862
  131    HA3  GLY 524           1HA      GLY 524   6.990   4.186  -0.359
  132    H    ALA 525           H        ALA 525   5.688   5.761   1.855
  133    HA   ALA 525           HA       ALA 525   5.976   7.807   2.763
  134    HB1  ALA 525           1HB      ALA 525   7.232   7.700   4.595
  135    HB2  ALA 525           2HB      ALA 525   8.708   7.463   3.655
  136    HB3  ALA 525           3HB      ALA 525   7.677   6.085   4.042
  137    H    ALA 526           H        ALA 526   7.365   7.151   0.001
  138    HA   ALA 526           HA       ALA 526   8.671   8.237  -1.508
  139    HB1  ALA 526           1HB      ALA 526   7.862  10.297  -2.018
  140    HB2  ALA 526           2HB      ALA 526   7.960  10.867  -0.351
  141    HB3  ALA 526           3HB      ALA 526   6.632   9.819  -0.850
  142    H    ILE 527           H        ILE 527   9.704   7.785   1.357
  143    HA   ILE 527           HA       ILE 527  11.470   9.785   2.097
  144    HB   ILE 527           HB       ILE 527  12.874   7.679   2.907
  145   HG12  ILE 527          2HG1      ILE 527  11.546   5.728   3.310
  146   HG13  ILE 527          1HG1      ILE 527  10.103   6.510   2.681
  147   HG21  ILE 527          1HG2      ILE 527  10.277   8.656   4.054
  148   HG22  ILE 527          2HG2      ILE 527  11.901   9.248   4.406
  149   HG23  ILE 527          3HG2      ILE 527  11.419   7.634   4.929
  150   HD11  ILE 527          3HD1      ILE 527  11.411   4.788   1.240
  151   HD12  ILE 527          1HD1      ILE 527  12.470   6.159   0.912
  152   HD13  ILE 527          2HD1      ILE 527  10.759   6.248   0.496
  153    H    GLY 528           H        GLY 528  11.649   7.614  -0.577
  154    HA2  GLY 528           2HA      GLY 528  13.506   8.860  -2.061
  155    HA3  GLY 528           1HA      GLY 528  14.513   7.966  -0.934
  156    H    LEU 529           H        LEU 529  13.214   5.600  -0.706
  157    HA   LEU 529           HA       LEU 529  12.781   3.586  -1.675
  158    HB2  LEU 529           2HB      LEU 529  12.357   5.301  -4.102
  159    HB3  LEU 529           1HB      LEU 529  12.272   3.556  -4.175
  160    HG   LEU 529           HG       LEU 529  10.347   3.489  -2.791
  161   HD11  LEU 529          1HD1      LEU 529   9.389   5.578  -1.811
  162   HD12  LEU 529          2HD1      LEU 529  10.889   6.400  -2.240
  163   HD13  LEU 529          3HD1      LEU 529  10.914   5.063  -1.090
  164   HD21  LEU 529          3HD2      LEU 529   9.008   5.513  -4.001
  165   HD22  LEU 529          1HD2      LEU 529   9.360   3.956  -4.750
  166   HD23  LEU 529          2HD2      LEU 529  10.404   5.342  -5.064
  167    H    ALA 530           H        ALA 530  14.872   5.618  -3.643
  168    HA   ALA 530           HA       ALA 530  16.411   3.380  -4.523
  169    HB1  ALA 530           1HB      ALA 530  15.991   5.538  -5.812
  170    HB2  ALA 530           2HB      ALA 530  17.616   4.857  -5.860
  171    HB3  ALA 530           3HB      ALA 530  17.267   6.231  -4.813
  172    H    TRP 531           H        TRP 531  16.429   3.362  -1.798
  173    HA   TRP 531           HA       TRP 531  19.220   4.049  -1.155
  174    HB2  TRP 531           2HB      TRP 531  18.387   4.134   1.258
  175    HB3  TRP 531           1HB      TRP 531  17.858   5.451   0.215
  176    HD1  TRP 531           HD       TRP 531  15.351   4.975  -0.950
  177    HE1  TRP 531           1HE      TRP 531  13.258   4.078   0.197
  178    HE3  TRP 531           3HE      TRP 531  17.538   2.807   3.119
  179    HZ2  TRP 531           2HZ      TRP 531  12.589   2.642   2.554
  180    HZ3  TRP 531           3HZ      TRP 531  16.103   1.697   4.781
  181    HH2  TRP 531           HH       TRP 531  13.678   1.619   4.503
  182    H    ILE 532           H        ILE 532  16.860   1.658  -1.530
  183    HA   ILE 532           HA       ILE 532  18.477  -0.321  -0.063
  184    HB   ILE 532           HB       ILE 532  16.359  -1.689  -0.142
  185   HG12  ILE 532          2HG1      ILE 532  15.461   0.274  -1.804
  186   HG13  ILE 532          1HG1      ILE 532  14.449  -0.909  -0.991
  187   HG21  ILE 532          1HG2      ILE 532  15.274  -0.213   1.725
  188   HG22  ILE 532          2HG2      ILE 532  16.762   0.717   1.546
  189   HG23  ILE 532          3HG2      ILE 532  16.835  -0.993   1.979
  190   HD11  ILE 532          3HD1      ILE 532  14.132   0.709   0.853
  191   HD12  ILE 532          1HD1      ILE 532  13.498   1.255  -0.701
  192   HD13  ILE 532          2HD1      ILE 532  15.028   1.894  -0.100
  193    HA   PRO 533           HA       PRO 533  18.761  -2.484  -3.927
  194    HB2  PRO 533           2HB      PRO 533  19.206  -4.999  -3.110
  195    HB3  PRO 533           1HB      PRO 533  20.351  -3.694  -2.786
  196    HG2  PRO 533           2HG      PRO 533  18.519  -5.087  -0.941
  197    HG3  PRO 533           1HG      PRO 533  20.024  -4.224  -0.594
  198    HD2  PRO 533           2HD      PRO 533  17.329  -3.279  -0.310
  199    HD3  PRO 533           1HD      PRO 533  18.835  -2.409   0.040
  200    H    TYR 534           H        TYR 534  15.906  -2.758  -2.252
  201    HA   TYR 534           HA       TYR 534  14.524  -3.864  -4.430
  202    HB2  TYR 534           2HB      TYR 534  13.787  -6.022  -3.403
  203    HB3  TYR 534           1HB      TYR 534  15.481  -5.975  -3.875
  204    HD1  TYR 534           1HD      TYR 534  13.196  -5.731  -0.966
  205    HD2  TYR 534           2HD      TYR 534  17.188  -6.362  -2.295
  206    HE1  TYR 534           1HE      TYR 534  13.836  -6.418   1.305
  207    HE2  TYR 534           2HE      TYR 534  17.840  -7.051  -0.025
  208    HH   TYR 534           HH       TYR 534  16.854  -7.896   1.998
  209    H    PHE 535           H        PHE 535  14.479  -3.014  -1.016
  210    HA   PHE 535           HA       PHE 535  11.741  -3.341  -0.531
  211    HB2  PHE 535           2HB      PHE 535  13.492  -1.164   0.624
  212    HB3  PHE 535           1HB      PHE 535  11.968  -1.732   1.280
  213    HD1  PHE 535           2HD      PHE 535  15.453  -2.712   0.603
  214    HD2  PHE 535           1HD      PHE 535  11.890  -3.561   2.745
  215    HE1  PHE 535           2HE      PHE 535  16.689  -4.295   1.993
  216    HE2  PHE 535           1HE      PHE 535  13.119  -5.161   4.153
  217    HZ   PHE 535           HZ       PHE 535  15.526  -5.530   3.777
  218    H    GLY 536           H        GLY 536  13.422  -0.896  -2.345
  219    HA2  GLY 536           2HA      GLY 536  10.919   0.649  -2.550
  220    HA3  GLY 536           1HA      GLY 536  12.525   1.310  -2.805
  221    HA   PRO 537           HA       PRO 537  12.491   0.619  -7.143
  222    HB2  PRO 537           2HB      PRO 537  14.617  -1.450  -6.971
  223    HB3  PRO 537           1HB      PRO 537  14.584   0.055  -7.895
  224    HG2  PRO 537           2HG      PRO 537  16.075  -0.154  -5.700
  225    HG3  PRO 537           1HG      PRO 537  15.201   1.347  -6.062
  226    HD2  PRO 537           2HD      PRO 537  14.529  -0.818  -4.110
  227    HD3  PRO 537           1HD      PRO 537  14.370   0.941  -3.942
  228    H    ALA 538           H        ALA 538  12.819  -2.412  -5.338
  229    HA   ALA 538           HA       ALA 538  11.445  -3.910  -7.407
  230    HB1  ALA 538           1HB      ALA 538  13.373  -4.687  -5.781
  231    HB2  ALA 538           2HB      ALA 538  12.138  -5.810  -6.347
  232    HB3  ALA 538           3HB      ALA 538  12.010  -5.095  -4.740
  233    H    ALA 539           H        ALA 539  10.624  -2.165  -4.576
  234    HA   ALA 539           HA       ALA 539   8.387  -3.552  -3.646
  235    HB1  ALA 539           1HB      ALA 539   8.689  -1.915  -2.163
  236    HB2  ALA 539           2HB      ALA 539   7.743  -0.903  -3.253
  237    HB3  ALA 539           3HB      ALA 539   9.505  -0.885  -3.339
  238    H    GLU 540           H        GLU 540   6.168  -3.292  -4.017
  239    HA   GLU 540           HA       GLU 540   5.215  -1.698  -6.221
  240    HB2  GLU 540           2HB      GLU 540   4.980  -4.705  -6.409
  241    HB3  GLU 540           1HB      GLU 540   4.365  -3.529  -7.562
  242    HG2  GLU 540           2HG      GLU 540   6.716  -2.815  -7.976
  243    HG3  GLU 540           1HG      GLU 540   7.241  -4.157  -6.959
  244    H    GLY 541           H        GLY 541   4.605  -4.146  -3.774
  245    HA2  GLY 541           2HA      GLY 541   1.817  -3.187  -3.583
  246    HA3  GLY 541           1HA      GLY 541   2.328  -4.815  -3.156
  247    H    ILE 542           H        ILE 542   4.151  -1.949  -2.340
  248    HA   ILE 542           HA       ILE 542   3.176  -1.982   0.409
  249    HB   ILE 542           HB       ILE 542   6.137  -1.972   0.071
  250   HG12  ILE 542          2HG1      ILE 542   6.009  -4.516   0.534
  251   HG13  ILE 542          1HG1      ILE 542   4.384  -4.407  -0.136
  252   HG21  ILE 542          1HG2      ILE 542   6.178  -2.577   2.304
  253   HG22  ILE 542          2HG2      ILE 542   4.574  -3.307   2.243
  254   HG23  ILE 542          3HG2      ILE 542   4.746  -1.552   2.216
  255   HD11  ILE 542          3HD1      ILE 542   5.869  -3.093  -2.014
  256   HD12  ILE 542          1HD1      ILE 542   5.381  -4.787  -2.092
  257   HD13  ILE 542          2HD1      ILE 542   6.974  -4.357  -1.470
  258    H    TYR 543           H        TYR 543   5.108  -0.549  -2.133
  259    HA   TYR 543           HA       TYR 543   5.280   1.957  -0.687
  260    HB2  TYR 543           2HB      TYR 543   7.184   2.316  -1.842
  261    HB3  TYR 543           1HB      TYR 543   7.130   0.585  -2.086
  262    HD1  TYR 543           1HD      TYR 543   5.724  -0.151  -4.220
  263    HD2  TYR 543           2HD      TYR 543   7.541   3.655  -3.685
  264    HE1  TYR 543           1HE      TYR 543   5.726   0.182  -6.652
  265    HE2  TYR 543           2HE      TYR 543   7.552   4.002  -6.115
  266    HH   TYR 543           HH       TYR 543   7.498   2.644  -8.172
  267    H    ILE 544           H        ILE 544   3.941   0.516  -3.589
  268    HA   ILE 544           HA       ILE 544   2.669   1.339  -5.309
  269    HB   ILE 544           HB       ILE 544   1.104   2.541  -3.037
  270   HG12  ILE 544          2HG1      ILE 544  -0.046   0.292  -2.990
  271   HG13  ILE 544          1HG1      ILE 544   1.293  -0.329  -3.950
  272   HG21  ILE 544          1HG2      ILE 544   0.057   3.157  -5.008
  273   HG22  ILE 544          2HG2      ILE 544  -0.780   1.665  -4.584
  274   HG23  ILE 544          3HG2      ILE 544   0.477   1.650  -5.820
  275   HD11  ILE 544          3HD1      ILE 544   2.033   1.105  -1.490
  276   HD12  ILE 544          1HD1      ILE 544   2.692  -0.371  -2.195
  277   HD13  ILE 544          2HD1      ILE 544   1.190  -0.429  -1.274
  278    H    GLU 545           H        GLU 545   2.277   3.969  -2.985
  279    HA   GLU 545           HA       GLU 545   2.556   6.216  -3.126
  280    HB2  GLU 545           2HB      GLU 545   4.353   5.652  -5.477
  281    HB3  GLU 545           1HB      GLU 545   4.353   7.084  -4.453
  282    HG2  GLU 545           2HG      GLU 545   4.876   5.496  -2.534
  283    HG3  GLU 545           1HG      GLU 545   5.242   4.304  -3.779
  284    H    GLY 546           H        GLY 546   0.382   4.999  -4.434
  285    HA2  GLY 546           2HA      GLY 546  -0.273   7.145  -6.300
  286    HA3  GLY 546           1HA      GLY 546  -0.390   5.501  -6.912
  287    H    LEU 547           H        LEU 547  -1.105   5.781  -3.596
  288    HA   LEU 547           HA       LEU 547  -3.901   6.397  -3.911
  289    HB2  LEU 547           2HB      LEU 547  -4.861   4.323  -3.582
  290    HB3  LEU 547           1HB      LEU 547  -3.556   3.993  -4.703
  291    HG   LEU 547           HG       LEU 547  -3.545   3.434  -1.736
  292   HD11  LEU 547          1HD1      LEU 547  -4.772   1.985  -3.642
  293   HD12  LEU 547          2HD1      LEU 547  -4.035   1.285  -2.201
  294   HD13  LEU 547          3HD1      LEU 547  -3.149   1.298  -3.727
  295   HD21  LEU 547          3HD2      LEU 547  -1.327   3.694  -1.964
  296   HD22  LEU 547          1HD2      LEU 547  -1.394   3.602  -3.724
  297   HD23  LEU 547          2HD2      LEU 547  -1.404   2.124  -2.763
  298    H    MET 548           H        MET 548  -1.192   5.844  -1.898
  299    HA   MET 548           HA       MET 548  -2.501   5.556   0.581
  300    HB2  MET 548           2HB      MET 548  -0.201   6.536   1.423
  301    HB3  MET 548           1HB      MET 548  -0.313   4.908   0.777
  302    HG2  MET 548           2HG      MET 548   1.645   6.112  -0.050
  303    HG3  MET 548           1HG      MET 548   0.554   5.647  -1.352
  304    HE1  MET 548           3HE      MET 548   0.509   6.756  -3.056
  305    HE2  MET 548           1HE      MET 548   1.601   8.132  -3.203
  306    HE3  MET 548           2HE      MET 548  -0.145   8.381  -3.264
  307    H    HIS 549           H        HIS 549  -4.122   7.322  -0.104
  308    HA   HIS 549           HA       HIS 549  -3.234   9.840   1.134
  309    HB2  HIS 549           2HB      HIS 549  -5.434  10.187  -0.751
  310    HB3  HIS 549           1HB      HIS 549  -3.943  11.102  -0.586
  311    HD1  HIS 549           1HD      HIS 549  -5.577   9.634  -3.153
  312    HD2  HIS 549           2HD      HIS 549  -1.772   8.969  -1.626
  313    HE1  HIS 549           1HE      HIS 549  -4.275   8.588  -5.030
  314    HE2  HIS 549           2HE      HIS 549  -1.949   8.276  -4.112
  315    H    ASN 550           H        ASN 550  -4.502   7.557   2.349
  316    HA   ASN 550           HA       ASN 550  -6.186   7.043   3.790
  317    HB2  ASN 550           2HB      ASN 550  -6.559  10.042   3.700
  318    HB3  ASN 550           1HB      ASN 550  -7.394   8.979   4.828
  319   HD21  ASN 550          1HD2      ASN 550  -5.023  11.095   4.715
  320   HD22  ASN 550          2HD2      ASN 550  -3.920  10.432   5.867
  321    H    GLN 551           H        GLN 551  -7.329   5.854   2.224
  322    HA   GLN 551           HA       GLN 551  -9.646   7.235   1.065
  323    HB2  GLN 551           2HB      GLN 551  -9.233   4.630  -0.087
  324    HB3  GLN 551           1HB      GLN 551  -9.283   6.197  -0.873
  325    HG2  GLN 551           2HG      GLN 551  -7.152   5.899  -1.382
  326    HG3  GLN 551           1HG      GLN 551  -6.780   6.126   0.323
  327   HE21  GLN 551          1HE2      GLN 551  -7.117   4.054   1.652
  328   HE22  GLN 551          2HE2      GLN 551  -6.476   2.608   0.963
  329    H    ASP 552           H        ASP 552  -9.022   3.829   1.642
  330    HA   ASP 552           HA       ASP 552 -10.124   2.230   2.825
  331    HB2  ASP 552           2HB      ASP 552 -10.542   4.647   4.378
  332    HB3  ASP 552           1HB      ASP 552 -11.918   3.557   4.512
  333    H    GLY 553           H        GLY 553 -11.359   3.970   0.510
  334    HA2  GLY 553           2HA      GLY 553 -14.083   2.855   0.773
  335    HA3  GLY 553           1HA      GLY 553 -13.720   4.342  -0.095
  336    H    LEU 554           H        LEU 554 -11.301   3.289  -1.304
  337    HA   LEU 554           HA       LEU 554 -12.522   1.955  -3.555
  338    HB2  LEU 554           2HB      LEU 554 -10.283   2.174  -4.570
  339    HB3  LEU 554           1HB      LEU 554 -10.939   3.697  -4.003
  340    HG   LEU 554           HG       LEU 554  -9.445   2.825  -1.835
  341   HD11  LEU 554          1HD1      LEU 554  -7.646   2.464  -4.192
  342   HD12  LEU 554          2HD1      LEU 554  -8.583   1.096  -3.590
  343   HD13  LEU 554          3HD1      LEU 554  -7.445   1.923  -2.526
  344   HD21  LEU 554          3HD2      LEU 554  -7.800   4.558  -2.691
  345   HD22  LEU 554          1HD2      LEU 554  -9.468   5.092  -2.488
  346   HD23  LEU 554          2HD2      LEU 554  -8.851   4.720  -4.097
  347    H    ILE 555           H        ILE 555 -11.391   0.864  -0.689
  348    HA   ILE 555           HA       ILE 555 -10.824  -1.785  -1.772
  349    HB   ILE 555           HB       ILE 555  -8.943  -2.085  -0.209
  350   HG12  ILE 555          2HG1      ILE 555  -9.591  -0.336   1.420
  351   HG13  ILE 555          1HG1      ILE 555  -7.927  -0.179   0.896
  352   HG21  ILE 555          1HG2      ILE 555  -7.544  -1.510  -1.832
  353   HG22  ILE 555          2HG2      ILE 555  -7.884   0.208  -1.613
  354   HG23  ILE 555          3HG2      ILE 555  -8.925  -0.774  -2.645
  355   HD11  ILE 555          3HD1      ILE 555  -9.215   1.420  -0.874
  356   HD12  ILE 555          1HD1      ILE 555  -8.410   1.958   0.596
  357   HD13  ILE 555          2HD1      ILE 555 -10.147   1.662   0.602
  358    H    CYS 556           H        CYS 556 -11.457   0.245   1.036
  359    HA   CYS 556           HA       CYS 556 -12.652  -2.061   2.395
  360    HB2  CYS 556           2HB      CYS 556 -10.737  -0.289   3.298
  361    HB3  CYS 556           1HB      CYS 556 -12.217   0.346   4.008
  362    H    GLY 557           H        GLY 557 -14.335  -1.164   0.566
  363    HA2  GLY 557           2HA      GLY 557 -16.707  -0.676   1.661
  364    HA3  GLY 557           1HA      GLY 557 -16.013   0.935   1.708
  365    H    LEU 558           H        LEU 558 -15.695  -1.528  -0.830
  366    HA   LEU 558           HA       LEU 558 -17.186   0.270  -2.622
  367    HB2  LEU 558           2HB      LEU 558 -15.688  -0.245  -4.433
  368    HB3  LEU 558           1HB      LEU 558 -14.771   0.386  -3.081
  369    HG   LEU 558           HG       LEU 558 -15.005  -2.563  -3.644
  370   HD11  LEU 558          1HD1      LEU 558 -12.820  -0.682  -4.522
  371   HD12  LEU 558          2HD1      LEU 558 -14.017  -1.424  -5.583
  372   HD13  LEU 558          3HD1      LEU 558 -12.846  -2.433  -4.735
  373   HD21  LEU 558          3HD2      LEU 558 -12.645  -2.167  -2.403
  374   HD22  LEU 558          1HD2      LEU 558 -14.147  -2.541  -1.562
  375   HD23  LEU 558          2HD2      LEU 558 -13.601  -0.869  -1.688
  376    H    ARG 559           H        ARG 559 -16.178  -3.048  -1.951
  377    HA   ARG 559           HA       ARG 559 -18.700  -4.134  -2.504
  378    HB2  ARG 559           2HB      ARG 559 -18.371  -5.266  -4.585
  379    HB3  ARG 559           1HB      ARG 559 -17.976  -3.574  -4.849
  380    HG2  ARG 559           2HG      ARG 559 -15.640  -5.044  -4.040
  381    HG3  ARG 559           1HG      ARG 559 -16.400  -5.798  -5.444
  382    HD2  ARG 559           2HD      ARG 559 -16.363  -2.958  -5.788
  383    HD3  ARG 559           1HD      ARG 559 -14.747  -3.517  -5.361
  384    HE   ARG 559           HE       ARG 559 -14.594  -4.537  -7.404
  385   HH11  ARG 559          1HH1      ARG 559 -17.933  -3.718  -6.804
  386   HH12  ARG 559          2HH1      ARG 559 -18.452  -4.134  -8.402
  387   HH21  ARG 559          1HH2      ARG 559 -15.275  -5.085  -9.506
  388   HH22  ARG 559          2HH2      ARG 559 -16.944  -4.912  -9.936
  389    H    GLN 560           H        GLN 560 -16.667  -4.264  -0.569
  390    HA   GLN 560           HA       GLN 560 -15.843  -7.076  -0.702
  391    HB2  GLN 560           2HB      GLN 560 -14.235  -6.316   1.161
  392    HB3  GLN 560           1HB      GLN 560 -13.894  -5.825  -0.490
  393    HG2  GLN 560           2HG      GLN 560 -13.566  -4.037   1.201
  394    HG3  GLN 560           1HG      GLN 560 -14.687  -3.625  -0.094
  395   HE21  GLN 560          1HE2      GLN 560 -16.497  -2.704   0.503
  396   HE22  GLN 560          2HE2      GLN 560 -17.240  -2.822   2.059
  Start of MODEL   20
    1    H1   ALA 507           1HT      ALA 507 -14.208 -13.761  -0.834
    2    H2   ALA 507           2HT      ALA 507 -14.779 -15.224  -0.143
    3    H3   ALA 507           3HT      ALA 507 -13.732 -14.200   0.753
    4    HA   ALA 507           HA       ALA 507 -16.396 -13.407  -0.195
    5    HB1  ALA 507           1HB      ALA 507 -16.555 -15.318   1.343
    6    HB2  ALA 507           2HB      ALA 507 -17.206 -13.838   2.047
    7    HB3  ALA 507           3HB      ALA 507 -15.614 -14.420   2.535
    8    H    GLN 508           H        GLN 508 -16.290 -11.277  -0.386
    9    HA   GLN 508           HA       GLN 508 -16.217  -9.103   0.322
   10    HB2  GLN 508           2HB      GLN 508 -14.553  -9.927   2.698
   11    HB3  GLN 508           1HB      GLN 508 -15.472  -8.443   2.481
   12    HG2  GLN 508           2HG      GLN 508 -17.070 -10.892   2.326
   13    HG3  GLN 508           1HG      GLN 508 -16.312 -10.603   3.891
   14   HE21  GLN 508          1HE2      GLN 508 -17.464  -8.223   1.560
   15   HE22  GLN 508          2HE2      GLN 508 -18.677  -7.540   2.583
   16    HA   PRO 509           HA       PRO 509 -11.984  -9.312  -1.563
   17    HB2  PRO 509           2HB      PRO 509 -13.295  -8.083  -3.866
   18    HB3  PRO 509           1HB      PRO 509 -12.376  -9.585  -3.795
   19    HG2  PRO 509           2HG      PRO 509 -15.041  -9.538  -4.202
   20    HG3  PRO 509           1HG      PRO 509 -14.245 -10.844  -3.302
   21    HD2  PRO 509           2HD      PRO 509 -15.715  -8.442  -2.247
   22    HD3  PRO 509           1HD      PRO 509 -15.818 -10.139  -1.730
   23    H    LYS 510           H        LYS 510 -12.108  -7.619   0.260
   24    HA   LYS 510           HA       LYS 510 -11.651  -4.994  -0.951
   25    HB2  LYS 510           2HB      LYS 510 -13.508  -5.564   1.351
   26    HB3  LYS 510           1HB      LYS 510 -12.975  -3.954   0.894
   27    HG2  LYS 510           2HG      LYS 510 -14.905  -3.970  -0.272
   28    HG3  LYS 510           1HG      LYS 510 -13.909  -4.796  -1.472
   29    HD2  LYS 510           2HD      LYS 510 -14.642  -6.965  -0.525
   30    HD3  LYS 510           1HD      LYS 510 -15.701  -6.096   0.580
   31    HE2  LYS 510           2HE      LYS 510 -16.699  -5.035  -1.534
   32    HE3  LYS 510           1HE      LYS 510 -15.878  -6.331  -2.404
   33    HZ1  LYS 510           3HZ      LYS 510 -17.992  -6.598  -0.342
   34    HZ2  LYS 510           1HZ      LYS 510 -17.071  -7.905  -0.893
   35    HZ3  LYS 510           2HZ      LYS 510 -18.067  -7.062  -1.967
   36    H    CYS 511           H        CYS 511 -11.081  -3.481   1.159
   37    HA   CYS 511           HA       CYS 511  -9.246  -2.932   2.411
   38    HB2  CYS 511           2HB      CYS 511 -10.788  -5.010   3.747
   39    HB3  CYS 511           1HB      CYS 511  -9.114  -4.974   4.289
   40    H    ASN 512           H        ASN 512  -8.101  -3.698   0.318
   41    HA   ASN 512           HA       ASN 512  -6.417  -6.015   0.716
   42    HB2  ASN 512           2HB      ASN 512  -6.410  -4.109  -1.619
   43    HB3  ASN 512           1HB      ASN 512  -5.696  -5.714  -1.556
   44   HD21  ASN 512          1HD2      ASN 512  -8.793  -4.012  -1.303
   45   HD22  ASN 512          2HD2      ASN 512  -9.745  -5.291  -1.962
   46    HA   PRO 513           HA       PRO 513  -3.122  -2.664   1.060
   47    HB2  PRO 513           2HB      PRO 513  -3.672  -0.175   0.183
   48    HB3  PRO 513           1HB      PRO 513  -3.338  -1.515  -0.916
   49    HG2  PRO 513           2HG      PRO 513  -5.844  -0.110  -0.499
   50    HG3  PRO 513           1HG      PRO 513  -5.435  -1.310  -1.733
   51    HD2  PRO 513           2HD      PRO 513  -6.812  -1.672   0.847
   52    HD3  PRO 513           1HD      PRO 513  -6.840  -2.689  -0.607
   53    H    ASN 514           H        ASN 514  -5.697  -2.676   2.822
   54    HA   ASN 514           HA       ASN 514  -4.984  -0.353   4.484
   55    HB2  ASN 514           2HB      ASN 514  -7.582  -1.487   3.673
   56    HB3  ASN 514           1HB      ASN 514  -7.453  -1.135   5.393
   57   HD21  ASN 514          1HD2      ASN 514  -7.292   0.234   2.167
   58   HD22  ASN 514          2HD2      ASN 514  -7.567   1.868   2.650
   59    H    LEU 515           H        LEU 515  -3.425  -2.490   4.663
   60    HA   LEU 515           HA       LEU 515  -4.367  -4.125   6.893
   61    HB2  LEU 515           2HB      LEU 515  -1.719  -4.573   5.633
   62    HB3  LEU 515           1HB      LEU 515  -2.871  -5.735   6.252
   63    HG   LEU 515           HG       LEU 515  -2.904  -6.155   3.980
   64   HD11  LEU 515          1HD1      LEU 515  -5.029  -4.098   3.809
   65   HD12  LEU 515          2HD1      LEU 515  -5.177  -5.324   5.068
   66   HD13  LEU 515          3HD1      LEU 515  -5.062  -5.808   3.376
   67   HD21  LEU 515          3HD2      LEU 515  -2.114  -4.759   2.435
   68   HD22  LEU 515          1HD2      LEU 515  -1.785  -3.628   3.748
   69   HD23  LEU 515          2HD2      LEU 515  -3.297  -3.520   2.849
   70    H    HIS 516           H        HIS 516  -1.418  -2.328   5.955
   71    HA   HIS 516           HA       HIS 516  -1.181  -1.012   8.427
   72    HB2  HIS 516           2HB      HIS 516   0.292  -2.258   9.674
   73    HB3  HIS 516           1HB      HIS 516  -0.626  -3.547   8.901
   74    HD1  HIS 516           1HD      HIS 516   0.590  -4.976   7.148
   75    HD2  HIS 516           2HD      HIS 516   2.899  -1.918   8.734
   76    HE1  HIS 516           1HE      HIS 516   2.909  -5.380   6.279
   77    HE2  HIS 516           2HE      HIS 516   4.333  -3.623   7.405
   78    H    TYR 517           H        TYR 517   0.992  -2.527   6.026
   79    HA   TYR 517           HA       TYR 517   2.943  -0.569   6.040
   80    HB2  TYR 517           2HB      TYR 517   2.930  -1.491   3.393
   81    HB3  TYR 517           1HB      TYR 517   3.966  -2.005   4.706
   82    HD1  TYR 517           2HD      TYR 517   0.310  -2.806   4.400
   83    HD2  TYR 517           1HD      TYR 517   4.319  -4.207   4.063
   84    HE1  TYR 517           2HE      TYR 517  -0.511  -5.106   4.157
   85    HE2  TYR 517           1HE      TYR 517   3.496  -6.506   3.802
   86    HH   TYR 517           HH       TYR 517   1.257  -7.758   4.574
   87    H    TRP 518           H        TRP 518  -0.178  -0.354   4.621
   88    HA   TRP 518           HA       TRP 518   0.724   2.037   3.155
   89    HB2  TRP 518           2HB      TRP 518  -1.837   0.759   2.375
   90    HB3  TRP 518           1HB      TRP 518  -0.635   1.554   1.389
   91    HD1  TRP 518           HD       TRP 518   0.735  -1.293   3.425
   92    HE1  TRP 518           1HE      TRP 518   1.173  -3.275   1.933
   93    HE3  TRP 518           3HE      TRP 518  -1.623   0.360  -0.787
   94    HZ2  TRP 518           2HZ      TRP 518   0.572  -4.108  -0.703
   95    HZ3  TRP 518           3HZ      TRP 518  -1.643  -1.106  -2.764
   96    HH2  TRP 518           HH       TRP 518  -0.561  -3.294  -2.723
   97    H    THR 519           H        THR 519  -1.554   0.720   5.390
   98    HA   THR 519           HA       THR 519  -3.321   2.977   5.396
   99    HB   THR 519           HB       THR 519  -4.292   0.919   6.038
  100    HG1  THR 519           1HG      THR 519  -3.816   2.253   8.490
  101   HG21  THR 519          3HG2      THR 519  -3.081   0.195   8.464
  102   HG22  THR 519          1HG2      THR 519  -1.779   0.410   7.292
  103   HG23  THR 519          2HG2      THR 519  -3.106  -0.701   6.946
  104    H    THR 520           H        THR 520  -0.334   2.219   6.885
  105    HA   THR 520           HA       THR 520  -0.700   4.270   8.947
  106    HB   THR 520           HB       THR 520   1.017   1.894   8.649
  107    HG1  THR 520           1HG      THR 520  -0.058   1.626  10.413
  108   HG21  THR 520          3HG2      THR 520   2.165   4.449   9.695
  109   HG22  THR 520          1HG2      THR 520   2.912   3.233   8.659
  110   HG23  THR 520          2HG2      THR 520   2.647   2.893  10.371
  111    H    GLN 521           H        GLN 521   2.046   3.317   6.919
  112    HA   GLN 521           HA       GLN 521   2.713   6.144   6.612
  113    HB2  GLN 521           2HB      GLN 521   4.940   5.454   6.152
  114    HB3  GLN 521           1HB      GLN 521   4.390   4.495   7.516
  115    HG2  GLN 521           2HG      GLN 521   4.391   2.553   6.343
  116    HG3  GLN 521           1HG      GLN 521   4.078   3.345   4.806
  117   HE21  GLN 521          1HE2      GLN 521   6.052   5.146   4.543
  118   HE22  GLN 521          2HE2      GLN 521   7.596   4.377   4.530
  119    H    ASP 522           H        ASP 522   4.333   5.855   4.343
  120    HA   ASP 522           HA       ASP 522   2.274   5.778   2.273
  121    HB2  ASP 522           2HB      ASP 522   5.082   6.863   2.279
  122    HB3  ASP 522           1HB      ASP 522   4.007   6.910   0.887
  123    H    GLU 523           H        GLU 523   3.395   3.341   3.374
  124    HA   GLU 523           HA       GLU 523   4.074   1.282   2.677
  125    HB2  GLU 523           2HB      GLU 523   3.898   2.383  -0.125
  126    HB3  GLU 523           1HB      GLU 523   3.766   0.702   0.376
  127    HG2  GLU 523           2HG      GLU 523   1.640   0.979   1.225
  128    HG3  GLU 523           1HG      GLU 523   1.833   2.722   1.405
  129    H    GLY 524           H        GLY 524   5.921   3.766   2.819
  130    HA2  GLY 524           2HA      GLY 524   8.313   3.340   3.114
  131    HA3  GLY 524           1HA      GLY 524   8.252   2.416   1.620
  132    H    ALA 525           H        ALA 525   6.445   5.362   1.806
  133    HA   ALA 525           HA       ALA 525   8.273   6.524  -0.143
  134    HB1  ALA 525           1HB      ALA 525   5.603   6.296  -0.257
  135    HB2  ALA 525           2HB      ALA 525   6.518   7.538  -1.110
  136    HB3  ALA 525           3HB      ALA 525   5.747   7.913   0.432
  137    H    ALA 526           H        ALA 526   7.836   6.707   3.124
  138    HA   ALA 526           HA       ALA 526   8.220   9.529   3.387
  139    HB1  ALA 526           1HB      ALA 526   6.986   8.835   5.173
  140    HB2  ALA 526           2HB      ALA 526   8.601   8.722   5.873
  141    HB3  ALA 526           3HB      ALA 526   7.802   7.274   5.261
  142    H    ILE 527           H        ILE 527  10.213   7.737   2.021
  143    HA   ILE 527           HA       ILE 527  12.569   8.600   3.534
  144    HB   ILE 527           HB       ILE 527  13.401   6.356   2.170
  145   HG12  ILE 527          2HG1      ILE 527  10.912   5.890   1.841
  146   HG13  ILE 527          1HG1      ILE 527  11.877   4.585   2.517
  147   HG21  ILE 527          1HG2      ILE 527  12.601   6.719   5.045
  148   HG22  ILE 527          2HG2      ILE 527  14.205   6.914   4.335
  149   HG23  ILE 527          3HG2      ILE 527  13.478   5.311   4.447
  150   HD11  ILE 527          3HD1      ILE 527  10.813   6.215   4.619
  151   HD12  ILE 527          1HD1      ILE 527  10.576   4.496   4.302
  152   HD13  ILE 527          2HD1      ILE 527   9.526   5.688   3.535
  153    H    GLY 528           H        GLY 528  11.683   7.122   0.389
  154    HA2  GLY 528           2HA      GLY 528  12.068   9.036  -1.400
  155    HA3  GLY 528           1HA      GLY 528  13.731   8.750  -0.908
  156    H    LEU 529           H        LEU 529  12.957   5.843  -0.469
  157    HA   LEU 529           HA       LEU 529  12.867   3.870  -1.604
  158    HB2  LEU 529           2HB      LEU 529  11.986   5.667  -3.828
  159    HB3  LEU 529           1HB      LEU 529  12.196   3.946  -4.053
  160    HG   LEU 529           HG       LEU 529  10.439   3.461  -2.491
  161   HD11  LEU 529          1HD1      LEU 529  10.473   6.422  -1.953
  162   HD12  LEU 529          2HD1      LEU 529  10.801   5.114  -0.818
  163   HD13  LEU 529          3HD1      LEU 529   9.169   5.349  -1.444
  164   HD21  LEU 529          3HD2      LEU 529   8.553   4.419  -3.640
  165   HD22  LEU 529          1HD2      LEU 529   9.820   4.063  -4.811
  166   HD23  LEU 529          2HD2      LEU 529   9.554   5.722  -4.277
  167    H    ALA 530           H        ALA 530  14.807   6.463  -2.663
  168    HA   ALA 530           HA       ALA 530  16.421   4.873  -4.414
  169    HB1  ALA 530           1HB      ALA 530  17.984   6.990  -4.068
  170    HB2  ALA 530           2HB      ALA 530  16.477   7.687  -3.470
  171    HB3  ALA 530           3HB      ALA 530  16.561   7.041  -5.110
  172    H    TRP 531           H        TRP 531  16.345   5.625  -1.085
  173    HA   TRP 531           HA       TRP 531  19.017   5.097  -0.351
  174    HB2  TRP 531           2HB      TRP 531  18.069   4.842   1.926
  175    HB3  TRP 531           1HB      TRP 531  17.430   6.271   1.121
  176    HD1  TRP 531           HD       TRP 531  14.967   5.688  -0.230
  177    HE1  TRP 531           1HE      TRP 531  12.964   4.469   0.755
  178    HE3  TRP 531           3HE      TRP 531  17.308   3.286   3.624
  179    HZ2  TRP 531           2HZ      TRP 531  12.406   2.713   2.913
  180    HZ3  TRP 531           3HZ      TRP 531  15.963   1.859   5.110
  181    HH2  TRP 531           HH       TRP 531  13.562   1.579   4.760
  182    H    ILE 532           H        ILE 532  16.420   3.129  -1.345
  183    HA   ILE 532           HA       ILE 532  17.828   0.708  -0.474
  184    HB   ILE 532           HB       ILE 532  15.520  -0.346  -0.562
  185   HG12  ILE 532          2HG1      ILE 532  14.800   2.576  -0.720
  186   HG13  ILE 532          1HG1      ILE 532  14.213   1.256  -1.721
  187   HG21  ILE 532          1HG2      ILE 532  16.316   1.709   1.475
  188   HG22  ILE 532          2HG2      ILE 532  16.594  -0.033   1.525
  189   HG23  ILE 532          3HG2      ILE 532  14.963   0.605   1.722
  190   HD11  ILE 532          3HD1      ILE 532  12.503   0.899  -0.359
  191   HD12  ILE 532          1HD1      ILE 532  12.944   2.399   0.450
  192   HD13  ILE 532          2HD1      ILE 532  13.545   0.858   1.060
  193    HA   PRO 533           HA       PRO 533  17.810  -0.112  -4.849
  194    HB2  PRO 533           2HB      PRO 533  19.219  -2.373  -4.833
  195    HB3  PRO 533           1HB      PRO 533  19.957  -0.834  -4.377
  196    HG2  PRO 533           2HG      PRO 533  19.019  -3.072  -2.644
  197    HG3  PRO 533           1HG      PRO 533  20.432  -2.022  -2.455
  198    HD2  PRO 533           2HD      PRO 533  17.981  -1.725  -1.142
  199    HD3  PRO 533           1HD      PRO 533  19.244  -0.487  -1.276
  200    H    TYR 534           H        TYR 534  16.343  -2.245  -2.514
  201    HA   TYR 534           HA       TYR 534  14.756  -3.402  -4.689
  202    HB2  TYR 534           2HB      TYR 534  14.863  -5.630  -3.575
  203    HB3  TYR 534           1HB      TYR 534  16.401  -5.084  -4.237
  204    HD1  TYR 534           2HD      TYR 534  14.469  -5.386  -1.082
  205    HD2  TYR 534           1HD      TYR 534  18.300  -4.895  -2.865
  206    HE1  TYR 534           2HE      TYR 534  15.526  -5.732   1.111
  207    HE2  TYR 534           1HE      TYR 534  19.369  -5.239  -0.676
  208    HH   TYR 534           HH       TYR 534  18.893  -6.239   1.469
  209    H    PHE 535           H        PHE 535  14.935  -2.405  -1.347
  210    HA   PHE 535           HA       PHE 535  12.537  -3.501  -0.429
  211    HB2  PHE 535           2HB      PHE 535  13.851  -0.900   0.352
  212    HB3  PHE 535           1HB      PHE 535  12.549  -1.665   1.248
  213    HD1  PHE 535           2HD      PHE 535  12.952  -3.763   2.460
  214    HD2  PHE 535           1HD      PHE 535  16.094  -1.665   0.508
  215    HE1  PHE 535           2HE      PHE 535  14.608  -5.029   3.766
  216    HE2  PHE 535           1HE      PHE 535  17.750  -2.917   1.809
  217    HZ   PHE 535           HZ       PHE 535  17.013  -4.606   3.441
  218    H    GLY 536           H        GLY 536  13.146  -0.417  -2.075
  219    HA2  GLY 536           2HA      GLY 536  10.229  -0.017  -2.232
  220    HA3  GLY 536           1HA      GLY 536  11.425   1.264  -2.341
  221    HA   PRO 537           HA       PRO 537  11.806   1.161  -6.725
  222    HB2  PRO 537           2HB      PRO 537  14.372  -0.354  -6.627
  223    HB3  PRO 537           1HB      PRO 537  13.988   1.157  -7.461
  224    HG2  PRO 537           2HG      PRO 537  15.417   1.173  -5.217
  225    HG3  PRO 537           1HG      PRO 537  14.211   2.434  -5.528
  226    HD2  PRO 537           2HD      PRO 537  14.073   0.083  -3.698
  227    HD3  PRO 537           1HD      PRO 537  13.396   1.713  -3.499
  228    H    ALA 538           H        ALA 538  12.905  -1.910  -5.313
  229    HA   ALA 538           HA       ALA 538  11.943  -3.433  -7.576
  230    HB1  ALA 538           1HB      ALA 538  12.943  -4.439  -4.914
  231    HB2  ALA 538           2HB      ALA 538  13.960  -4.117  -6.318
  232    HB3  ALA 538           3HB      ALA 538  12.733  -5.381  -6.389
  233    H    ALA 539           H        ALA 539  10.848  -2.552  -4.378
  234    HA   ALA 539           HA       ALA 539   8.877  -4.397  -3.846
  235    HB1  ALA 539           1HB      ALA 539   7.694  -2.089  -3.020
  236    HB2  ALA 539           2HB      ALA 539   9.390  -1.611  -3.113
  237    HB3  ALA 539           3HB      ALA 539   8.912  -2.983  -2.113
  238    H    GLU 540           H        GLU 540   6.535  -4.267  -4.116
  239    HA   GLU 540           HA       GLU 540   5.552  -2.702  -6.361
  240    HB2  GLU 540           2HB      GLU 540   5.267  -5.708  -6.374
  241    HB3  GLU 540           1HB      GLU 540   4.739  -4.585  -7.619
  242    HG2  GLU 540           2HG      GLU 540   7.105  -3.990  -8.025
  243    HG3  GLU 540           1HG      GLU 540   7.579  -5.223  -6.856
  244    H    GLY 541           H        GLY 541   4.855  -5.196  -3.953
  245    HA2  GLY 541           2HA      GLY 541   2.121  -4.116  -3.711
  246    HA3  GLY 541           1HA      GLY 541   2.590  -5.754  -3.277
  247    H    ILE 542           H        ILE 542   4.650  -3.098  -2.451
  248    HA   ILE 542           HA       ILE 542   3.605  -2.980   0.275
  249    HB   ILE 542           HB       ILE 542   6.553  -3.251   0.027
  250   HG12  ILE 542          2HG1      ILE 542   6.195  -5.779   0.378
  251   HG13  ILE 542          1HG1      ILE 542   4.597  -5.503  -0.318
  252   HG21  ILE 542          1HG2      ILE 542   4.458  -3.532   2.073
  253   HG22  ILE 542          2HG2      ILE 542   6.126  -2.978   2.222
  254   HG23  ILE 542          3HG2      ILE 542   5.770  -4.705   2.178
  255   HD11  ILE 542          3HD1      ILE 542   6.259  -4.215  -2.081
  256   HD12  ILE 542          1HD1      ILE 542   5.590  -5.838  -2.286
  257   HD13  ILE 542          2HD1      ILE 542   7.204  -5.632  -1.605
  258    H    TYR 543           H        TYR 543   4.841  -1.393  -2.408
  259    HA   TYR 543           HA       TYR 543   5.497   0.911  -0.783
  260    HB2  TYR 543           2HB      TYR 543   7.466   1.203  -1.827
  261    HB3  TYR 543           1HB      TYR 543   7.339  -0.515  -2.097
  262    HD1  TYR 543           2HD      TYR 543   6.279  -1.269  -4.317
  263    HD2  TYR 543           1HD      TYR 543   7.747   2.659  -3.619
  264    HE1  TYR 543           2HE      TYR 543   6.439  -0.904  -6.740
  265    HE2  TYR 543           1HE      TYR 543   7.920   3.038  -6.037
  266    HH   TYR 543           HH       TYR 543   8.154   1.643  -8.110
  267    H    ILE 544           H        ILE 544   4.387  -0.258  -3.917
  268    HA   ILE 544           HA       ILE 544   3.277   0.735  -5.648
  269    HB   ILE 544           HB       ILE 544   1.530   1.768  -3.431
  270   HG12  ILE 544          2HG1      ILE 544   0.388  -0.559  -3.952
  271   HG13  ILE 544          1HG1      ILE 544   2.031  -1.012  -4.390
  272   HG21  ILE 544          1HG2      ILE 544   1.126   1.077  -6.316
  273   HG22  ILE 544          2HG2      ILE 544   0.699   2.557  -5.457
  274   HG23  ILE 544          3HG2      ILE 544  -0.225   1.081  -5.183
  275   HD11  ILE 544          3HD1      ILE 544   1.687  -1.645  -2.137
  276   HD12  ILE 544          1HD1      ILE 544   1.031  -0.063  -1.724
  277   HD13  ILE 544          2HD1      ILE 544   2.738  -0.234  -2.117
  278    H    GLU 545           H        GLU 545   2.725   3.179  -3.153
  279    HA   GLU 545           HA       GLU 545   3.193   5.403  -3.041
  280    HB2  GLU 545           2HB      GLU 545   4.826   5.140  -5.550
  281    HB3  GLU 545           1HB      GLU 545   4.980   6.339  -4.271
  282    HG2  GLU 545           2HG      GLU 545   5.294   3.550  -3.434
  283    HG3  GLU 545           1HG      GLU 545   6.543   4.162  -4.516
  284    H    GLY 546           H        GLY 546   0.977   4.260  -4.556
  285    HA2  GLY 546           2HA      GLY 546   0.358   6.653  -6.141
  286    HA3  GLY 546           1HA      GLY 546   0.119   5.069  -6.861
  287    H    LEU 547           H        LEU 547  -0.509   4.827  -3.592
  288    HA   LEU 547           HA       LEU 547  -3.275   5.744  -3.791
  289    HB2  LEU 547           2HB      LEU 547  -4.311   3.667  -3.454
  290    HB3  LEU 547           1HB      LEU 547  -3.157   3.433  -4.753
  291    HG   LEU 547           HG       LEU 547  -2.769   2.591  -1.880
  292   HD11  LEU 547          1HD1      LEU 547  -3.165   0.902  -4.343
  293   HD12  LEU 547          2HD1      LEU 547  -4.430   1.271  -3.171
  294   HD13  LEU 547          3HD1      LEU 547  -3.013   0.343  -2.678
  295   HD21  LEU 547          3HD2      LEU 547  -0.952   2.790  -4.192
  296   HD22  LEU 547          1HD2      LEU 547  -0.877   1.284  -3.276
  297   HD23  LEU 547          2HD2      LEU 547  -0.602   2.826  -2.464
  298    H    MET 548           H        MET 548  -0.589   4.900  -1.853
  299    HA   MET 548           HA       MET 548  -1.926   4.582   0.619
  300    HB2  MET 548           2HB      MET 548   0.455   5.279   1.513
  301    HB3  MET 548           1HB      MET 548   0.177   3.707   0.788
  302    HG2  MET 548           2HG      MET 548   2.238   4.612  -0.025
  303    HG3  MET 548           1HG      MET 548   1.081   4.565  -1.346
  304    HE1  MET 548           3HE      MET 548   0.942   5.972  -2.829
  305    HE2  MET 548           1HE      MET 548   2.267   7.129  -2.955
  306    HE3  MET 548           2HE      MET 548   0.624   7.700  -2.672
  307    H    HIS 549           H        HIS 549  -3.374   6.515   0.090
  308    HA   HIS 549           HA       HIS 549  -2.270   8.840   1.507
  309    HB2  HIS 549           2HB      HIS 549  -4.307   9.625  -0.406
  310    HB3  HIS 549           1HB      HIS 549  -2.695  10.281  -0.159
  311    HD1  HIS 549           1HD      HIS 549  -4.542   9.106  -2.798
  312    HD2  HIS 549           2HD      HIS 549  -0.796   8.053  -1.350
  313    HE1  HIS 549           1HE      HIS 549  -3.358   8.019  -4.731
  314    HE2  HIS 549           2HE      HIS 549  -1.040   7.534  -3.871
  315    H    ASN 550           H        ASN 550  -3.795   6.671   2.539
  316    HA   ASN 550           HA       ASN 550  -5.594   6.246   3.869
  317    HB2  ASN 550           2HB      ASN 550  -4.976   9.034   4.199
  318    HB3  ASN 550           1HB      ASN 550  -6.718   8.805   4.309
  319   HD21  ASN 550          1HD2      ASN 550  -7.471   8.335   6.236
  320   HD22  ASN 550          2HD2      ASN 550  -6.586   7.608   7.530
  321    H    GLN 551           H        GLN 551  -6.884   5.189   2.409
  322    HA   GLN 551           HA       GLN 551  -8.965   6.816   1.123
  323    HB2  GLN 551           2HB      GLN 551  -8.726   4.262  -0.157
  324    HB3  GLN 551           1HB      GLN 551  -8.556   5.864  -0.851
  325    HG2  GLN 551           2HG      GLN 551  -6.449   5.328  -1.266
  326    HG3  GLN 551           1HG      GLN 551  -6.154   5.471   0.463
  327   HE21  GLN 551          1HE2      GLN 551  -6.619   3.462   1.738
  328   HE22  GLN 551          2HE2      GLN 551  -6.171   1.953   1.032
  329    H    ASP 552           H        ASP 552  -8.590   3.356   1.585
  330    HA   ASP 552           HA       ASP 552  -9.908   1.776   2.559
  331    HB2  ASP 552           2HB      ASP 552  -9.601   3.513   4.509
  332    HB3  ASP 552           1HB      ASP 552 -11.301   3.855   4.207
  333    H    GLY 553           H        GLY 553 -10.846   3.669   0.326
  334    HA2  GLY 553           2HA      GLY 553 -13.695   2.908   0.459
  335    HA3  GLY 553           1HA      GLY 553 -13.155   4.425  -0.245
  336    H    LEU 554           H        LEU 554 -10.815   3.232  -1.483
  337    HA   LEU 554           HA       LEU 554 -12.110   2.175  -3.864
  338    HB2  LEU 554           2HB      LEU 554  -9.926   2.502  -4.905
  339    HB3  LEU 554           1HB      LEU 554 -10.490   3.959  -4.113
  340    HG   LEU 554           HG       LEU 554  -8.979   2.826  -2.131
  341   HD11  LEU 554          1HD1      LEU 554  -7.276   2.463  -4.555
  342   HD12  LEU 554          2HD1      LEU 554  -8.322   1.147  -4.020
  343   HD13  LEU 554          3HD1      LEU 554  -7.090   1.792  -2.935
  344   HD21  LEU 554          3HD2      LEU 554  -8.841   5.133  -2.675
  345   HD22  LEU 554          1HD2      LEU 554  -8.228   4.786  -4.292
  346   HD23  LEU 554          2HD2      LEU 554  -7.222   4.466  -2.879
  347    H    ILE 555           H        ILE 555 -11.244   0.771  -1.153
  348    HA   ILE 555           HA       ILE 555 -10.549  -1.750  -2.420
  349    HB   ILE 555           HB       ILE 555  -8.783  -2.181  -0.712
  350   HG12  ILE 555          2HG1      ILE 555  -9.428  -0.482   0.941
  351   HG13  ILE 555          1HG1      ILE 555  -7.761  -0.286   0.452
  352   HG21  ILE 555          1HG2      ILE 555  -8.582  -0.819  -3.113
  353   HG22  ILE 555          2HG2      ILE 555  -7.277  -1.616  -2.237
  354   HG23  ILE 555          3HG2      ILE 555  -7.577   0.107  -1.998
  355   HD11  ILE 555          3HD1      ILE 555  -8.287   1.857   0.254
  356   HD12  ILE 555          1HD1      ILE 555 -10.014   1.527   0.146
  357   HD13  ILE 555          2HD1      ILE 555  -8.994   1.367  -1.282
  358    H    CYS 556           H        CYS 556 -11.198   0.040   0.536
  359    HA   CYS 556           HA       CYS 556 -12.752  -2.236   1.548
  360    HB2  CYS 556           2HB      CYS 556 -10.604  -1.149   2.782
  361    HB3  CYS 556           1HB      CYS 556 -11.869  -0.102   3.418
  362    H    GLY 557           H        GLY 557 -13.942  -0.647  -0.267
  363    HA2  GLY 557           2HA      GLY 557 -16.012   0.640   1.329
  364    HA3  GLY 557           1HA      GLY 557 -15.135   1.694   0.239
  365    H    LEU 558           H        LEU 558 -14.833  -0.273  -1.870
  366    HA   LEU 558           HA       LEU 558 -16.777   0.264  -3.601
  367    HB2  LEU 558           2HB      LEU 558 -16.510  -2.247  -4.383
  368    HB3  LEU 558           1HB      LEU 558 -15.231  -1.069  -4.592
  369    HG   LEU 558           HG       LEU 558 -15.213  -2.680  -2.089
  370   HD11  LEU 558          1HD1      LEU 558 -15.365  -3.922  -4.636
  371   HD12  LEU 558          2HD1      LEU 558 -15.063  -4.662  -3.065
  372   HD13  LEU 558          3HD1      LEU 558 -13.713  -4.091  -4.044
  373   HD21  LEU 558          3HD2      LEU 558 -13.388  -1.065  -3.674
  374   HD22  LEU 558          1HD2      LEU 558 -12.699  -2.625  -3.225
  375   HD23  LEU 558          2HD2      LEU 558 -13.303  -1.536  -1.976
  376    H    ARG 559           H        ARG 559 -17.026  -2.445  -1.305
  377    HA   ARG 559           HA       ARG 559 -19.737  -2.062  -0.773
  378    HB2  ARG 559           2HB      ARG 559 -20.789  -3.875  -1.991
  379    HB3  ARG 559           1HB      ARG 559 -19.998  -2.796  -3.135
  380    HG2  ARG 559           2HG      ARG 559 -18.576  -5.196  -2.088
  381    HG3  ARG 559           1HG      ARG 559 -19.727  -5.345  -3.420
  382    HD2  ARG 559           2HD      ARG 559 -18.369  -3.391  -4.459
  383    HD3  ARG 559           1HD      ARG 559 -17.127  -3.872  -3.304
  384    HE   ARG 559           HE       ARG 559 -16.697  -5.716  -4.589
  385   HH11  ARG 559          1HH1      ARG 559 -19.771  -4.369  -5.548
  386   HH12  ARG 559          2HH1      ARG 559 -19.942  -5.413  -6.919
  387   HH21  ARG 559          1HH2      ARG 559 -16.921  -7.091  -6.392
  388   HH22  ARG 559          2HH2      ARG 559 -18.326  -6.960  -7.397
  389    H    GLN 560           H        GLN 560 -17.248  -2.753   0.441
  390    HA   GLN 560           HA       GLN 560 -17.262  -5.444   1.333
  391    HB2  GLN 560           2HB      GLN 560 -15.853  -4.278   3.285
  392    HB3  GLN 560           1HB      GLN 560 -15.180  -4.620   1.708
  393    HG2  GLN 560           2HG      GLN 560 -14.579  -2.393   2.500
  394    HG3  GLN 560           1HG      GLN 560 -15.528  -2.317   1.018
  395   HE21  GLN 560          1HE2      GLN 560 -17.355  -1.154   1.013
  396   HE22  GLN 560          2HE2      GLN 560 -18.063  -0.411   2.400