*HEADER    ANTIFREEZE PROTEIN                      21-FEB-12   2LQ0              
*TITLE     SOLUTION STRUCTURE OF DE NOVO DESIGNED ANTIFREEZE PEPTIDE 1M          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DE NOVO DESIGNED ANTIFREEZE PEPTIDE 1M;                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES                                                       
*KEYWDS    AFP, ANTIFREEZE PROTEIN                                               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    A.BHUNIA                                                              
*REVDAT   1   24-OCT-12 2LQ0    0                                                


 1 GLN HA 2 ARG  H 3.3 2.0
 1 GLN QB 2 ARG  H 3.5 2.0
 2 ARG QB 2 ARG  H 2.5 2.0
 2 ARG QG 2 ARG  H 3.7 2.0
 2 ARG QD 2 ARG  H 3.9 2.0
 2 ARG QB 3 SER  H 2.5 2.0
 2 ARG QG 3 SER  H 3.7 2.0
 2 ARG QD 3 SER  H 3.9 2.0
 2 ARG HA 3 SER  H 3.3 2.0
 3 SER QB 3 SER  H 2.5 2.0
 3 SER HA 4 ASN  H 3.3 2.0
 3 SER QB 4 ASN  H 2.5 2.0
 4 ASN QB 4 ASN  H 2.5 2.0
 4 ASN HA 5 PHE  H 3.3 2.0
 3 SER HA 5 PHE  H 4.2 2.0
 4 ASN QB 5 PHE  H 2.8 2.0
 5 PHE QB 5 PHE  H 2.5 2.0
 5 PHE HA 6 HIS  H 3.3 2.0
 4 ASN  HA 6 HIS  H 4.2 2.0
 5 PHE QB 6 HIS  H 2.5 2.0
 6 HIS QB 6 HIS  H 2.5 2.0
 7 PRO QB 8 LEU  H 3.3 2.0
 7 PRO QD 8 LEU  H 3.6 2.0
 7 PRO QD 8 LEU  HA 5.0 2.0
 6 HIS  HA 8 LEU  H 4.2 2.0
 5 PHE HA 8 LEU  H 3.3 2.0
 8 LEU QB 8 LEU  H 2.5 2.0
 8 LEU QQD 8 LEU  H 3.6 2.0
 4 ASN QB 8 LEU  H 4.5 2.0
 6 HIS QB 8 LEU  H 4.6 2.0
 8 LEU HA 9 ALA  H 3.3 2.0
 8 LEU QB 9 ALA  H 2.9 2.0
 8 LEU QQD 9 ALA  H 3.6 2.0
 9 ALA QB 9 ALA  H 2.5 2.0
 6 HIS HA 9 ALA  H 3.6 2.0
 5 PHE HA 9 ALA  H 4.0 2.0
 6 HIS QB 9 ALA  H 4.7 2.0
 9 ALA HA 10 ALA H 3.3 2.0
 9 ALA QB 10 ALA H 2.5 2.0
10 ALA QB 10 ALA H 2.5 2.0
 8 LEU HA 10 ALA H 4.1 2.0
10 ALA HA 11 SER H 3.3 2.0
10 ALA QB 11 SER  H 2.5 2.0
11 SER QB 11 SER H 2.5 2.0
 8 LEU HA 11 SER H 3.3 2.0
 8 LEU QQD 11 SER H 4.5 2.0
11 SER     HA 12 PHE H 3.3 2.0
11 SER QB 12 PHE H 2.5 2.0
12 PHE QB 12 PHE H 2.5 2.0
 8 LEU HA 12 PHE H 4.0 2.0
 8 LEU QQD 12 PHE H 4.0 2.0
 9 ALA QB 12 PHE H 4.7 2.0
10 ALA QB 12 PHE H 5.0 2.0
12 PHE HA 13 ILE H 3.3 2.0
10 ALA HA 13 ILE H 3.3 2.0
 9 ALA HA 13 ILE H 4.0 2.0
11 SER HA 13 ILE H 4.0 2.0
11 SER QB 13 ILE H 4.3 2.0
12 PHE QB 13 ILE H 2.8 2.0
13 ILE HB 13 ILE H 2.5 2.0
13 ILE QG1 13 ILE H 4.2 2.0
13 ILE     HG23 13 ILE H 4.1 2.0
13 ILE QD1 13 ILE  H 4.5 2.0
 9 ALA QB 13 ILE H 4.3 2.0
10 ALA QB 13 ILE H 4.3 2.0
 8 LEU QQD 13 ILE     H 4.9 2.0
14 VAL QQG 13 ILE H 5.0 2.0
13 ILE HA 14 VAL H 3.3 2.0
11 SER HA 14 VAL H 3.3 2.0
10 ALA HA 14 VAL H 4.0 2.0
12 PHE HA 14 VAL H 4.3 2.0
13 ILE HB 14 VAL H 2.5 2.0
13 ILE QG1 14 VAL H 4.3 2.0
13 ILE     HG23 14 VAL H 4.1 2.0
13 ILE QD1 14 VAL  H 4.5 2.0
14 VAL HB 14 VAL H 2.5 2.0
14 VAL QQG 14 VAL H 3.5 2.0
11 SER QB 14 VAL H 4.8 2.0
10 ALA QB 14 VAL H 4.3 2.0
14 VAL HA 15 ARG H 3.3 2.0
12 PHE HA 15 ARG H 3.5 2.0
13 ILE HA 15 ARG H 4.1 2.0
12 PHE QB 15 ARG H 5.0 2.0
14 VAL HB 15 ARG H 3.0 2.0
14 VAL QQG 15 ARG H 3.8 2.0
15 ARG QB 15 ARG H 2.5 2.0
15 ARG  QG 15 ARG H 3.0 2.0
13 ILE QG1 15 ARG H 5.5 2.0
13 ILE QD1 15 ARG H 5.3 2.0
15 ARG HA 16 CYS H 3.3 2.0
14 VAL HA 16 CYS H 4.2 2.0
15 ARG QB 16 CYS H 3.0 2.0
15 ARG  QG 16 CYS H 3.0 2.0
13 ILE HA 16 CYS H 3.3 2.0
16 CYS QB 16 CYS H 2.5 2.0
12 PHE QB 16 CYS H 4.6 2.0
13 ILE QD1 16 CYS H 4.7 2.0
16 CYS HA 17 ALA H 3.3 2.0
16 CYS QB 17 ALA H 2.5 2.0
17 ALA QB 17 ALA H 2.5 2.0
13 ILE QD1 17 ALA H 4.4 2.0
13 ILE HA 17 ALA H 4.0 2.0
14 VAL HA 17 ALA H 3.8 2.0
15 ARG HA 17 ALA H 4.2 2.0
16 CYS HA 18 PHE H 4.2 2.0
17 ALA HA 18 PHE H 3.3 2.0
17 ALA QB 18 PHE H 2.5 2.0
18 PHE QB 18 PHE H 2.5 2.0
14 VAL HA 18 PHE H 3.4 2.0
15 ARG HA 18 PHE H 3.9 2.0
16 CYS HA 18 PHE H 4.0 2.0
18 PHE HA 19 GLU H 3.3 2.0
18 PHE QB 19 GLU H 2.5 2.0
16 CYS HA 19 GLU H 3.3 2.0
19 GLU QG 19 GLU H 3.7 2.0
19 GLU QB 19 GLU H 2.5 2.0
17 ALA QB 19 GLU H 4.5 2.0
16 CYS QB 19 GLU H 4.5 2.0
18 PHE HA 20 HIS H 4.2 2.0
19 GLU HA 20 HIS H 3.3 2.0
19 GLU QB 20 HIS H 2.8 2.0
19 GLU QG 20 HIS H 3.7  2.0
20 HIS QB 20 HIS H 2.5 2.0
16 CYS HA 20 HIS H 4.0 2.0
18 PHE HA 20 HIS H 4.1 2.0
16 CYS QB 20 HIS H 4.1 2.0
17 ALA QB 20 HIS H 4.4 2.0
18 PHE QB 20 HIS H 4.3 2.0
20 HIS HA 21 SER H 3.3 2.0
20 HIS QB 21 SER H 2.5 2.0
21 SER QB 21 SER H 2.5 2.0
19 GLU HA 21 SER H 4.0 2.0
21 SER HA 22 ARG H 3.3 2.0
21 SER QB 22 ARG H 2.5 2.0
22 ARG  QB 22 ARG H 2.5 2.0
22 ARG QG 22 ARG H 3.6 2.0
18 PHE HA 22 ARG H 4.0 2.0
20 HIS HA 22 ARG H 4.2 2.0
22 ARG HA 23 ARG H 3.3 2.0
22 ARG  QB 23 ARG H 2.5 2.0
22 ARG QG 23 ARG H 4.0 2.0
23 ARG  QB 23 ARG H 2.5 2.0
23 ARG QG 23 ARG H 3.6 2.0
19 GLU HA 23 ARG H 4.0 2.0
23 ARG HA 24 PHE H 3.3 2.0
19 GLU HA 22 ARG H 3.3 2.0
23 ARG  QB 24 PHE H 2.8 2.0
23 ARG QG 24 PHE H 3.6 2.0
24 PHE QB 24 PHE H 2.5 2.0
21 SER QB 24 PHE H 4.3 2.0
22 ARG HA 24 PHE H 4.2 2.0
24 PHE HA 25 THR H 3.3 2.0
24 PHE QB 25 THR H 2.5 2.0
25 THR QB 25 THR H 2.5 2.0
25 THR QG2 25 THR H 3.5 2.0
22 ARG HA 25 THR H 3.0 2.0
 2 ARG H 3 SER      H 4.0 2.0
 3 SER H 4 ASN  H 2.8 2.0
 4 ASN H 5 PHE  H 2.8 2.0
 5 PHE H 6 HIS  H 2.8 2.0
 8 LEU H 9 ALA  H 2.8 2.0
 9 ALA H 10 ALA H 2.8 2.0
10 ALA H 11 SER H 2.8 2.0
11 SER H 12 PHE H 2.8 2.0
12 PHE H 13 ILE H 2.8 2.0
13 ILE H 14 VAL H 2.8 2.0
14 VAL H 15 ARG H 2.8 2.0
15 ARG H 16 CYS H 2.8 2.0
16 CYS H 17 ALA H 2.8 2.0
17 ALA H 18 PHE H 2.8 2.0
18 PHE H 19 GLU H 2.8 2.0
19 GLU H 20 HIS H 2.8 2.0
20 HIS H 21 SER H 2.8 2.0
21 SER H 22 ARG H 2.8 2.0
22 ARG H 23 ARG H 2.8 2.0
23 ARG H 24 PHE H 2.8 2.0
24 PHE H 25 THR H 2.8 2.0
18 PHE H 20 HIS H 4.0 2.0
13 ILE H 15 ARG H 4.0 2.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLN   1           H        GLN   1   1.807   0.000   0.855
    2    HA   GLN   1           HA       GLN   1   3.110   0.275  -1.006
    3    HB2  GLN   1           2HB      GLN   1   1.112  -1.580  -2.296
    4    HB3  GLN   1           3HB      GLN   1   2.826  -1.425  -2.657
    5    HG2  GLN   1           2HG      GLN   1   1.676  -2.468  -0.078
    6    HG3  GLN   1           3HG      GLN   1   2.314  -3.456  -1.392
    7   HE21  GLN   1          1HE2      GLN   1   4.564  -2.139  -2.104
    8   HE22  GLN   1          2HE2      GLN   1   5.691  -2.119  -0.795
    9    H    ARG   2           H        ARG   2   3.355   1.752  -2.567
   10    HA   ARG   2           HA       ARG   2   1.089   3.310  -3.387
   11    HB2  ARG   2           2HB      ARG   2   3.876   3.541  -4.505
   12    HB3  ARG   2           3HB      ARG   2   2.648   4.793  -4.371
   13    HG2  ARG   2           2HG      ARG   2   3.119   5.221  -2.197
   14    HG3  ARG   2           3HG      ARG   2   3.578   3.552  -1.853
   15    HD2  ARG   2           2HD      ARG   2   5.626   4.571  -1.753
   16    HD3  ARG   2           3HD      ARG   2   5.582   4.114  -3.455
   17    HE   ARG   2           HE       ARG   2   4.497   6.666  -3.250
   18   HH11  ARG   2          1HH1      ARG   2   7.548   5.078  -2.713
   19   HH12  ARG   2          2HH1      ARG   2   8.492   6.486  -3.070
   20   HH21  ARG   2          1HH2      ARG   2   5.728   8.527  -3.722
   21   HH22  ARG   2          2HH2      ARG   2   7.456   8.448  -3.643
   22    H    SER   3           H        SER   3   3.322   1.061  -4.957
   23    HA   SER   3           HA       SER   3   2.448   1.386  -7.591
   24    HB2  SER   3           2HB      SER   3   4.486   0.102  -6.792
   25    HB3  SER   3           3HB      SER   3   3.394  -1.228  -6.406
   26    HG   SER   3           HG       SER   3   4.504  -0.953  -8.645
   27    H    ASN   4           H        ASN   4   1.239  -0.682  -4.998
   28    HA   ASN   4           HA       ASN   4  -0.742  -1.922  -6.688
   29    HB2  ASN   4           2HB      ASN   4  -0.357  -2.007  -3.687
   30    HB3  ASN   4           3HB      ASN   4  -1.510  -2.991  -4.585
   31   HD21  ASN   4          1HD2      ASN   4  -0.395  -4.134  -6.531
   32   HD22  ASN   4          2HD2      ASN   4   1.064  -4.970  -6.133
   33    H    PHE   5           H        PHE   5  -0.506   0.923  -4.811
   34    HA   PHE   5           HA       PHE   5  -3.215   1.268  -4.090
   35    HB2  PHE   5           2HB      PHE   5  -1.282   2.548  -3.136
   36    HB3  PHE   5           3HB      PHE   5  -1.190   3.441  -4.650
   37    HD1  PHE   5           HD1      PHE   5  -4.123   2.385  -2.615
   38    HD2  PHE   5           HD2      PHE   5  -1.834   5.607  -4.196
   39    HE1  PHE   5           HE1      PHE   5  -5.793   3.983  -1.768
   40    HE2  PHE   5           HE2      PHE   5  -3.499   7.209  -3.351
   41    HZ   PHE   5           HZ       PHE   5  -5.481   6.398  -2.135
   42    H    HIS   6           H        HIS   6  -1.368   2.150  -6.960
   43    HA   HIS   6           HA       HIS   6  -3.243   3.784  -8.219
   44    HB2  HIS   6           2HB      HIS   6  -0.919   2.166  -9.086
   45    HB3  HIS   6           3HB      HIS   6  -2.075   2.593 -10.344
   46    HD1  HIS   6           HD1      HIS   6   0.885   3.818  -8.804
   47    HD2  HIS   6           HD2      HIS   6  -2.595   5.574 -10.243
   48    HE1  HIS   6           HE1      HIS   6   1.455   6.240  -9.168
   49    HA   PRO   7           HA       PRO   7  -4.983  -0.168 -10.397
   50    HB2  PRO   7           2HB      PRO   7  -4.235  -2.571  -9.378
   51    HB3  PRO   7           3HB      PRO   7  -3.335  -1.748 -10.658
   52    HG2  PRO   7           2HG      PRO   7  -2.783  -1.847  -7.718
   53    HG3  PRO   7           3HG      PRO   7  -1.651  -1.998  -9.074
   54    HD2  PRO   7           2HD      PRO   7  -1.954   0.302  -7.677
   55    HD3  PRO   7           3HD      PRO   7  -1.550   0.281  -9.406
   56    H    LEU   8           H        LEU   8  -4.494  -0.074  -6.944
   57    HA   LEU   8           HA       LEU   8  -6.892  -1.560  -6.335
   58    HB2  LEU   8           2HB      LEU   8  -5.079  -1.742  -4.799
   59    HB3  LEU   8           3HB      LEU   8  -4.958   0.010  -4.646
   60    HG   LEU   8           HG       LEU   8  -7.498  -1.287  -3.806
   61   HD11  LEU   8          1HD1      LEU   8  -5.871  -1.210  -1.528
   62   HD12  LEU   8          2HD1      LEU   8  -4.940  -2.059  -2.761
   63   HD13  LEU   8          3HD1      LEU   8  -6.549  -2.632  -2.322
   64   HD21  LEU   8          3HD2      LEU   8  -6.966   0.486  -1.928
   65   HD22  LEU   8          1HD2      LEU   8  -7.634   0.971  -3.487
   66   HD23  LEU   8          2HD2      LEU   8  -5.906   1.146  -3.175
   67    H    ALA   9           H        ALA   9  -6.021   1.728  -6.905
   68    HA   ALA   9           HA       ALA   9  -8.023   3.074  -5.491
   69    HB1  ALA   9           1HB      ALA   9  -6.214   4.311  -6.431
   70    HB2  ALA   9           2HB      ALA   9  -6.626   3.783  -8.063
   71    HB3  ALA   9           3HB      ALA   9  -7.701   4.878  -7.194
   72    H    ALA  10           H        ALA  10  -8.048   1.646  -8.730
   73    HA   ALA  10           HA       ALA  10 -10.582   2.576  -9.520
   74    HB1  ALA  10           1HB      ALA  10  -9.138   1.733 -11.194
   75    HB2  ALA  10           2HB      ALA  10  -8.970   0.182 -10.370
   76    HB3  ALA  10           3HB      ALA  10 -10.506   0.622 -11.115
   77    H    SER  11           H        SER  11  -9.583  -0.413  -7.891
   78    HA   SER  11           HA       SER  11 -12.123  -1.629  -7.840
   79    HB2  SER  11           2HB      SER  11  -9.736  -1.973  -6.012
   80    HB3  SER  11           3HB      SER  11 -11.160  -3.013  -5.985
   81    HG   SER  11           HG       SER  11  -9.503  -3.891  -7.285
   82    H    PHE  12           H        PHE  12 -10.441   0.409  -5.472
   83    HA   PHE  12           HA       PHE  12 -12.539   0.319  -3.548
   84    HB2  PHE  12           2HB      PHE  12 -10.070   1.982  -3.908
   85    HB3  PHE  12           3HB      PHE  12 -11.266   2.443  -2.701
   86    HD1  PHE  12           HD2      PHE  12  -9.802  -0.812  -3.799
   87    HD2  PHE  12           HD1      PHE  12 -10.588   1.874  -0.592
   88    HE1  PHE  12           HE2      PHE  12  -8.819  -2.419  -2.217
   89    HE2  PHE  12           HE1      PHE  12  -9.605   0.271   0.995
   90    HZ   PHE  12           HZ       PHE  12  -8.720  -1.879   0.184
   91    H    ILE  13           H        ILE  13 -11.882   2.266  -6.341
   92    HA   ILE  13           HA       ILE  13 -13.655   4.408  -5.644
   93    HB   ILE  13           HB       ILE  13 -12.167   3.638  -8.122
   94   HG12  ILE  13          2HG1      ILE  13 -11.068   4.954  -6.336
   95   HG13  ILE  13          3HG1      ILE  13 -11.188   5.852  -7.846
   96   HG21  ILE  13          1HG2      ILE  13 -14.447   5.589  -7.951
   97   HG22  ILE  13          2HG2      ILE  13 -13.203   5.689  -9.195
   98   HG23  ILE  13          3HG2      ILE  13 -14.227   4.258  -9.086
   99   HD11  ILE  13          3HD1      ILE  13 -11.934   6.734  -5.349
  100   HD12  ILE  13          1HD1      ILE  13 -12.379   7.461  -6.893
  101   HD13  ILE  13          2HD1      ILE  13 -13.464   6.309  -6.114
  102    H    VAL  14           H        VAL  14 -13.865   1.507  -7.653
  103    HA   VAL  14           HA       VAL  14 -16.472   2.061  -8.658
  104    HB   VAL  14           HB       VAL  14 -15.015  -0.579  -8.462
  105   HG11  VAL  14          1HG1      VAL  14 -16.634  -0.949 -10.521
  106   HG12  VAL  14          2HG1      VAL  14 -17.149  -1.284  -8.867
  107   HG13  VAL  14          3HG1      VAL  14 -17.617   0.226  -9.649
  108   HG21  VAL  14          3HG2      VAL  14 -15.266   0.626 -11.091
  109   HG22  VAL  14          1HG2      VAL  14 -14.365   1.646  -9.969
  110   HG23  VAL  14          2HG2      VAL  14 -13.839  -0.010 -10.271
  111    H    ARG  15           H        ARG  15 -15.277   0.782  -5.701
  112    HA   ARG  15           HA       ARG  15 -17.696  -0.622  -4.997
  113    HB2  ARG  15           2HB      ARG  15 -16.408  -1.564  -3.432
  114    HB3  ARG  15           3HB      ARG  15 -15.057  -0.659  -4.102
  115    HG2  ARG  15           2HG      ARG  15 -15.490   1.161  -2.538
  116    HG3  ARG  15           3HG      ARG  15 -16.859   0.268  -1.874
  117    HD2  ARG  15           2HD      ARG  15 -14.038  -0.787  -1.909
  118    HD3  ARG  15           3HD      ARG  15 -14.725   0.111  -0.555
  119    HE   ARG  15           HE       ARG  15 -16.289  -2.165  -1.361
  120   HH11  ARG  15          1HH1      ARG  15 -13.655  -1.047   0.621
  121   HH12  ARG  15          2HH1      ARG  15 -13.780  -2.353   1.753
  122   HH21  ARG  15          1HH2      ARG  15 -16.464  -3.890   0.121
  123   HH22  ARG  15          2HH2      ARG  15 -15.378  -3.970   1.467
  124    H    CYS  16           H        CYS  16 -16.187   2.477  -4.245
  125    HA   CYS  16           HA       CYS  16 -18.315   3.212  -2.422
  126    HB2  CYS  16           2HB      CYS  16 -15.976   4.818  -3.475
  127    HB3  CYS  16           3HB      CYS  16 -17.081   5.342  -2.211
  128    HG   CYS  16           HG       CYS  16 -14.460   3.274  -2.031
  129    H    ALA  17           H        ALA  17 -17.310   3.900  -5.713
  130    HA   ALA  17           HA       ALA  17 -18.996   6.092  -6.215
  131    HB1  ALA  17           1HB      ALA  17 -18.618   5.647  -8.560
  132    HB2  ALA  17           2HB      ALA  17 -17.114   5.429  -7.664
  133    HB3  ALA  17           3HB      ALA  17 -18.039   4.022  -8.188
  134    H    PHE  18           H        PHE  18 -19.527   2.612  -6.441
  135    HA   PHE  18           HA       PHE  18 -22.104   2.831  -7.654
  136    HB2  PHE  18           2HB      PHE  18 -20.468   0.811  -7.632
  137    HB3  PHE  18           3HB      PHE  18 -21.199   0.442  -6.073
  138    HD1  PHE  18           HD2      PHE  18 -22.123   1.167  -9.606
  139    HD2  PHE  18           HD1      PHE  18 -23.098  -0.862  -5.994
  140    HE1  PHE  18           HE2      PHE  18 -23.977   0.027 -10.752
  141    HE2  PHE  18           HE1      PHE  18 -24.954  -2.007  -7.134
  142    HZ   PHE  18           HZ       PHE  18 -25.396  -1.562  -9.516
  143    H    GLU  19           H        GLU  19 -20.916   2.489  -4.354
  144    HA   GLU  19           HA       GLU  19 -23.546   2.213  -3.224
  145    HB2  GLU  19           2HB      GLU  19 -21.855   1.163  -1.976
  146    HB3  GLU  19           3HB      GLU  19 -20.791   2.558  -2.076
  147    HG2  GLU  19           2HG      GLU  19 -21.756   3.598  -0.324
  148    HG3  GLU  19           3HG      GLU  19 -23.364   2.981  -0.701
  149    H    HIS  20           H        HIS  20 -21.385   4.818  -3.981
  150    HA   HIS  20           HA       HIS  20 -22.553   6.774  -2.275
  151    HB2  HIS  20           2HB      HIS  20 -20.273   6.976  -3.234
  152    HB3  HIS  20           3HB      HIS  20 -20.986   7.186  -4.831
  153    HD1  HIS  20           HD1      HIS  20 -22.734   9.349  -4.910
  154    HD2  HIS  20           HD2      HIS  20 -19.787   9.319  -1.983
  155    HE1  HIS  20           HE1      HIS  20 -22.515  11.736  -4.152
  156    H    SER  21           H        SER  21 -23.153   5.709  -5.571
  157    HA   SER  21           HA       SER  21 -25.082   7.806  -6.067
  158    HB2  SER  21           2HB      SER  21 -24.481   5.342  -7.719
  159    HB3  SER  21           3HB      SER  21 -25.368   6.771  -8.248
  160    HG   SER  21           HG       SER  21 -22.786   7.124  -7.241
  161    H    ARG  22           H        ARG  22 -25.079   4.411  -5.184
  162    HA   ARG  22           HA       ARG  22 -27.748   3.778  -5.651
  163    HB2  ARG  22           2HB      ARG  22 -25.710   2.340  -4.793
  164    HB3  ARG  22           3HB      ARG  22 -26.380   2.724  -3.212
  165    HG2  ARG  22           2HG      ARG  22 -28.551   1.785  -3.965
  166    HG3  ARG  22           3HG      ARG  22 -27.764   1.287  -5.464
  167    HD2  ARG  22           2HD      ARG  22 -27.866  -0.563  -3.886
  168    HD3  ARG  22           3HD      ARG  22 -26.195  -0.085  -4.183
  169    HE   ARG  22           HE       ARG  22 -26.011   0.515  -1.980
  170   HH11  ARG  22          1HH1      ARG  22 -29.377   0.142  -2.788
  171   HH12  ARG  22          2HH1      ARG  22 -29.922   0.293  -1.150
  172   HH21  ARG  22          1HH2      ARG  22 -26.716   0.716   0.180
  173   HH22  ARG  22          2HH2      ARG  22 -28.407   0.620   0.537
  174    H    ARG  23           H        ARG  23 -26.237   5.306  -2.840
  175    HA   ARG  23           HA       ARG  23 -28.447   5.341  -1.139
  176    HB2  ARG  23           2HB      ARG  23 -26.479   5.951  -0.088
  177    HB3  ARG  23           3HB      ARG  23 -25.984   7.011  -1.401
  178    HG2  ARG  23           2HG      ARG  23 -27.195   8.780  -0.619
  179    HG3  ARG  23           3HG      ARG  23 -28.394   7.751   0.169
  180    HD2  ARG  23           2HD      ARG  23 -27.324   8.360   2.051
  181    HD3  ARG  23           3HD      ARG  23 -26.176   7.109   1.577
  182    HE   ARG  23           HE       ARG  23 -25.318   9.401   0.329
  183   HH11  ARG  23          1HH1      ARG  23 -25.914   8.399   3.610
  184   HH12  ARG  23          2HH1      ARG  23 -24.706   9.441   4.286
  185   HH21  ARG  23          1HH2      ARG  23 -23.724  10.777   1.207
  186   HH22  ARG  23          2HH2      ARG  23 -23.461  10.794   2.918
  187    H    PHE  24           H        PHE  24 -27.679   7.299  -3.907
  188    HA   PHE  24           HA       PHE  24 -29.653   9.318  -3.311
  189    HB2  PHE  24           2HB      PHE  24 -27.506   9.722  -4.605
  190    HB3  PHE  24           3HB      PHE  24 -28.256   8.864  -5.947
  191    HD1  PHE  24           HD1      PHE  24 -30.500   9.768  -6.803
  192    HD2  PHE  24           HD2      PHE  24 -27.845  11.997  -4.334
  193    HE1  PHE  24           HE1      PHE  24 -31.574  11.855  -7.539
  194    HE2  PHE  24           HE2      PHE  24 -28.916  14.088  -5.065
  195    HZ   PHE  24           HZ       PHE  24 -30.783  14.019  -6.669
  196    H    THR  25           H        THR  25 -29.355   6.526  -5.447
  197    HA   THR  25           HA       THR  25 -31.992   6.966  -6.577
  198    HB   THR  25           HB       THR  25 -29.990   6.019  -7.866
  199    HG1  THR  25           HG1      THR  25 -32.632   5.102  -7.855
  200   HG21  THR  25          3HG2      THR  25 -29.659   4.281  -5.928
  201   HG22  THR  25          1HG2      THR  25 -29.341   3.821  -7.600
  202   HG23  THR  25          2HG2      THR  25 -30.858   3.355  -6.831
  Start of MODEL    2
    1    H1   GLN   1           H        GLN   1   2.014   0.160   0.869
    2    HA   GLN   1           HA       GLN   1   3.142   0.172  -1.121
    3    HB2  GLN   1           2HB      GLN   1   0.822  -1.595  -1.916
    4    HB3  GLN   1           3HB      GLN   1   2.393  -1.534  -2.705
    5    HG2  GLN   1           2HG      GLN   1   1.935  -2.367   0.151
    6    HG3  GLN   1           3HG      GLN   1   2.120  -3.473  -1.210
    7   HE21  GLN   1          1HE2      GLN   1   4.154  -2.908  -2.567
    8   HE22  GLN   1          2HE2      GLN   1   5.601  -2.687  -1.650
    9    H    ARG   2           H        ARG   2   3.359   1.718  -2.588
   10    HA   ARG   2           HA       ARG   2   1.103   3.279  -3.430
   11    HB2  ARG   2           2HB      ARG   2   3.891   3.474  -4.552
   12    HB3  ARG   2           3HB      ARG   2   2.672   4.736  -4.436
   13    HG2  ARG   2           2HG      ARG   2   3.148   5.193  -2.269
   14    HG3  ARG   2           3HG      ARG   2   3.594   3.526  -1.901
   15    HD2  ARG   2           2HD      ARG   2   5.651   4.526  -1.817
   16    HD3  ARG   2           3HD      ARG   2   5.600   4.052  -3.515
   17    HE   ARG   2           HE       ARG   2   4.554   6.667  -3.143
   18   HH11  ARG   2          1HH1      ARG   2   7.529   4.866  -3.304
   19   HH12  ARG   2          2HH1      ARG   2   8.469   6.217  -3.845
   20   HH21  ARG   2          1HH2      ARG   2   5.781   8.453  -3.855
   21   HH22  ARG   2          2HH2      ARG   2   7.474   8.257  -4.157
   22    H    SER   3           H        SER   3   3.319   0.991  -4.969
   23    HA   SER   3           HA       SER   3   2.444   1.286  -7.606
   24    HB2  SER   3           2HB      SER   3   3.487  -1.217  -6.258
   25    HB3  SER   3           3HB      SER   3   3.416  -0.938  -7.997
   26    HG   SER   3           HG       SER   3   4.703   1.092  -7.225
   27    H    ASN   4           H        ASN   4   1.224  -0.738  -4.983
   28    HA   ASN   4           HA       ASN   4  -0.767  -1.988  -6.653
   29    HB2  ASN   4           2HB      ASN   4  -0.380  -2.033  -3.652
   30    HB3  ASN   4           3HB      ASN   4  -1.540  -3.022  -4.535
   31   HD21  ASN   4          1HD2      ASN   4  -0.898  -4.924  -5.289
   32   HD22  ASN   4          2HD2      ASN   4   0.736  -5.482  -5.336
   33    H    PHE   5           H        PHE   5  -0.510   0.882  -4.818
   34    HA   PHE   5           HA       PHE   5  -3.216   1.255  -4.099
   35    HB2  PHE   5           2HB      PHE   5  -1.273   2.535  -3.165
   36    HB3  PHE   5           3HB      PHE   5  -1.176   3.406  -4.692
   37    HD1  PHE   5           HD2      PHE   5  -4.042   2.415  -2.520
   38    HD2  PHE   5           HD1      PHE   5  -1.878   5.568  -4.389
   39    HE1  PHE   5           HE2      PHE   5  -5.699   4.037  -1.695
   40    HE2  PHE   5           HE1      PHE   5  -3.530   7.195  -3.566
   41    HZ   PHE   5           HZ       PHE   5  -5.444   6.430  -2.218
   42    H    HIS   6           H        HIS   6  -1.366   2.083  -6.984
   43    HA   HIS   6           HA       HIS   6  -3.231   3.712  -8.264
   44    HB2  HIS   6           2HB      HIS   6  -0.919   2.066  -9.109
   45    HB3  HIS   6           3HB      HIS   6  -2.074   2.482 -10.373
   46    HD1  HIS   6           HD1      HIS   6   0.963   3.649  -9.152
   47    HD2  HIS   6           HD2      HIS   6  -2.640   5.529 -10.015
   48    HE1  HIS   6           HE1      HIS   6   1.532   6.078  -9.476
   49    HA   PRO   7           HA       PRO   7  -5.000  -0.259 -10.383
   50    HB2  PRO   7           2HB      PRO   7  -4.268  -2.652  -9.331
   51    HB3  PRO   7           3HB      PRO   7  -3.364  -1.854 -10.623
   52    HG2  PRO   7           2HG      PRO   7  -2.809  -1.915  -7.682
   53    HG3  PRO   7           3HG      PRO   7  -1.679  -2.092  -9.037
   54    HD2  PRO   7           2HD      PRO   7  -1.965   0.229  -7.673
   55    HD3  PRO   7           3HD      PRO   7  -1.563   0.181  -9.402
   56    H    LEU   8           H        LEU   8  -4.507  -0.119  -6.932
   57    HA   LEU   8           HA       LEU   8  -6.914  -1.580  -6.299
   58    HB2  LEU   8           2HB      LEU   8  -5.100  -1.752  -4.763
   59    HB3  LEU   8           3HB      LEU   8  -4.967   0.001  -4.635
   60    HG   LEU   8           HG       LEU   8  -7.515  -1.267  -3.774
   61   HD11  LEU   8          1HD1      LEU   8  -4.969  -2.055  -2.728
   62   HD12  LEU   8          2HD1      LEU   8  -6.583  -2.586  -2.258
   63   HD13  LEU   8          3HD1      LEU   8  -5.870  -1.162  -1.503
   64   HD21  LEU   8          3HD2      LEU   8  -6.969   0.530  -1.922
   65   HD22  LEU   8          1HD2      LEU   8  -7.636   0.997  -3.486
   66   HD23  LEU   8          2HD2      LEU   8  -5.907   1.164  -3.180
   67    H    ALA   9           H        ALA   9  -6.021   1.694  -6.918
   68    HA   ALA   9           HA       ALA   9  -8.013   3.074  -5.521
   69    HB1  ALA   9           1HB      ALA   9  -6.614   3.735  -8.105
   70    HB2  ALA   9           2HB      ALA   9  -7.680   4.850  -7.250
   71    HB3  ALA   9           3HB      ALA   9  -6.197   4.285  -6.482
   72    H    ALA  10           H        ALA  10  -8.051   1.599  -8.739
   73    HA   ALA  10           HA       ALA  10 -10.579   2.535  -9.539
   74    HB1  ALA  10           1HB      ALA  10 -10.520   0.556 -11.105
   75    HB2  ALA  10           2HB      ALA  10  -9.145   1.657 -11.204
   76    HB3  ALA  10           3HB      ALA  10  -8.984   0.119 -10.356
   77    H    SER  11           H        SER  11  -9.600  -0.437  -7.869
   78    HA   SER  11           HA       SER  11 -12.147  -1.634  -7.797
   79    HB2  SER  11           2HB      SER  11  -9.762  -1.969  -5.966
   80    HB3  SER  11           3HB      SER  11 -11.192  -2.999  -5.925
   81    HG   SER  11           HG       SER  11 -10.675  -3.825  -7.866
   82    H    PHE  12           H        PHE  12 -10.449   0.425  -5.461
   83    HA   PHE  12           HA       PHE  12 -12.544   0.377  -3.534
   84    HB2  PHE  12           2HB      PHE  12 -10.064   2.018  -3.920
   85    HB3  PHE  12           3HB      PHE  12 -11.256   2.505  -2.719
   86    HD1  PHE  12           HD2      PHE  12  -9.816  -0.776  -3.772
   87    HD2  PHE  12           HD1      PHE  12 -10.579   1.962  -0.603
   88    HE1  PHE  12           HE2      PHE  12  -8.843  -2.367  -2.168
   89    HE2  PHE  12           HE1      PHE  12  -9.605   0.375   1.007
   90    HZ   PHE  12           HZ       PHE  12  -8.737  -1.793   0.225
   91    H    ILE  13           H        ILE  13 -11.878   2.279  -6.355
   92    HA   ILE  13           HA       ILE  13 -13.635   4.444  -5.687
   93    HB   ILE  13           HB       ILE  13 -12.156   3.628  -8.155
   94   HG12  ILE  13          2HG1      ILE  13 -11.046   4.962  -6.390
   95   HG13  ILE  13          3HG1      ILE  13 -11.161   5.838  -7.912
   96   HG21  ILE  13          1HG2      ILE  13 -14.422   5.596  -8.010
   97   HG22  ILE  13          2HG2      ILE  13 -13.179   5.670  -9.257
   98   HG23  ILE  13          3HG2      ILE  13 -14.213   4.247  -9.126
   99   HD11  ILE  13          3HD1      ILE  13 -12.344   7.469  -6.985
  100   HD12  ILE  13          1HD1      ILE  13 -13.433   6.336  -6.185
  101   HD13  ILE  13          2HD1      ILE  13 -11.897   6.766  -5.431
  102    H    VAL  14           H        VAL  14 -13.869   1.516  -7.654
  103    HA   VAL  14           HA       VAL  14 -16.472   2.074  -8.663
  104    HB   VAL  14           HB       VAL  14 -15.034  -0.574  -8.430
  105   HG11  VAL  14          1HG1      VAL  14 -16.621  -1.096 -10.398
  106   HG12  VAL  14          2HG1      VAL  14 -17.263  -1.151  -8.755
  107   HG13  VAL  14          3HG1      VAL  14 -17.578   0.250  -9.780
  108   HG21  VAL  14          3HG2      VAL  14 -13.820   0.007 -10.202
  109   HG22  VAL  14          1HG2      VAL  14 -15.256   0.524 -11.085
  110   HG23  VAL  14          2HG2      VAL  14 -14.431   1.650 -10.008
  111    H    ARG  15           H        ARG  15 -15.283   0.829  -5.690
  112    HA   ARG  15           HA       ARG  15 -17.711  -0.547  -4.962
  113    HB2  ARG  15           2HB      ARG  15 -16.427  -1.476  -3.385
  114    HB3  ARG  15           3HB      ARG  15 -15.071  -0.590  -4.070
  115    HG2  ARG  15           2HG      ARG  15 -15.488   1.256  -2.533
  116    HG3  ARG  15           3HG      ARG  15 -16.863   0.382  -1.854
  117    HD2  ARG  15           2HD      ARG  15 -14.110  -0.811  -1.905
  118    HD3  ARG  15           3HD      ARG  15 -14.622   0.268  -0.608
  119    HE   ARG  15           HE       ARG  15 -16.467  -1.870  -1.053
  120   HH11  ARG  15          1HH1      ARG  15 -13.476  -0.997   0.500
  121   HH12  ARG  15          2HH1      ARG  15 -13.604  -2.217   1.724
  122   HH21  ARG  15          1HH2      ARG  15 -16.647  -3.480   0.553
  123   HH22  ARG  15          2HH2      ARG  15 -15.408  -3.630   1.753
  124    H    CYS  16           H        CYS  16 -16.179   2.551  -4.257
  125    HA   CYS  16           HA       CYS  16 -18.299   3.328  -2.442
  126    HB2  CYS  16           2HB      CYS  16 -15.950   4.902  -3.522
  127    HB3  CYS  16           3HB      CYS  16 -17.050   5.452  -2.263
  128    HG   CYS  16           HG       CYS  16 -14.399   4.496  -1.402
  129    H    ALA  17           H        ALA  17 -17.293   3.961  -5.744
  130    HA   ALA  17           HA       ALA  17 -18.965   6.157  -6.276
  131    HB1  ALA  17           1HB      ALA  17 -18.593   5.675  -8.615
  132    HB2  ALA  17           2HB      ALA  17 -17.090   5.460  -7.717
  133    HB3  ALA  17           3HB      ALA  17 -18.026   4.052  -8.220
  134    H    PHE  18           H        PHE  18 -19.520   2.679  -6.451
  135    HA   PHE  18           HA       PHE  18 -22.098   2.897  -7.663
  136    HB2  PHE  18           2HB      PHE  18 -20.476   0.867  -7.614
  137    HB3  PHE  18           3HB      PHE  18 -21.207   0.525  -6.049
  138    HD1  PHE  18           HD1      PHE  18 -23.852   0.548  -6.063
  139    HD2  PHE  18           HD2      PHE  18 -21.394  -0.106  -9.476
  140    HE1  PHE  18           HE1      PHE  18 -25.719  -0.598  -7.184
  141    HE2  PHE  18           HE2      PHE  18 -23.257  -1.251 -10.602
  142    HZ   PHE  18           HZ       PHE  18 -25.423  -1.498  -9.457
  143    H    GLU  19           H        GLU  19 -20.908   2.596  -4.360
  144    HA   GLU  19           HA       GLU  19 -23.538   2.354  -3.223
  145    HB2  GLU  19           2HB      GLU  19 -21.853   1.311  -1.962
  146    HB3  GLU  19           3HB      GLU  19 -20.779   2.697  -2.084
  147    HG2  GLU  19           2HG      GLU  19 -21.734   3.769  -0.346
  148    HG3  GLU  19           3HG      GLU  19 -23.347   3.159  -0.712
  149    H    HIS  20           H        HIS  20 -21.360   4.933  -4.021
  150    HA   HIS  20           HA       HIS  20 -22.512   6.921  -2.342
  151    HB2  HIS  20           2HB      HIS  20 -20.231   7.093  -3.308
  152    HB3  HIS  20           3HB      HIS  20 -20.946   7.287  -4.906
  153    HD1  HIS  20           HD1      HIS  20 -21.546   9.610  -5.593
  154    HD2  HIS  20           HD2      HIS  20 -20.864   9.298  -1.507
  155    HE1  HIS  20           HE1      HIS  20 -21.596  11.969  -4.721
  156    H    SER  21           H        SER  21 -23.124   5.813  -5.621
  157    HA   SER  21           HA       SER  21 -25.038   7.916  -6.146
  158    HB2  SER  21           2HB      SER  21 -24.456   5.424  -7.762
  159    HB3  SER  21           3HB      SER  21 -25.334   6.852  -8.311
  160    HG   SER  21           HG       SER  21 -22.826   6.465  -8.612
  161    H    ARG  22           H        ARG  22 -25.058   4.535  -5.214
  162    HA   ARG  22           HA       ARG  22 -27.732   3.913  -5.668
  163    HB2  ARG  22           2HB      ARG  22 -25.704   2.473  -4.791
  164    HB3  ARG  22           3HB      ARG  22 -26.367   2.886  -3.216
  165    HG2  ARG  22           2HG      ARG  22 -28.548   1.954  -3.953
  166    HG3  ARG  22           3HG      ARG  22 -27.764   1.422  -5.443
  167    HD2  ARG  22           2HD      ARG  22 -27.862  -0.409  -3.866
  168    HD3  ARG  22           3HD      ARG  22 -26.187   0.085  -4.107
  169    HE   ARG  22           HE       ARG  22 -27.467   1.328  -1.847
  170   HH11  ARG  22          1HH1      ARG  22 -25.665  -1.429  -2.976
  171   HH12  ARG  22          2HH1      ARG  22 -25.048  -1.832  -1.408
  172   HH21  ARG  22          1HH2      ARG  22 -26.662   0.807   0.222
  173   HH22  ARG  22          2HH2      ARG  22 -25.617  -0.560   0.411
  174    H    ARG  23           H        ARG  23 -26.206   5.471  -2.881
  175    HA   ARG  23           HA       ARG  23 -28.414   5.547  -1.179
  176    HB2  ARG  23           2HB      ARG  23 -26.440   6.158  -0.139
  177    HB3  ARG  23           3HB      ARG  23 -25.940   7.197  -1.467
  178    HG2  ARG  23           2HG      ARG  23 -27.138   8.984  -0.709
  179    HG3  ARG  23           3HG      ARG  23 -28.342   7.975   0.095
  180    HD2  ARG  23           2HD      ARG  23 -25.850   7.477   1.337
  181    HD3  ARG  23           3HD      ARG  23 -26.026   9.225   1.194
  182    HE   ARG  23           HE       ARG  23 -28.357   7.887   2.227
  183   HH11  ARG  23          1HH1      ARG  23 -25.305   9.369   3.008
  184   HH12  ARG  23          2HH1      ARG  23 -25.748   9.722   4.646
  185   HH21  ARG  23          1HH2      ARG  23 -28.951   8.346   4.381
  186   HH22  ARG  23          2HH2      ARG  23 -27.821   9.138   5.426
  187    H    PHE  24           H        PHE  24 -27.636   7.458  -3.976
  188    HA   PHE  24           HA       PHE  24 -29.595   9.501  -3.407
  189    HB2  PHE  24           2HB      PHE  24 -27.448   9.870  -4.710
  190    HB3  PHE  24           3HB      PHE  24 -28.204   8.997  -6.038
  191    HD1  PHE  24           HD1      PHE  24 -30.071   9.961  -7.259
  192    HD2  PHE  24           HD2      PHE  24 -28.142  12.092  -4.120
  193    HE1  PHE  24           HE1      PHE  24 -31.132  12.045  -8.027
  194    HE2  PHE  24           HE2      PHE  24 -29.200  14.179  -4.882
  195    HZ   PHE  24           HZ       PHE  24 -30.698  14.157  -6.837
  196    H    THR  25           H        THR  25 -29.321   6.675  -5.501
  197    HA   THR  25           HA       THR  25 -31.956   7.117  -6.633
  198    HB   THR  25           HB       THR  25 -29.963   6.136  -7.911
  199    HG1  THR  25           HG1      THR  25 -31.529   4.473  -8.854
  200   HG21  THR  25          3HG2      THR  25 -29.334   3.936  -7.616
  201   HG22  THR  25          1HG2      THR  25 -30.850   3.495  -6.833
  202   HG23  THR  25          2HG2      THR  25 -29.640   4.425  -5.950
  Start of MODEL    3
    1    H1   GLN   1           H        GLN   1   1.404  -0.985   0.592
    2    HA   GLN   1           HA       GLN   1   3.011   0.295  -0.749
    3    HB2  GLN   1           2HB      GLN   1   1.890  -2.216  -1.501
    4    HB3  GLN   1           3HB      GLN   1   2.228  -1.307  -2.968
    5    HG2  GLN   1           2HG      GLN   1   4.538  -0.886  -1.902
    6    HG3  GLN   1           3HG      GLN   1   4.119  -2.236  -0.849
    7   HE21  GLN   1          1HE2      GLN   1   5.515  -1.358  -3.733
    8   HE22  GLN   1          2HE2      GLN   1   5.522  -2.899  -4.513
    9    H    ARG   2           H        ARG   2   3.400   1.614  -2.539
   10    HA   ARG   2           HA       ARG   2   1.151   3.188  -3.373
   11    HB2  ARG   2           2HB      ARG   2   3.940   3.379  -4.493
   12    HB3  ARG   2           3HB      ARG   2   2.726   4.645  -4.371
   13    HG2  ARG   2           2HG      ARG   2   3.202   5.088  -2.201
   14    HG3  ARG   2           3HG      ARG   2   3.642   3.417  -1.841
   15    HD2  ARG   2           2HD      ARG   2   5.702   4.413  -1.751
   16    HD3  ARG   2           3HD      ARG   2   5.652   3.943  -3.450
   17    HE   ARG   2           HE       ARG   2   4.620   6.567  -3.046
   18   HH11  ARG   2          1HH1      ARG   2   7.567   4.732  -3.309
   19   HH12  ARG   2          2HH1      ARG   2   8.506   6.076  -3.869
   20   HH21  ARG   2          1HH2      ARG   2   5.846   8.343  -3.783
   21   HH22  ARG   2          2HH2      ARG   2   7.527   8.129  -4.138
   22    H    SER   3           H        SER   3   3.359   0.900  -4.922
   23    HA   SER   3           HA       SER   3   2.487   1.211  -7.559
   24    HB2  SER   3           2HB      SER   3   3.520  -1.302  -6.222
   25    HB3  SER   3           3HB      SER   3   3.451  -1.014  -7.960
   26    HG   SER   3           HG       SER   3   4.890   0.753  -7.622
   27    H    ASN   4           H        ASN   4   1.258  -0.821  -4.947
   28    HA   ASN   4           HA       ASN   4  -0.736  -2.055  -6.625
   29    HB2  ASN   4           2HB      ASN   4  -0.353  -2.117  -3.623
   30    HB3  ASN   4           3HB      ASN   4  -1.515  -3.097  -4.512
   31   HD21  ASN   4          1HD2      ASN   4  -0.193  -4.737  -3.277
   32   HD22  ASN   4          2HD2      ASN   4   1.174  -5.401  -4.099
   33    H    PHE   5           H        PHE   5  -0.470   0.805  -4.774
   34    HA   PHE   5           HA       PHE   5  -3.175   1.184  -4.056
   35    HB2  PHE   5           2HB      PHE   5  -1.228   2.453  -3.114
   36    HB3  PHE   5           3HB      PHE   5  -1.126   3.330  -4.637
   37    HD1  PHE   5           HD1      PHE   5  -3.207   2.727  -1.659
   38    HD2  PHE   5           HD2      PHE   5  -2.612   5.107  -5.137
   39    HE1  PHE   5           HE1      PHE   5  -4.858   4.350  -0.826
   40    HE2  PHE   5           HE2      PHE   5  -4.260   6.735  -4.310
   41    HZ   PHE   5           HZ       PHE   5  -5.385   6.358  -2.151
   42    H    HIS   6           H        HIS   6  -1.320   2.020  -6.935
   43    HA   HIS   6           HA       HIS   6  -3.179   3.662  -8.209
   44    HB2  HIS   6           2HB      HIS   6  -0.872   2.012  -9.061
   45    HB3  HIS   6           3HB      HIS   6  -2.024   2.438 -10.323
   46    HD1  HIS   6           HD1      HIS   6   0.681   3.827  -8.229
   47    HD2  HIS   6           HD2      HIS   6  -2.242   5.245 -10.819
   48    HE1  HIS   6           HE1      HIS   6   1.345   6.193  -8.760
   49    HA   PRO   7           HA       PRO   7  -4.960  -0.292 -10.349
   50    HB2  PRO   7           2HB      PRO   7  -4.238  -2.693  -9.308
   51    HB3  PRO   7           3HB      PRO   7  -3.330  -1.892 -10.596
   52    HG2  PRO   7           2HG      PRO   7  -2.777  -1.969  -7.654
   53    HG3  PRO   7           3HG      PRO   7  -1.647  -2.144  -9.010
   54    HD2  PRO   7           2HD      PRO   7  -1.925   0.172  -7.634
   55    HD3  PRO   7           3HD      PRO   7  -1.522   0.130  -9.363
   56    H    LEU   8           H        LEU   8  -4.469  -0.171  -6.897
   57    HA   LEU   8           HA       LEU   8  -6.882  -1.625  -6.273
   58    HB2  LEU   8           2HB      LEU   8  -5.071  -1.812  -4.736
   59    HB3  LEU   8           3HB      LEU   8  -4.931  -0.060  -4.600
   60    HG   LEU   8           HG       LEU   8  -7.484  -1.322  -3.747
   61   HD11  LEU   8          1HD1      LEU   8  -4.933  -2.108  -2.693
   62   HD12  LEU   8          2HD1      LEU   8  -6.547  -2.664  -2.252
   63   HD13  LEU   8          3HD1      LEU   8  -5.860  -1.242  -1.468
   64   HD21  LEU   8          3HD2      LEU   8  -5.865   1.098  -3.135
   65   HD22  LEU   8          1HD2      LEU   8  -6.935   0.462  -1.886
   66   HD23  LEU   8          2HD2      LEU   8  -7.594   0.942  -3.449
   67    H    ALA   9           H        ALA   9  -5.977   1.648  -6.874
   68    HA   ALA   9           HA       ALA   9  -7.964   3.028  -5.473
   69    HB1  ALA   9           1HB      ALA   9  -6.142   4.236  -6.426
   70    HB2  ALA   9           2HB      ALA   9  -6.562   3.698  -8.053
   71    HB3  ALA   9           3HB      ALA   9  -7.623   4.812  -7.191
   72    H    ALA  10           H        ALA  10  -8.006   1.570  -8.698
   73    HA   ALA  10           HA       ALA  10 -10.530   2.518  -9.495
   74    HB1  ALA  10           1HB      ALA  10 -10.477   0.548 -11.070
   75    HB2  ALA  10           2HB      ALA  10  -9.097   1.643 -11.162
   76    HB3  ALA  10           3HB      ALA  10  -8.944   0.100 -10.323
   77    H    SER  11           H        SER  11  -9.563  -0.465  -7.839
   78    HA   SER  11           HA       SER  11 -12.114  -1.653  -7.774
   79    HB2  SER  11           2HB      SER  11  -9.731  -2.006  -5.943
   80    HB3  SER  11           3HB      SER  11 -11.166  -3.030  -5.907
   81    HG   SER  11           HG       SER  11 -10.620  -3.899  -7.798
   82    H    PHE  12           H        PHE  12 -10.410   0.389  -5.426
   83    HA   PHE  12           HA       PHE  12 -12.507   0.339  -3.501
   84    HB2  PHE  12           2HB      PHE  12 -10.020   1.972  -3.878
   85    HB3  PHE  12           3HB      PHE  12 -11.211   2.458  -2.676
   86    HD1  PHE  12           HD1      PHE  12  -9.782  -0.822  -3.743
   87    HD2  PHE  12           HD2      PHE  12 -10.540   1.901  -0.560
   88    HE1  PHE  12           HE1      PHE  12  -8.816  -2.425  -2.146
   89    HE2  PHE  12           HE2      PHE  12  -9.574   0.303   1.042
   90    HZ   PHE  12           HZ       PHE  12  -8.710  -1.863   0.250
   91    H    ILE  13           H        ILE  13 -11.832   2.252  -6.313
   92    HA   ILE  13           HA       ILE  13 -13.581   4.420  -5.634
   93    HB   ILE  13           HB       ILE  13 -12.104   3.611  -8.106
   94   HG12  ILE  13          2HG1      ILE  13 -10.990   4.932  -6.334
   95   HG13  ILE  13          3HG1      ILE  13 -11.101   5.816  -7.852
   96   HG21  ILE  13          1HG2      ILE  13 -14.363   5.587  -7.952
   97   HG22  ILE  13          2HG2      ILE  13 -13.118   5.662  -9.198
   98   HG23  ILE  13          3HG2      ILE  13 -14.158   4.242  -9.075
   99   HD11  ILE  13          3HD1      ILE  13 -12.279   7.446  -6.918
  100   HD12  ILE  13          1HD1      ILE  13 -13.371   6.314  -6.123
  101   HD13  ILE  13          2HD1      ILE  13 -11.834   6.735  -5.367
  102    H    VAL  14           H        VAL  14 -13.824   1.503  -7.616
  103    HA   VAL  14           HA       VAL  14 -16.426   2.075  -8.624
  104    HB   VAL  14           HB       VAL  14 -14.997  -0.579  -8.403
  105   HG11  VAL  14          1HG1      VAL  14 -17.162  -1.235  -8.779
  106   HG12  VAL  14          2HG1      VAL  14 -17.578   0.249  -9.639
  107   HG13  VAL  14          3HG1      VAL  14 -16.609  -0.991 -10.436
  108   HG21  VAL  14          3HG2      VAL  14 -13.830  -0.054 -10.234
  109   HG22  VAL  14          1HG2      VAL  14 -15.245   0.627 -11.038
  110   HG23  VAL  14          2HG2      VAL  14 -14.304   1.616  -9.922
  111    H    ARG  15           H        ARG  15 -15.242   0.811  -5.656
  112    HA   ARG  15           HA       ARG  15 -17.676  -0.559  -4.936
  113    HB2  ARG  15           2HB      ARG  15 -16.396  -1.500  -3.364
  114    HB3  ARG  15           3HB      ARG  15 -15.037  -0.616  -4.043
  115    HG2  ARG  15           2HG      ARG  15 -15.448   1.224  -2.497
  116    HG3  ARG  15           3HG      ARG  15 -16.826   0.351  -1.823
  117    HD2  ARG  15           2HD      ARG  15 -14.162  -0.984  -1.897
  118    HD3  ARG  15           3HD      ARG  15 -14.464   0.251  -0.675
  119    HE   ARG  15           HE       ARG  15 -15.462  -2.407  -0.685
  120   HH11  ARG  15          1HH1      ARG  15 -16.298   0.859   0.183
  121   HH12  ARG  15          2HH1      ARG  15 -17.403   0.384   1.430
  122   HH21  ARG  15          1HH2      ARG  15 -16.914  -3.046   0.953
  123   HH22  ARG  15          2HH2      ARG  15 -17.752  -1.838   1.868
  124    H    CYS  16           H        CYS  16 -16.133   2.530  -4.216
  125    HA   CYS  16           HA       CYS  16 -18.251   3.306  -2.398
  126    HB2  CYS  16           2HB      CYS  16 -15.896   4.876  -3.469
  127    HB3  CYS  16           3HB      CYS  16 -16.994   5.425  -2.208
  128    HG   CYS  16           HG       CYS  16 -14.352   3.419  -1.992
  129    H    ALA  17           H        ALA  17 -17.241   3.951  -5.696
  130    HA   ALA  17           HA       ALA  17 -18.905   6.155  -6.218
  131    HB1  ALA  17           1HB      ALA  17 -17.031   5.459  -7.661
  132    HB2  ALA  17           2HB      ALA  17 -17.971   4.057  -8.172
  133    HB3  ALA  17           3HB      ALA  17 -18.532   5.683  -8.559
  134    H    PHE  18           H        PHE  18 -19.472   2.680  -6.410
  135    HA   PHE  18           HA       PHE  18 -22.048   2.914  -7.623
  136    HB2  PHE  18           2HB      PHE  18 -20.434   0.877  -7.583
  137    HB3  PHE  18           3HB      PHE  18 -21.167   0.531  -6.020
  138    HD1  PHE  18           HD2      PHE  18 -23.750   0.394  -5.970
  139    HD2  PHE  18           HD1      PHE  18 -21.417   0.088  -9.516
  140    HE1  PHE  18           HE2      PHE  18 -25.620  -0.740  -7.098
  141    HE2  PHE  18           HE1      PHE  18 -23.283  -1.046 -10.651
  142    HZ   PHE  18           HZ       PHE  18 -25.388  -1.462  -9.441
  143    H    GLU  19           H        GLU  19 -20.862   2.592  -4.321
  144    HA   GLU  19           HA       GLU  19 -23.493   2.355  -3.187
  145    HB2  GLU  19           2HB      GLU  19 -21.812   1.299  -1.930
  146    HB3  GLU  19           3HB      GLU  19 -20.734   2.683  -2.044
  147    HG2  GLU  19           2HG      GLU  19 -21.687   3.747  -0.300
  148    HG3  GLU  19           3HG      GLU  19 -23.301   3.146  -0.672
  149    H    HIS  20           H        HIS  20 -21.305   4.929  -3.971
  150    HA   HIS  20           HA       HIS  20 -22.450   6.914  -2.283
  151    HB2  HIS  20           2HB      HIS  20 -20.169   7.082  -3.247
  152    HB3  HIS  20           3HB      HIS  20 -20.882   7.285  -4.844
  153    HD1  HIS  20           HD1      HIS  20 -22.548   9.477  -4.999
  154    HD2  HIS  20           HD2      HIS  20 -19.715   9.419  -1.960
  155    HE1  HIS  20           HE1      HIS  20 -22.317  11.867  -4.249
  156    H    SER  21           H        SER  21 -23.065   5.824  -5.568
  157    HA   SER  21           HA       SER  21 -24.972   7.937  -6.082
  158    HB2  SER  21           2HB      SER  21 -24.399   5.450  -7.711
  159    HB3  SER  21           3HB      SER  21 -25.270   6.884  -8.253
  160    HG   SER  21           HG       SER  21 -22.579   6.924  -7.362
  161    H    ARG  22           H        ARG  22 -25.005   4.550  -5.167
  162    HA   ARG  22           HA       ARG  22 -27.680   3.940  -5.626
  163    HB2  ARG  22           2HB      ARG  22 -25.657   2.490  -4.754
  164    HB3  ARG  22           3HB      ARG  22 -26.320   2.897  -3.178
  165    HG2  ARG  22           2HG      ARG  22 -28.503   1.974  -3.920
  166    HG3  ARG  22           3HG      ARG  22 -27.721   1.451  -5.413
  167    HD2  ARG  22           2HD      ARG  22 -27.881  -0.353  -3.739
  168    HD3  ARG  22           3HD      ARG  22 -26.215   0.028  -4.172
  169    HE   ARG  22           HE       ARG  22 -27.156   1.424  -1.841
  170   HH11  ARG  22          1HH1      ARG  22 -25.703  -1.505  -3.037
  171   HH12  ARG  22          2HH1      ARG  22 -24.959  -1.908  -1.526
  172   HH21  ARG  22          1HH2      ARG  22 -26.181   0.904   0.155
  173   HH22  ARG  22          2HH2      ARG  22 -25.232  -0.537   0.290
  174    H    ARG  23           H        ARG  23 -26.150   5.480  -2.831
  175    HA   ARG  23           HA       ARG  23 -28.358   5.555  -1.129
  176    HB2  ARG  23           2HB      ARG  23 -26.386   6.158  -0.084
  177    HB3  ARG  23           3HB      ARG  23 -25.878   7.195  -1.409
  178    HG2  ARG  23           2HG      ARG  23 -27.068   8.988  -0.651
  179    HG3  ARG  23           3HG      ARG  23 -28.279   7.984   0.150
  180    HD2  ARG  23           2HD      ARG  23 -25.530   7.799   1.207
  181    HD3  ARG  23           3HD      ARG  23 -26.353   9.338   1.457
  182    HE   ARG  23           HE       ARG  23 -26.877   6.890   2.802
  183   HH11  ARG  23          1HH1      ARG  23 -28.404   9.767   1.575
  184   HH12  ARG  23          2HH1      ARG  23 -29.714   9.713   2.708
  185   HH21  ARG  23          1HH2      ARG  23 -28.596   6.808   4.300
  186   HH22  ARG  23          2HH2      ARG  23 -29.821   8.030   4.259
  187    H    PHE  24           H        PHE  24 -27.570   7.482  -3.915
  188    HA   PHE  24           HA       PHE  24 -29.530   9.522  -3.337
  189    HB2  PHE  24           2HB      PHE  24 -27.376   9.900  -4.627
  190    HB3  PHE  24           3HB      PHE  24 -28.127   9.038  -5.966
  191    HD1  PHE  24           HD1      PHE  24 -30.416   9.948  -6.771
  192    HD2  PHE  24           HD2      PHE  24 -27.645  12.184  -4.439
  193    HE1  PHE  24           HE1      PHE  24 -31.473  12.038  -7.526
  194    HE2  PHE  24           HE2      PHE  24 -28.698  14.277  -5.188
  195    HZ   PHE  24           HZ       PHE  24 -30.615  14.207  -6.733
  196    H    THR  25           H        THR  25 -29.247   6.713  -5.452
  197    HA   THR  25           HA       THR  25 -31.874   7.165  -6.598
  198    HB   THR  25           HB       THR  25 -29.880   6.186  -7.870
  199    HG1  THR  25           HG1      THR  25 -32.523   5.257  -7.848
  200   HG21  THR  25          3HG2      THR  25 -29.072   4.143  -7.393
  201   HG22  THR  25          1HG2      THR  25 -30.674   3.480  -7.076
  202   HG23  THR  25          2HG2      THR  25 -29.826   4.378  -5.817
  Start of MODEL    4
    1    H1   GLN   1           H        GLN   1   1.893   0.309   0.798
    2    HA   GLN   1           HA       GLN   1   3.133   0.378  -1.116
    3    HB2  GLN   1           2HB      GLN   1   1.385  -1.891  -1.215
    4    HB3  GLN   1           3HB      GLN   1   1.620  -1.275  -2.846
    5    HG2  GLN   1           2HG      GLN   1   3.906  -1.832  -0.983
    6    HG3  GLN   1           3HG      GLN   1   3.228  -3.054  -2.057
    7   HE21  GLN   1          1HE2      GLN   1   4.060  -3.205  -4.015
    8   HE22  GLN   1          2HE2      GLN   1   5.021  -2.005  -4.803
    9    H    ARG   2           H        ARG   2   3.354   1.814  -2.709
   10    HA   ARG   2           HA       ARG   2   1.085   3.346  -3.566
   11    HB2  ARG   2           2HB      ARG   2   3.859   3.515  -4.727
   12    HB3  ARG   2           3HB      ARG   2   2.639   4.778  -4.631
   13    HG2  ARG   2           2HG      ARG   2   3.140   5.296  -2.484
   14    HG3  ARG   2           3HG      ARG   2   3.593   3.640  -2.074
   15    HD2  ARG   2           2HD      ARG   2   5.636   3.986  -3.530
   16    HD3  ARG   2           3HD      ARG   2   5.212   5.698  -3.555
   17    HE   ARG   2           HE       ARG   2   5.367   4.628  -0.904
   18   HH11  ARG   2          1HH1      ARG   2   7.220   5.934  -3.547
   19   HH12  ARG   2          2HH1      ARG   2   8.518   6.480  -2.538
   20   HH21  ARG   2          1HH2      ARG   2   7.070   5.343   0.435
   21   HH22  ARG   2          2HH2      ARG   2   8.433   6.142  -0.273
   22    H    SER   3           H        SER   3   3.287   1.021  -5.069
   23    HA   SER   3           HA       SER   3   2.379   1.242  -7.702
   24    HB2  SER   3           2HB      SER   3   3.444  -1.222  -6.299
   25    HB3  SER   3           3HB      SER   3   3.351  -0.989  -8.045
   26    HG   SER   3           HG       SER   3   4.643   1.063  -7.342
   27    H    ASN   4           H        ASN   4   1.196  -0.712  -5.010
   28    HA   ASN   4           HA       ASN   4  -0.812  -2.011  -6.621
   29    HB2  ASN   4           2HB      ASN   4  -0.389  -1.974  -3.625
   30    HB3  ASN   4           3HB      ASN   4  -1.557  -2.988  -4.466
   31   HD21  ASN   4          1HD2      ASN   4  -0.408  -4.138  -6.442
   32   HD22  ASN   4          2HD2      ASN   4   1.028  -4.993  -6.004
   33    H    PHE   5           H        PHE   5  -0.539   0.909  -4.867
   34    HA   PHE   5           HA       PHE   5  -3.237   1.296  -4.125
   35    HB2  PHE   5           2HB      PHE   5  -1.286   2.605  -3.250
   36    HB3  PHE   5           3HB      PHE   5  -1.209   3.433  -4.801
   37    HD1  PHE   5           HD1      PHE   5  -3.240   2.919  -1.774
   38    HD2  PHE   5           HD2      PHE   5  -2.719   5.179  -5.343
   39    HE1  PHE   5           HE1      PHE   5  -4.889   4.560  -0.972
   40    HE2  PHE   5           HE2      PHE   5  -4.366   6.824  -4.546
   41    HZ   PHE   5           HZ       PHE   5  -5.453   6.516  -2.358
   42    H    HIS   6           H        HIS   6  -1.425   2.050  -7.054
   43    HA   HIS   6           HA       HIS   6  -3.310   3.639  -8.354
   44    HB2  HIS   6           2HB      HIS   6  -1.005   1.975  -9.184
   45    HB3  HIS   6           3HB      HIS   6  -2.175   2.355 -10.443
   46    HD1  HIS   6           HD1      HIS   6  -0.615   4.466  -7.677
   47    HD2  HIS   6           HD2      HIS   6  -1.248   4.500 -11.783
   48    HE1  HIS   6           HE1      HIS   6   0.324   6.655  -8.483
   49    HA   PRO   7           HA       PRO   7  -5.095  -0.391 -10.344
   50    HB2  PRO   7           2HB      PRO   7  -4.344  -2.753  -9.236
   51    HB3  PRO   7           3HB      PRO   7  -3.458  -1.989 -10.560
   52    HG2  PRO   7           2HG      PRO   7  -2.867  -1.969  -7.626
   53    HG3  PRO   7           3HG      PRO   7  -1.754  -2.181  -8.990
   54    HD2  PRO   7           2HD      PRO   7  -2.028   0.176  -7.685
   55    HD3  PRO   7           3HD      PRO   7  -1.647   0.082  -9.417
   56    H    LEU   8           H        LEU   8  -4.560  -0.157  -6.904
   57    HA   LEU   8           HA       LEU   8  -6.956  -1.604  -6.202
   58    HB2  LEU   8           2HB      LEU   8  -5.123  -1.731  -4.684
   59    HB3  LEU   8           3HB      LEU   8  -4.992   0.024  -4.605
   60    HG   LEU   8           HG       LEU   8  -7.526  -1.225  -3.679
   61   HD11  LEU   8          1HD1      LEU   8  -6.568  -2.503  -2.143
   62   HD12  LEU   8          2HD1      LEU   8  -5.857  -1.055  -1.430
   63   HD13  LEU   8          3HD1      LEU   8  -4.961  -1.973  -2.641
   64   HD21  LEU   8          3HD2      LEU   8  -7.651   1.044  -3.449
   65   HD22  LEU   8          1HD2      LEU   8  -5.919   1.225  -3.173
   66   HD23  LEU   8          2HD2      LEU   8  -6.958   0.623  -1.882
   67    H    ALA   9           H        ALA   9  -6.078   1.653  -6.919
   68    HA   ALA   9           HA       ALA   9  -8.056   3.066  -5.536
   69    HB1  ALA   9           1HB      ALA   9  -6.253   4.254  -6.551
   70    HB2  ALA   9           2HB      ALA   9  -6.690   3.661  -8.154
   71    HB3  ALA   9           3HB      ALA   9  -7.747   4.796  -7.315
   72    H    ALA  10           H        ALA  10  -8.130   1.505  -8.712
   73    HA   ALA  10           HA       ALA  10 -10.669   2.414  -9.506
   74    HB1  ALA  10           1HB      ALA  10  -9.252   1.496 -11.163
   75    HB2  ALA  10           2HB      ALA  10  -9.079  -0.020 -10.278
   76    HB3  ALA  10           3HB      ALA  10 -10.624   0.396 -11.020
   77    H    SER  11           H        SER  11  -9.662  -0.510  -7.769
   78    HA   SER  11           HA       SER  11 -12.206  -1.710  -7.634
   79    HB2  SER  11           2HB      SER  11  -9.798  -1.990  -5.823
   80    HB3  SER  11           3HB      SER  11 -11.225  -3.023  -5.738
   81    HG   SER  11           HG       SER  11  -9.527  -3.915  -7.024
   82    H    PHE  12           H        PHE  12 -10.485   0.415  -5.375
   83    HA   PHE  12           HA       PHE  12 -12.556   0.415  -3.421
   84    HB2  PHE  12           2HB      PHE  12 -10.085   2.049  -3.882
   85    HB3  PHE  12           3HB      PHE  12 -11.263   2.565  -2.680
   86    HD1  PHE  12           HD2      PHE  12  -9.828  -0.739  -3.662
   87    HD2  PHE  12           HD1      PHE  12 -10.559   2.081  -0.558
   88    HE1  PHE  12           HE2      PHE  12  -8.831  -2.284  -2.028
   89    HE2  PHE  12           HE1      PHE  12  -9.562   0.540   1.081
   90    HZ   PHE  12           HZ       PHE  12  -8.698  -1.646   0.347
   91    H    ILE  13           H        ILE  13 -11.929   2.241  -6.301
   92    HA   ILE  13           HA       ILE  13 -13.683   4.420  -5.669
   93    HB   ILE  13           HB       ILE  13 -12.231   3.541  -8.133
   94   HG12  ILE  13          2HG1      ILE  13 -11.103   4.924  -6.418
   95   HG13  ILE  13          3HG1      ILE  13 -11.239   5.759  -7.961
   96   HG21  ILE  13          1HG2      ILE  13 -14.501   5.508  -8.012
   97   HG22  ILE  13          2HG2      ILE  13 -13.272   5.551  -9.276
   98   HG23  ILE  13          3HG2      ILE  13 -14.301   4.130  -9.095
   99   HD11  ILE  13          3HD1      ILE  13 -11.948   6.747  -5.493
  100   HD12  ILE  13          1HD1      ILE  13 -12.410   7.413  -7.059
  101   HD13  ILE  13          2HD1      ILE  13 -13.490   6.298  -6.220
  102    H    VAL  14           H        VAL  14 -13.933   1.440  -7.554
  103    HA   VAL  14           HA       VAL  14 -16.550   1.965  -8.547
  104    HB   VAL  14           HB       VAL  14 -15.102  -0.672  -8.261
  105   HG11  VAL  14          1HG1      VAL  14 -17.199  -1.437  -8.649
  106   HG12  VAL  14          2HG1      VAL  14 -17.738   0.081  -9.371
  107   HG13  VAL  14          3HG1      VAL  14 -16.772  -1.053 -10.316
  108   HG21  VAL  14          3HG2      VAL  14 -13.962  -0.199 -10.124
  109   HG22  VAL  14          1HG2      VAL  14 -15.391   0.450 -10.929
  110   HG23  VAL  14          2HG2      VAL  14 -14.441   1.477  -9.856
  111    H    ARG  15           H        ARG  15 -15.321   0.802  -5.556
  112    HA   ARG  15           HA       ARG  15 -17.737  -0.559  -4.762
  113    HB2  ARG  15           2HB      ARG  15 -16.432  -1.443  -3.177
  114    HB3  ARG  15           3HB      ARG  15 -15.086  -0.573  -3.902
  115    HG2  ARG  15           2HG      ARG  15 -15.489   1.312  -2.409
  116    HG3  ARG  15           3HG      ARG  15 -16.854   0.454  -1.691
  117    HD2  ARG  15           2HD      ARG  15 -14.145  -0.811  -1.753
  118    HD3  ARG  15           3HD      ARG  15 -14.528   0.395  -0.526
  119    HE   ARG  15           HE       ARG  15 -16.595  -1.328  -0.340
  120   HH11  ARG  15          1HH1      ARG  15 -13.140  -1.758  -0.347
  121   HH12  ARG  15          2HH1      ARG  15 -13.183  -3.166   0.662
  122   HH21  ARG  15          1HH2      ARG  15 -16.664  -3.180   0.990
  123   HH22  ARG  15          2HH2      ARG  15 -15.187  -3.974   1.422
  124    H    CYS  16           H        CYS  16 -16.204   2.560  -4.159
  125    HA   CYS  16           HA       CYS  16 -18.304   3.380  -2.339
  126    HB2  CYS  16           2HB      CYS  16 -15.973   4.929  -3.489
  127    HB3  CYS  16           3HB      CYS  16 -17.058   5.511  -2.232
  128    HG   CYS  16           HG       CYS  16 -16.272   3.102  -0.647
  129    H    ALA  17           H        ALA  17 -17.340   3.927  -5.669
  130    HA   ALA  17           HA       ALA  17 -19.024   6.104  -6.238
  131    HB1  ALA  17           1HB      ALA  17 -18.102   3.950  -8.137
  132    HB2  ALA  17           2HB      ALA  17 -18.678   5.561  -8.568
  133    HB3  ALA  17           3HB      ALA  17 -17.164   5.374  -7.683
  134    H    PHE  18           H        PHE  18 -19.572   2.621  -6.314
  135    HA   PHE  18           HA       PHE  18 -22.165   2.802  -7.501
  136    HB2  PHE  18           2HB      PHE  18 -20.536   0.777  -7.416
  137    HB3  PHE  18           3HB      PHE  18 -21.249   0.476  -5.835
  138    HD1  PHE  18           HD2      PHE  18 -22.639   1.515  -9.140
  139    HD2  PHE  18           HD1      PHE  18 -22.728  -1.269  -5.922
  140    HE1  PHE  18           HE2      PHE  18 -24.513   0.338 -10.215
  141    HE2  PHE  18           HE1      PHE  18 -24.602  -2.451  -6.992
  142    HZ   PHE  18           HZ       PHE  18 -25.498  -1.648  -9.141
  143    H    GLU  19           H        GLU  19 -20.934   2.591  -4.205
  144    HA   GLU  19           HA       GLU  19 -23.550   2.374  -3.031
  145    HB2  GLU  19           2HB      GLU  19 -21.847   1.368  -1.763
  146    HB3  GLU  19           3HB      GLU  19 -20.779   2.754  -1.934
  147    HG2  GLU  19           2HG      GLU  19 -21.716   3.867  -0.213
  148    HG3  GLU  19           3HG      GLU  19 -23.332   3.244  -0.545
  149    H    HIS  20           H        HIS  20 -21.388   4.935  -3.923
  150    HA   HIS  20           HA       HIS  20 -22.524   6.965  -2.284
  151    HB2  HIS  20           2HB      HIS  20 -20.256   7.117  -3.281
  152    HB3  HIS  20           3HB      HIS  20 -20.990   7.265  -4.875
  153    HD1  HIS  20           HD1      HIS  20 -20.687   9.138  -1.611
  154    HD2  HIS  20           HD2      HIS  20 -21.793   9.800  -5.560
  155    HE1  HIS  20           HE1      HIS  20 -20.966  11.629  -1.822
  156    H    SER  21           H        SER  21 -23.173   5.769  -5.525
  157    HA   SER  21           HA       SER  21 -25.100   7.854  -6.081
  158    HB2  SER  21           2HB      SER  21 -24.531   5.321  -7.638
  159    HB3  SER  21           3HB      SER  21 -25.419   6.732  -8.213
  160    HG   SER  21           HG       SER  21 -22.840   7.152  -7.251
  161    H    ARG  22           H        ARG  22 -25.100   4.498  -5.060
  162    HA   ARG  22           HA       ARG  22 -27.777   3.858  -5.465
  163    HB2  ARG  22           2HB      ARG  22 -25.734   2.447  -4.575
  164    HB3  ARG  22           3HB      ARG  22 -26.379   2.900  -3.003
  165    HG2  ARG  22           2HG      ARG  22 -28.567   1.943  -3.689
  166    HG3  ARG  22           3HG      ARG  22 -27.798   1.373  -5.172
  167    HD2  ARG  22           2HD      ARG  22 -27.218   0.552  -2.338
  168    HD3  ARG  22           3HD      ARG  22 -27.789  -0.454  -3.668
  169    HE   ARG  22           HE       ARG  22 -25.410   0.409  -4.576
  170   HH11  ARG  22          1HH1      ARG  22 -26.393  -1.037  -1.565
  171   HH12  ARG  22          2HH1      ARG  22 -24.865  -1.803  -1.284
  172   HH21  ARG  22          1HH2      ARG  22 -23.394  -0.595  -4.217
  173   HH22  ARG  22          2HH2      ARG  22 -23.159  -1.551  -2.793
  174    H    ARG  23           H        ARG  23 -26.222   5.494  -2.740
  175    HA   ARG  23           HA       ARG  23 -28.409   5.609  -1.013
  176    HB2  ARG  23           2HB      ARG  23 -26.428   6.257  -0.012
  177    HB3  ARG  23           3HB      ARG  23 -25.943   7.255  -1.376
  178    HG2  ARG  23           2HG      ARG  23 -27.135   9.063  -0.660
  179    HG3  ARG  23           3HG      ARG  23 -28.330   8.078   0.187
  180    HD2  ARG  23           2HD      ARG  23 -26.952   7.775   2.035
  181    HD3  ARG  23           3HD      ARG  23 -25.492   8.175   1.132
  182    HE   ARG  23           HE       ARG  23 -25.823  10.360   1.686
  183   HH11  ARG  23          1HH1      ARG  23 -28.848   8.667   2.001
  184   HH12  ARG  23          2HH1      ARG  23 -29.692  10.030   2.660
  185   HH21  ARG  23          1HH2      ARG  23 -26.922  12.162   2.552
  186   HH22  ARG  23          2HH2      ARG  23 -28.595  12.017   2.971
  187    H    PHE  24           H        PHE  24 -27.668   7.452  -3.868
  188    HA   PHE  24           HA       PHE  24 -29.633   9.498  -3.330
  189    HB2  PHE  24           2HB      PHE  24 -27.499   9.848  -4.658
  190    HB3  PHE  24           3HB      PHE  24 -28.260   8.940  -5.960
  191    HD1  PHE  24           HD1      PHE  24 -29.167  11.748  -3.669
  192    HD2  PHE  24           HD2      PHE  24 -29.179  10.197  -7.633
  193    HE1  PHE  24           HE1      PHE  24 -30.245  13.810  -4.469
  194    HE2  PHE  24           HE2      PHE  24 -30.255  12.257  -8.439
  195    HZ   PHE  24           HZ       PHE  24 -30.789  14.067  -6.857
  196    H    THR  25           H        THR  25 -29.359   6.625  -5.360
  197    HA   THR  25           HA       THR  25 -32.002   7.025  -6.486
  198    HB   THR  25           HB       THR  25 -30.018   6.018  -7.751
  199    HG1  THR  25           HG1      THR  25 -31.569   5.369  -9.028
  200   HG21  THR  25          3HG2      THR  25 -29.190   3.997  -7.220
  201   HG22  THR  25          1HG2      THR  25 -30.784   3.334  -6.862
  202   HG23  THR  25          2HG2      THR  25 -29.927   4.276  -5.643
  Start of MODEL    5
    1    H1   GLN   1           H        GLN   1   2.379   0.753   0.665
    2    HA   GLN   1           HA       GLN   1   3.340   0.622  -1.437
    3    HB2  GLN   1           2HB      GLN   1   0.897  -1.128  -1.444
    4    HB3  GLN   1           3HB      GLN   1   1.973  -1.076  -2.834
    5    HG2  GLN   1           2HG      GLN   1   3.044  -1.616  -0.096
    6    HG3  GLN   1           3HG      GLN   1   2.310  -2.902  -1.052
    7   HE21  GLN   1          1HE2      GLN   1   3.405  -3.756  -2.752
    8   HE22  GLN   1          2HE2      GLN   1   5.026  -3.325  -3.166
    9    H    ARG   2           H        ARG   2   3.497   2.155  -2.922
   10    HA   ARG   2           HA       ARG   2   1.212   3.639  -3.820
   11    HB2  ARG   2           2HB      ARG   2   3.974   3.775  -5.013
   12    HB3  ARG   2           3HB      ARG   2   2.748   5.035  -4.957
   13    HG2  ARG   2           2HG      ARG   2   3.265   5.642  -2.837
   14    HG3  ARG   2           3HG      ARG   2   3.731   4.006  -2.365
   15    HD2  ARG   2           2HD      ARG   2   5.759   4.305  -3.854
   16    HD3  ARG   2           3HD      ARG   2   5.325   6.012  -3.941
   17    HE   ARG   2           HE       ARG   2   6.123   6.285  -1.814
   18   HH11  ARG   2          1HH1      ARG   2   5.668   2.890  -2.433
   19   HH12  ARG   2          2HH1      ARG   2   6.432   2.386  -0.961
   20   HH21  ARG   2          1HH2      ARG   2   7.131   5.635   0.126
   21   HH22  ARG   2          2HH2      ARG   2   7.263   3.948   0.494
   22    H    SER   3           H        SER   3   3.413   1.267  -5.248
   23    HA   SER   3           HA       SER   3   2.481   1.375  -7.880
   24    HB2  SER   3           2HB      SER   3   4.538   0.159  -7.024
   25    HB3  SER   3           3HB      SER   3   3.456  -1.133  -6.504
   26    HG   SER   3           HG       SER   3   4.384  -0.548  -8.989
   27    H    ASN   4           H        ASN   4   1.331  -0.472  -5.100
   28    HA   ASN   4           HA       ASN   4  -0.685  -1.845  -6.639
   29    HB2  ASN   4           2HB      ASN   4  -0.235  -1.685  -3.650
   30    HB3  ASN   4           3HB      ASN   4  -1.405  -2.738  -4.439
   31   HD21  ASN   4          1HD2      ASN   4  -0.704  -4.545  -5.532
   32   HD22  ASN   4          2HD2      ASN   4   0.910  -5.148  -5.399
   33    H    PHE   5           H        PHE   5  -0.411   1.144  -5.006
   34    HA   PHE   5           HA       PHE   5  -3.104   1.548  -4.257
   35    HB2  PHE   5           2HB      PHE   5  -1.150   2.901  -3.454
   36    HB3  PHE   5           3HB      PHE   5  -1.094   3.667  -5.038
   37    HD1  PHE   5           HD1      PHE   5  -3.751   2.864  -2.538
   38    HD2  PHE   5           HD2      PHE   5  -1.960   5.781  -5.067
   39    HE1  PHE   5           HE1      PHE   5  -5.403   4.525  -1.785
   40    HE2  PHE   5           HE2      PHE   5  -3.608   7.447  -4.318
   41    HZ   PHE   5           HZ       PHE   5  -5.332   6.821  -2.674
   42    H    HIS   6           H        HIS   6  -1.321   2.191  -7.230
   43    HA   HIS   6           HA       HIS   6  -3.226   3.717  -8.577
   44    HB2  HIS   6           2HB      HIS   6  -0.919   2.033  -9.358
   45    HB3  HIS   6           3HB      HIS   6  -2.103   2.354 -10.622
   46    HD1  HIS   6           HD1      HIS   6  -0.235   3.766 -11.829
   47    HD2  HIS   6           HD2      HIS   6  -1.497   5.271  -8.168
   48    HE1  HIS   6           HE1      HIS   6   0.608   6.134 -11.749
   49    HA   PRO   7           HA       PRO   7  -5.008  -0.399 -10.385
   50    HB2  PRO   7           2HB      PRO   7  -4.235  -2.710  -9.189
   51    HB3  PRO   7           3HB      PRO   7  -3.365  -1.996 -10.552
   52    HG2  PRO   7           2HG      PRO   7  -2.748  -1.854  -7.626
   53    HG3  PRO   7           3HG      PRO   7  -1.646  -2.116  -8.990
   54    HD2  PRO   7           2HD      PRO   7  -1.920   0.291  -7.780
   55    HD3  PRO   7           3HD      PRO   7  -1.554   0.128  -9.509
   56    H    LEU   8           H        LEU   8  -4.444  -0.023  -6.963
   57    HA   LEU   8           HA       LEU   8  -6.826  -1.452  -6.181
   58    HB2  LEU   8           2HB      LEU   8  -4.979  -1.508  -4.676
   59    HB3  LEU   8           3HB      LEU   8  -4.857   0.250  -4.670
   60    HG   LEU   8           HG       LEU   8  -7.376  -0.974  -3.671
   61   HD11  LEU   8          1HD1      LEU   8  -4.798  -1.664  -2.625
   62   HD12  LEU   8          2HD1      LEU   8  -6.396  -2.186  -2.095
   63   HD13  LEU   8          3HD1      LEU   8  -5.692  -0.706  -1.445
   64   HD21  LEU   8          3HD2      LEU   8  -7.521   1.297  -3.519
   65   HD22  LEU   8          1HD2      LEU   8  -5.784   1.506  -3.293
   66   HD23  LEU   8          2HD2      LEU   8  -6.787   0.949  -1.953
   67    H    ALA   9           H        ALA   9  -5.971   1.778  -7.038
   68    HA   ALA   9           HA       ALA   9  -7.943   3.237  -5.696
   69    HB1  ALA   9           1HB      ALA   9  -7.661   4.895  -7.546
   70    HB2  ALA   9           2HB      ALA   9  -6.157   4.391  -6.774
   71    HB3  ALA   9           3HB      ALA   9  -6.604   3.732  -8.348
   72    H    ALA  10           H        ALA  10  -8.038   1.548  -8.805
   73    HA   ALA  10           HA       ALA  10 -10.589   2.412  -9.612
   74    HB1  ALA  10           1HB      ALA  10 -10.548   0.334 -11.043
   75    HB2  ALA  10           2HB      ALA  10  -9.182   1.433 -11.243
   76    HB3  ALA  10           3HB      ALA  10  -8.994  -0.045 -10.299
   77    H    SER  11           H        SER  11  -9.552  -0.434  -7.767
   78    HA   SER  11           HA       SER  11 -12.088  -1.640  -7.560
   79    HB2  SER  11           2HB      SER  11  -9.661  -1.836  -5.762
   80    HB3  SER  11           3HB      SER  11 -11.083  -2.870  -5.621
   81    HG   SER  11           HG       SER  11  -9.431  -3.835  -6.883
   82    H    PHE  12           H        PHE  12 -10.357   0.583  -5.405
   83    HA   PHE  12           HA       PHE  12 -12.411   0.651  -3.434
   84    HB2  PHE  12           2HB      PHE  12  -9.952   2.277  -3.983
   85    HB3  PHE  12           3HB      PHE  12 -11.122   2.837  -2.792
   86    HD1  PHE  12           HD1      PHE  12  -9.680  -0.498  -3.652
   87    HD2  PHE  12           HD2      PHE  12 -10.398   2.441  -0.658
   88    HE1  PHE  12           HE1      PHE  12  -8.662  -1.972  -1.966
   89    HE2  PHE  12           HE2      PHE  12  -9.380   0.972   1.033
   90    HZ   PHE  12           HZ       PHE  12  -8.509  -1.237   0.380
   91    H    ILE  13           H        ILE  13 -11.819   2.363  -6.390
   92    HA   ILE  13           HA       ILE  13 -13.578   4.557  -5.831
   93    HB   ILE  13           HB       ILE  13 -12.144   3.586  -8.271
   94   HG12  ILE  13          2HG1      ILE  13 -11.008   5.043  -6.623
   95   HG13  ILE  13          3HG1      ILE  13 -11.161   5.813  -8.198
   96   HG21  ILE  13          1HG2      ILE  13 -14.423   5.546  -8.209
   97   HG22  ILE  13          2HG2      ILE  13 -13.206   5.543  -9.484
   98   HG23  ILE  13          3HG2      ILE  13 -14.226   4.126  -9.237
   99   HD11  ILE  13          3HD1      ILE  13 -13.401   6.412  -6.461
  100   HD12  ILE  13          1HD1      ILE  13 -11.855   6.899  -5.767
  101   HD13  ILE  13          2HD1      ILE  13 -12.337   7.496  -7.356
  102    H    VAL  14           H        VAL  14 -13.830   1.502  -7.592
  103    HA   VAL  14           HA       VAL  14 -16.459   1.974  -8.580
  104    HB   VAL  14           HB       VAL  14 -14.995  -0.643  -8.202
  105   HG11  VAL  14          1HG1      VAL  14 -16.730  -0.992 -10.279
  106   HG12  VAL  14          2HG1      VAL  14 -17.017  -1.518  -8.619
  107   HG13  VAL  14          3HG1      VAL  14 -17.671   0.020  -9.184
  108   HG21  VAL  14          3HG2      VAL  14 -15.245   0.187 -10.922
  109   HG22  VAL  14          1HG2      VAL  14 -14.520   1.493  -9.985
  110   HG23  VAL  14          2HG2      VAL  14 -13.781  -0.108  -9.984
  111    H    ARG  15           H        ARG  15 -15.197   0.939  -5.556
  112    HA   ARG  15           HA       ARG  15 -17.598  -0.401  -4.686
  113    HB2  ARG  15           2HB      ARG  15 -16.275  -1.213  -3.079
  114    HB3  ARG  15           3HB      ARG  15 -14.940  -0.367  -3.851
  115    HG2  ARG  15           2HG      ARG  15 -15.339   1.575  -2.432
  116    HG3  ARG  15           3HG      ARG  15 -16.693   0.740  -1.667
  117    HD2  ARG  15           2HD      ARG  15 -13.872  -0.314  -1.676
  118    HD3  ARG  15           3HD      ARG  15 -14.531   0.689  -0.385
  119    HE   ARG  15           HE       ARG  15 -15.000  -2.092  -0.802
  120   HH11  ARG  15          1HH1      ARG  15 -16.444   0.842   0.393
  121   HH12  ARG  15          2HH1      ARG  15 -17.520   0.025   1.477
  122   HH21  ARG  15          1HH2      ARG  15 -16.413  -3.179   0.621
  123   HH22  ARG  15          2HH2      ARG  15 -17.501  -2.262   1.607
  124    H    CYS  16           H        CYS  16 -16.076   2.748  -4.223
  125    HA   CYS  16           HA       CYS  16 -18.164   3.631  -2.420
  126    HB2  CYS  16           2HB      CYS  16 -15.851   5.144  -3.652
  127    HB3  CYS  16           3HB      CYS  16 -16.928   5.770  -2.409
  128    HG   CYS  16           HG       CYS  16 -16.033   4.240  -0.376
  129    H    ALA  17           H        ALA  17 -17.233   4.047  -5.777
  130    HA   ALA  17           HA       ALA  17 -18.932   6.191  -6.419
  131    HB1  ALA  17           1HB      ALA  17 -17.083   5.412  -7.850
  132    HB2  ALA  17           2HB      ALA  17 -18.017   3.966  -8.237
  133    HB3  ALA  17           3HB      ALA  17 -18.606   5.554  -8.728
  134    H    PHE  18           H        PHE  18 -19.465   2.706  -6.350
  135    HA   PHE  18           HA       PHE  18 -22.071   2.830  -7.515
  136    HB2  PHE  18           2HB      PHE  18 -20.430   0.818  -7.374
  137    HB3  PHE  18           3HB      PHE  18 -21.127   0.570  -5.777
  138    HD1  PHE  18           HD2      PHE  18 -21.825   0.600  -9.385
  139    HD2  PHE  18           HD1      PHE  18 -23.327  -0.299  -5.505
  140    HE1  PHE  18           HE2      PHE  18 -23.702  -0.624 -10.399
  141    HE2  PHE  18           HE1      PHE  18 -25.206  -1.526  -6.513
  142    HZ   PHE  18           HZ       PHE  18 -25.396  -1.688  -8.963
  143    H    GLU  19           H        GLU  19 -20.802   2.741  -4.228
  144    HA   GLU  19           HA       GLU  19 -23.399   2.551  -3.013
  145    HB2  GLU  19           2HB      GLU  19 -21.673   1.613  -1.726
  146    HB3  GLU  19           3HB      GLU  19 -20.617   2.997  -1.970
  147    HG2  GLU  19           2HG      GLU  19 -21.538   4.175  -0.283
  148    HG3  GLU  19           3HG      GLU  19 -23.153   3.529  -0.566
  149    H    HIS  20           H        HIS  20 -21.269   5.098  -4.024
  150    HA   HIS  20           HA       HIS  20 -22.403   7.179  -2.453
  151    HB2  HIS  20           2HB      HIS  20 -20.155   7.314  -3.494
  152    HB3  HIS  20           3HB      HIS  20 -20.918   7.390  -5.080
  153    HD1  HIS  20           HD1      HIS  20 -22.567   9.548  -5.397
  154    HD2  HIS  20           HD2      HIS  20 -19.764   9.736  -2.336
  155    HE1  HIS  20           HE1      HIS  20 -22.372  11.986  -4.812
  156    H    SER  21           H        SER  21 -23.094   5.852  -5.634
  157    HA   SER  21           HA       SER  21 -25.059   7.891  -6.227
  158    HB2  SER  21           2HB      SER  21 -24.467   5.322  -7.715
  159    HB3  SER  21           3HB      SER  21 -25.392   6.697  -8.319
  160    HG   SER  21           HG       SER  21 -22.808   7.198  -7.413
  161    H    ARG  22           H        ARG  22 -24.982   4.587  -5.070
  162    HA   ARG  22           HA       ARG  22 -27.634   3.848  -5.431
  163    HB2  ARG  22           2HB      ARG  22 -25.541   2.575  -4.427
  164    HB3  ARG  22           3HB      ARG  22 -26.250   3.084  -2.900
  165    HG2  ARG  22           2HG      ARG  22 -28.366   1.991  -3.566
  166    HG3  ARG  22           3HG      ARG  22 -27.563   1.404  -5.023
  167    HD2  ARG  22           2HD      ARG  22 -27.421  -0.387  -3.529
  168    HD3  ARG  22           3HD      ARG  22 -25.837   0.382  -3.435
  169    HE   ARG  22           HE       ARG  22 -26.279   0.966  -1.258
  170   HH11  ARG  22          1HH1      ARG  22 -29.211  -0.112  -2.794
  171   HH12  ARG  22          2HH1      ARG  22 -30.122  -0.155  -1.321
  172   HH21  ARG  22          1HH2      ARG  22 -27.467   0.914   0.688
  173   HH22  ARG  22          2HH2      ARG  22 -29.129   0.430   0.659
  174    H    ARG  23           H        ARG  23 -26.148   5.681  -2.791
  175    HA   ARG  23           HA       ARG  23 -28.356   5.843  -1.097
  176    HB2  ARG  23           2HB      ARG  23 -26.393   8.096  -1.464
  177    HB3  ARG  23           3HB      ARG  23 -27.235   7.611   0.001
  178    HG2  ARG  23           2HG      ARG  23 -25.777   5.366  -0.731
  179    HG3  ARG  23           3HG      ARG  23 -24.698   6.726  -1.048
  180    HD2  ARG  23           2HD      ARG  23 -24.278   6.146   1.181
  181    HD3  ARG  23           3HD      ARG  23 -25.337   7.552   1.279
  182    HE   ARG  23           HE       ARG  23 -26.738   5.044   1.343
  183   HH11  ARG  23          1HH1      ARG  23 -25.071   7.441   3.238
  184   HH12  ARG  23          2HH1      ARG  23 -25.883   7.029   4.712
  185   HH21  ARG  23          1HH2      ARG  23 -27.813   4.491   3.277
  186   HH22  ARG  23          2HH2      ARG  23 -27.442   5.350   4.734
  187    H    PHE  24           H        PHE  24 -27.619   7.550  -4.039
  188    HA   PHE  24           HA       PHE  24 -29.649   9.564  -3.640
  189    HB2  PHE  24           2HB      PHE  24 -27.503   9.905  -4.952
  190    HB3  PHE  24           3HB      PHE  24 -28.217   8.908  -6.215
  191    HD1  PHE  24           HD1      PHE  24 -30.188   9.697  -7.451
  192    HD2  PHE  24           HD2      PHE  24 -28.192  12.156  -4.608
  193    HE1  PHE  24           HE1      PHE  24 -31.310  11.679  -8.383
  194    HE2  PHE  24           HE2      PHE  24 -29.311  14.142  -5.534
  195    HZ   PHE  24           HZ       PHE  24 -30.873  13.905  -7.423
  196    H    THR  25           H        THR  25 -29.263   6.595  -5.506
  197    HA   THR  25           HA       THR  25 -31.897   6.861  -6.694
  198    HB   THR  25           HB       THR  25 -29.864   5.844  -7.872
  199    HG1  THR  25           HG1      THR  25 -32.216   5.603  -8.422
  200   HG21  THR  25          3HG2      THR  25 -30.575   3.191  -6.852
  201   HG22  THR  25          1HG2      THR  25 -29.762   4.220  -5.673
  202   HG23  THR  25          2HG2      THR  25 -28.993   3.876  -7.222
  Start of MODEL    6
    1    H1   GLN   1           H        GLN   1   1.800  -0.511   0.215
    2    HA   GLN   1           HA       GLN   1   3.329   0.586  -1.356
    3    HB2  GLN   1           2HB      GLN   1   1.777  -1.502  -2.877
    4    HB3  GLN   1           3HB      GLN   1   3.486  -1.111  -3.013
    5    HG2  GLN   1           2HG      GLN   1   2.113  -2.461  -0.703
    6    HG3  GLN   1           3HG      GLN   1   3.245  -3.184  -1.844
    7   HE21  GLN   1          1HE2      GLN   1   3.342  -2.942   1.086
    8   HE22  GLN   1          2HE2      GLN   1   4.835  -2.148   1.438
    9    H    ARG   2           H        ARG   2   3.607   1.803  -3.210
   10    HA   ARG   2           HA       ARG   2   1.317   3.315  -4.048
   11    HB2  ARG   2           2HB      ARG   2   4.051   3.427  -5.305
   12    HB3  ARG   2           3HB      ARG   2   2.840   4.699  -5.216
   13    HG2  ARG   2           2HG      ARG   2   3.413   5.292  -3.106
   14    HG3  ARG   2           3HG      ARG   2   3.874   3.650  -2.651
   15    HD2  ARG   2           2HD      ARG   2   5.868   3.936  -4.190
   16    HD3  ARG   2           3HD      ARG   2   5.450   5.648  -4.254
   17    HE   ARG   2           HE       ARG   2   6.683   4.246  -2.071
   18   HH11  ARG   2          1HH1      ARG   2   4.762   7.004  -2.979
   19   HH12  ARG   2          2HH1      ARG   2   5.221   7.942  -1.596
   20   HH21  ARG   2          1HH2      ARG   2   7.294   5.471  -0.247
   21   HH22  ARG   2          2HH2      ARG   2   6.661   7.070  -0.043
   22    H    SER   3           H        SER   3   3.459   0.926  -5.536
   23    HA   SER   3           HA       SER   3   2.467   1.054  -8.145
   24    HB2  SER   3           2HB      SER   3   4.531  -0.186  -7.341
   25    HB3  SER   3           3HB      SER   3   3.448  -1.469  -6.800
   26    HG   SER   3           HG       SER   3   4.381  -1.659  -8.990
   27    H    ASN   4           H        ASN   4   1.363  -0.792  -5.345
   28    HA   ASN   4           HA       ASN   4  -0.702  -2.138  -6.842
   29    HB2  ASN   4           2HB      ASN   4  -0.182  -1.993  -3.864
   30    HB3  ASN   4           3HB      ASN   4  -1.381  -3.031  -4.629
   31   HD21  ASN   4          1HD2      ASN   4  -0.109  -4.038  -6.760
   32   HD22  ASN   4          2HD2      ASN   4   1.262  -4.970  -6.273
   33    H    PHE   5           H        PHE   5  -0.359   0.843  -5.207
   34    HA   PHE   5           HA       PHE   5  -3.030   1.272  -4.394
   35    HB2  PHE   5           2HB      PHE   5  -1.043   2.601  -3.633
   36    HB3  PHE   5           3HB      PHE   5  -1.017   3.373  -5.214
   37    HD1  PHE   5           HD2      PHE   5  -2.729   4.964  -5.852
   38    HD2  PHE   5           HD1      PHE   5  -2.755   3.119  -2.017
   39    HE1  PHE   5           HE2      PHE   5  -4.343   6.643  -5.059
   40    HE2  PHE   5           HE1      PHE   5  -4.370   4.794  -1.218
   41    HZ   PHE   5           HZ       PHE   5  -5.165   6.560  -2.739
   42    H    HIS   6           H        HIS   6  -1.310   1.907  -7.405
   43    HA   HIS   6           HA       HIS   6  -3.229   3.458  -8.702
   44    HB2  HIS   6           2HB      HIS   6  -0.959   1.752  -9.543
   45    HB3  HIS   6           3HB      HIS   6  -2.168   2.090 -10.778
   46    HD1  HIS   6           HD1      HIS   6  -1.955   4.268 -11.959
   47    HD2  HIS   6           HD2      HIS   6   0.174   4.206  -8.392
   48    HE1  HIS   6           HE1      HIS   6  -0.667   6.428 -11.906
   49    HA   PRO   7           HA       PRO   7  -5.096  -0.633 -10.482
   50    HB2  PRO   7           2HB      PRO   7  -4.320  -2.957  -9.312
   51    HB3  PRO   7           3HB      PRO   7  -3.474  -2.247 -10.692
   52    HG2  PRO   7           2HG      PRO   7  -2.788  -2.122  -7.781
   53    HG3  PRO   7           3HG      PRO   7  -1.721  -2.390  -9.171
   54    HD2  PRO   7           2HD      PRO   7  -1.941   0.015  -7.947
   55    HD3  PRO   7           3HD      PRO   7  -1.618  -0.146  -9.685
   56    H    LEU   8           H        LEU   8  -4.449  -0.275  -7.073
   57    HA   LEU   8           HA       LEU   8  -6.827  -1.682  -6.241
   58    HB2  LEU   8           2HB      LEU   8  -4.947  -1.763  -4.779
   59    HB3  LEU   8           3HB      LEU   8  -4.805  -0.006  -4.770
   60    HG   LEU   8           HG       LEU   8  -7.315  -1.204  -3.717
   61   HD11  LEU   8          1HD1      LEU   8  -5.549  -0.959  -1.540
   62   HD12  LEU   8          2HD1      LEU   8  -4.735  -1.956  -2.745
   63   HD13  LEU   8          3HD1      LEU   8  -6.328  -2.419  -2.150
   64   HD21  LEU   8          3HD2      LEU   8  -6.693   0.702  -2.010
   65   HD22  LEU   8          1HD2      LEU   8  -7.409   1.078  -3.578
   66   HD23  LEU   8          2HD2      LEU   8  -5.670   1.248  -3.339
   67    H    ALA   9           H        ALA   9  -5.958   1.542  -7.106
   68    HA   ALA   9           HA       ALA   9  -7.883   3.017  -5.714
   69    HB1  ALA   9           1HB      ALA   9  -7.627   4.677  -7.566
   70    HB2  ALA   9           2HB      ALA   9  -6.110   4.156  -6.831
   71    HB3  ALA   9           3HB      ALA   9  -6.601   3.506  -8.395
   72    H    ALA  10           H        ALA  10  -8.068   1.339  -8.826
   73    HA   ALA  10           HA       ALA  10 -10.628   2.232  -9.571
   74    HB1  ALA  10           1HB      ALA  10  -9.270   1.245 -11.237
   75    HB2  ALA  10           2HB      ALA  10  -9.075  -0.238 -10.301
   76    HB3  ALA  10           3HB      ALA  10 -10.641   0.159 -11.008
   77    H    SER  11           H        SER  11  -9.579  -0.631  -7.759
   78    HA   SER  11           HA       SER  11 -12.122  -1.810  -7.496
   79    HB2  SER  11           2HB      SER  11  -9.657  -2.036  -5.755
   80    HB3  SER  11           3HB      SER  11 -11.086  -3.056  -5.585
   81    HG   SER  11           HG       SER  11  -9.314  -2.886  -7.787
   82    H    PHE  12           H        PHE  12 -10.318   0.388  -5.375
   83    HA   PHE  12           HA       PHE  12 -12.325   0.473  -3.357
   84    HB2  PHE  12           2HB      PHE  12  -9.863   2.075  -3.958
   85    HB3  PHE  12           3HB      PHE  12 -10.999   2.642  -2.739
   86    HD1  PHE  12           HD2      PHE  12  -9.611  -0.704  -3.642
   87    HD2  PHE  12           HD1      PHE  12 -10.229   2.233  -0.624
   88    HE1  PHE  12           HE2      PHE  12  -8.568  -2.193  -1.984
   89    HE2  PHE  12           HE1      PHE  12  -9.187   0.749   1.038
   90    HZ   PHE  12           HZ       PHE  12  -8.355  -1.468   0.359
   91    H    ILE  13           H        ILE  13 -11.783   2.187  -6.322
   92    HA   ILE  13           HA       ILE  13 -13.506   4.398  -5.716
   93    HB   ILE  13           HB       ILE  13 -12.140   3.419  -8.191
   94   HG12  ILE  13          2HG1      ILE  13 -10.950   4.858  -6.566
   95   HG13  ILE  13          3HG1      ILE  13 -11.132   5.635  -8.135
   96   HG21  ILE  13          1HG2      ILE  13 -14.395   5.402  -8.071
   97   HG22  ILE  13          2HG2      ILE  13 -13.208   5.390  -9.375
   98   HG23  ILE  13          3HG2      ILE  13 -14.238   3.983  -9.107
   99   HD11  ILE  13          3HD1      ILE  13 -12.271   7.327  -7.264
  100   HD12  ILE  13          1HD1      ILE  13 -13.323   6.252  -6.343
  101   HD13  ILE  13          2HD1      ILE  13 -11.754   6.724  -5.689
  102    H    VAL  14           H        VAL  14 -13.831   1.350  -7.479
  103    HA   VAL  14           HA       VAL  14 -16.477   1.853  -8.405
  104    HB   VAL  14           HB       VAL  14 -15.033  -0.780  -8.066
  105   HG11  VAL  14          1HG1      VAL  14 -17.622  -0.036  -9.385
  106   HG12  VAL  14          2HG1      VAL  14 -16.701  -1.452  -9.898
  107   HG13  VAL  14          3HG1      VAL  14 -17.294  -1.337  -8.241
  108   HG21  VAL  14          3HG2      VAL  14 -15.334   0.054 -10.778
  109   HG22  VAL  14          1HG2      VAL  14 -14.581   1.356  -9.857
  110   HG23  VAL  14          2HG2      VAL  14 -13.852  -0.251  -9.871
  111    H    ARG  15           H        ARG  15 -15.157   0.797  -5.413
  112    HA   ARG  15           HA       ARG  15 -17.551  -0.520  -4.491
  113    HB2  ARG  15           2HB      ARG  15 -16.199  -1.349  -2.916
  114    HB3  ARG  15           3HB      ARG  15 -14.874  -0.515  -3.716
  115    HG2  ARG  15           2HG      ARG  15 -15.220   1.428  -2.285
  116    HG3  ARG  15           3HG      ARG  15 -16.565   0.606  -1.490
  117    HD2  ARG  15           2HD      ARG  15 -14.116  -0.975  -1.540
  118    HD3  ARG  15           3HD      ARG  15 -13.934   0.556  -0.686
  119    HE   ARG  15           HE       ARG  15 -16.300  -0.772   0.130
  120   HH11  ARG  15          1HH1      ARG  15 -12.837  -0.860   0.473
  121   HH12  ARG  15          2HH1      ARG  15 -12.880  -1.606   2.037
  122   HH21  ARG  15          1HH2      ARG  15 -16.370  -1.754   2.188
  123   HH22  ARG  15          2HH2      ARG  15 -14.890  -2.115   3.010
  124    H    CYS  16           H        CYS  16 -15.986   2.612  -4.055
  125    HA   CYS  16           HA       CYS  16 -18.023   3.512  -2.203
  126    HB2  CYS  16           2HB      CYS  16 -15.724   5.004  -3.484
  127    HB3  CYS  16           3HB      CYS  16 -16.766   5.638  -2.216
  128    HG   CYS  16           HG       CYS  16 -13.982   4.428  -1.667
  129    H    ALA  17           H        ALA  17 -17.162   3.930  -5.579
  130    HA   ALA  17           HA       ALA  17 -18.849   6.093  -6.181
  131    HB1  ALA  17           1HB      ALA  17 -17.048   5.290  -7.658
  132    HB2  ALA  17           2HB      ALA  17 -18.008   3.854  -8.017
  133    HB3  ALA  17           3HB      ALA  17 -18.592   5.447  -8.498
  134    H    PHE  18           H        PHE  18 -19.430   2.614  -6.104
  135    HA   PHE  18           HA       PHE  18 -22.067   2.785  -7.196
  136    HB2  PHE  18           2HB      PHE  18 -20.444   0.748  -7.109
  137    HB3  PHE  18           3HB      PHE  18 -21.117   0.495  -5.502
  138    HD1  PHE  18           HD1      PHE  18 -22.050   0.836  -9.074
  139    HD2  PHE  18           HD2      PHE  18 -23.151  -0.606  -5.224
  140    HE1  PHE  18           HE1      PHE  18 -23.964  -0.348 -10.069
  141    HE2  PHE  18           HE2      PHE  18 -25.065  -1.794  -6.213
  142    HZ   PHE  18           HZ       PHE  18 -25.474  -1.666  -8.638
  143    H    GLU  19           H        GLU  19 -20.706   2.629  -3.945
  144    HA   GLU  19           HA       GLU  19 -23.262   2.463  -2.652
  145    HB2  GLU  19           2HB      GLU  19 -21.533   1.520  -1.396
  146    HB3  GLU  19           3HB      GLU  19 -20.440   2.859  -1.716
  147    HG2  GLU  19           2HG      GLU  19 -21.193   2.851   0.596
  148    HG3  GLU  19           3HG      GLU  19 -21.733   4.298  -0.253
  149    H    HIS  20           H        HIS  20 -21.154   5.007  -3.718
  150    HA   HIS  20           HA       HIS  20 -22.255   7.083  -2.110
  151    HB2  HIS  20           2HB      HIS  20 -20.015   7.204  -3.186
  152    HB3  HIS  20           3HB      HIS  20 -20.806   7.320  -4.755
  153    HD1  HIS  20           HD1      HIS  20 -20.385   9.258  -1.542
  154    HD2  HIS  20           HD2      HIS  20 -21.640   9.841  -5.459
  155    HE1  HIS  20           HE1      HIS  20 -20.676  11.743  -1.792
  156    H    SER  21           H        SER  21 -23.005   5.752  -5.270
  157    HA   SER  21           HA       SER  21 -24.934   7.815  -5.876
  158    HB2  SER  21           2HB      SER  21 -24.457   5.184  -7.294
  159    HB3  SER  21           3HB      SER  21 -25.342   6.573  -7.923
  160    HG   SER  21           HG       SER  21 -22.598   6.604  -7.199
  161    H    ARG  22           H        ARG  22 -24.942   4.508  -4.689
  162    HA   ARG  22           HA       ARG  22 -27.659   3.930  -4.938
  163    HB2  ARG  22           2HB      ARG  22 -25.581   3.015  -2.956
  164    HB3  ARG  22           3HB      ARG  22 -27.231   2.405  -2.931
  165    HG2  ARG  22           2HG      ARG  22 -26.050   2.265  -5.576
  166    HG3  ARG  22           3HG      ARG  22 -25.120   1.372  -4.370
  167    HD2  ARG  22           2HD      ARG  22 -26.726  -0.182  -4.101
  168    HD3  ARG  22           3HD      ARG  22 -28.028   1.002  -4.211
  169    HE   ARG  22           HE       ARG  22 -26.908   0.690  -6.753
  170   HH11  ARG  22          1HH1      ARG  22 -28.744  -1.135  -4.426
  171   HH12  ARG  22          2HH1      ARG  22 -29.528  -2.116  -5.620
  172   HH21  ARG  22          1HH2      ARG  22 -27.934  -0.594  -8.334
  173   HH22  ARG  22          2HH2      ARG  22 -29.066  -1.808  -7.842
  174    H    ARG  23           H        ARG  23 -25.900   5.587  -2.355
  175    HA   ARG  23           HA       ARG  23 -27.980   5.808  -0.508
  176    HB2  ARG  23           2HB      ARG  23 -25.908   6.400   0.348
  177    HB3  ARG  23           3HB      ARG  23 -25.497   7.385  -1.050
  178    HG2  ARG  23           2HG      ARG  23 -25.859   8.790   0.873
  179    HG3  ARG  23           3HG      ARG  23 -27.128   9.071  -0.320
  180    HD2  ARG  23           2HD      ARG  23 -28.202   7.076   1.212
  181    HD3  ARG  23           3HD      ARG  23 -27.299   8.013   2.402
  182    HE   ARG  23           HE       ARG  23 -28.889   9.671   0.710
  183   HH11  ARG  23          1HH1      ARG  23 -28.992   7.584   3.494
  184   HH12  ARG  23          2HH1      ARG  23 -30.378   8.360   4.187
  185   HH21  ARG  23          1HH2      ARG  23 -30.714  10.701   1.611
  186   HH22  ARG  23          2HH2      ARG  23 -31.357  10.132   3.114
  187    H    PHE  24           H        PHE  24 -27.360   7.541  -3.453
  188    HA   PHE  24           HA       PHE  24 -29.204   9.680  -2.855
  189    HB2  PHE  24           2HB      PHE  24 -27.153   9.902  -4.334
  190    HB3  PHE  24           3HB      PHE  24 -28.036   8.985  -5.550
  191    HD1  PHE  24           HD1      PHE  24 -30.310   9.921  -6.292
  192    HD2  PHE  24           HD2      PHE  24 -27.381  12.202  -4.210
  193    HE1  PHE  24           HE1      PHE  24 -31.362  11.996  -7.093
  194    HE2  PHE  24           HE2      PHE  24 -28.429  14.281  -5.007
  195    HZ   PHE  24           HZ       PHE  24 -30.422  14.180  -6.450
  196    H    THR  25           H        THR  25 -29.179   6.736  -4.799
  197    HA   THR  25           HA       THR  25 -31.877   7.209  -5.758
  198    HB   THR  25           HB       THR  25 -30.019   6.084  -7.118
  199    HG1  THR  25           HG1      THR  25 -32.679   5.232  -6.830
  200   HG21  THR  25          3HG2      THR  25 -29.566   4.486  -5.113
  201   HG22  THR  25          1HG2      THR  25 -29.474   3.859  -6.758
  202   HG23  THR  25          2HG2      THR  25 -30.910   3.559  -5.779
  Start of MODEL    7
    1    H1   GLN   1           H        GLN   1   4.383  -0.549  -1.463
    2    HA   GLN   1           HA       GLN   1   2.238  -1.031  -2.112
    3    HB2  GLN   1           2HB      GLN   1   2.216  -0.362   0.406
    4    HB3  GLN   1           3HB      GLN   1   1.368   1.072  -0.158
    5    HG2  GLN   1           2HG      GLN   1  -0.519  -0.069  -0.666
    6    HG3  GLN   1           3HG      GLN   1   0.351  -1.540  -1.095
    7   HE21  GLN   1          1HE2      GLN   1  -1.988  -0.983   0.685
    8   HE22  GLN   1          2HE2      GLN   1  -1.577  -1.721   2.192
    9    H    ARG   2           H        ARG   2   3.582   1.684  -3.090
   10    HA   ARG   2           HA       ARG   2   1.306   3.243  -3.878
   11    HB2  ARG   2           2HB      ARG   2   4.062   3.429  -5.077
   12    HB3  ARG   2           3HB      ARG   2   2.848   4.694  -4.934
   13    HG2  ARG   2           2HG      ARG   2   3.383   5.160  -2.783
   14    HG3  ARG   2           3HG      ARG   2   3.835   3.494  -2.418
   15    HD2  ARG   2           2HD      ARG   2   5.859   3.865  -3.893
   16    HD3  ARG   2           3HD      ARG   2   5.441   5.578  -3.877
   17    HE   ARG   2           HE       ARG   2   5.632   4.450  -1.251
   18   HH11  ARG   2          1HH1      ARG   2   7.445   5.816  -3.891
   19   HH12  ARG   2          2HH1      ARG   2   8.758   6.340  -2.889
   20   HH21  ARG   2          1HH2      ARG   2   7.354   5.135   0.078
   21   HH22  ARG   2          2HH2      ARG   2   8.705   5.952  -0.632
   22    H    SER   3           H        SER   3   3.476   0.945  -5.467
   23    HA   SER   3           HA       SER   3   2.529   1.230  -8.081
   24    HB2  SER   3           2HB      SER   3   3.606  -1.269  -6.751
   25    HB3  SER   3           3HB      SER   3   3.488  -0.996  -8.489
   26    HG   SER   3           HG       SER   3   4.974   0.692  -8.276
   27    H    ASN   4           H        ASN   4   1.380  -0.781  -5.417
   28    HA   ASN   4           HA       ASN   4  -0.658  -2.036  -7.027
   29    HB2  ASN   4           2HB      ASN   4  -0.188  -2.070  -4.037
   30    HB3  ASN   4           3HB      ASN   4  -1.373  -3.060  -4.884
   31   HD21  ASN   4          1HD2      ASN   4  -0.191  -4.087  -6.961
   32   HD22  ASN   4          2HD2      ASN   4   1.222  -4.988  -6.542
   33    H    PHE   5           H        PHE   5  -0.347   0.841  -5.210
   34    HA   PHE   5           HA       PHE   5  -3.032   1.220  -4.419
   35    HB2  PHE   5           2HB      PHE   5  -1.063   2.501  -3.543
   36    HB3  PHE   5           3HB      PHE   5  -1.006   3.366  -5.076
   37    HD1  PHE   5           HD2      PHE   5  -3.907   2.371  -2.967
   38    HD2  PHE   5           HD1      PHE   5  -1.603   5.547  -4.618
   39    HE1  PHE   5           HE2      PHE   5  -5.539   3.998  -2.105
   40    HE2  PHE   5           HE1      PHE   5  -3.231   7.180  -3.757
   41    HZ   PHE   5           HZ       PHE   5  -5.202   6.406  -2.500
   42    H    HIS   6           H        HIS   6  -1.261   2.035  -7.356
   43    HA   HIS   6           HA       HIS   6  -3.159   3.661  -8.591
   44    HB2  HIS   6           2HB      HIS   6  -0.873   2.009  -9.493
   45    HB3  HIS   6           3HB      HIS   6  -2.061   2.422 -10.726
   46    HD1  HIS   6           HD1      HIS   6   0.543   3.931  -8.515
   47    HD2  HIS   6           HD2      HIS   6  -2.146   5.128 -11.447
   48    HE1  HIS   6           HE1      HIS   6   1.224   6.271  -9.137
   49    HA   PRO   7           HA       PRO   7  -4.989  -0.316 -10.646
   50    HB2  PRO   7           2HB      PRO   7  -4.231  -2.706  -9.604
   51    HB3  PRO   7           3HB      PRO   7  -3.362  -1.914 -10.924
   52    HG2  PRO   7           2HG      PRO   7  -2.726  -1.964  -7.999
   53    HG3  PRO   7           3HG      PRO   7  -1.635  -2.148  -9.384
   54    HD2  PRO   7           2HD      PRO   7  -1.880   0.179  -8.022
   55    HD3  PRO   7           3HD      PRO   7  -1.526   0.124  -9.760
   56    H    LEU   8           H        LEU   8  -4.402  -0.164  -7.210
   57    HA   LEU   8           HA       LEU   8  -6.792  -1.619  -6.506
   58    HB2  LEU   8           2HB      LEU   8  -4.937  -1.787  -5.019
   59    HB3  LEU   8           3HB      LEU   8  -4.799  -0.034  -4.902
   60    HG   LEU   8           HG       LEU   8  -7.323  -1.298  -3.967
   61   HD11  LEU   8          1HD1      LEU   8  -5.631  -1.190  -1.737
   62   HD12  LEU   8          2HD1      LEU   8  -4.741  -2.068  -2.981
   63   HD13  LEU   8          3HD1      LEU   8  -6.340  -2.622  -2.484
   64   HD21  LEU   8          3HD2      LEU   8  -5.708   1.140  -3.442
   65   HD22  LEU   8          1HD2      LEU   8  -6.708   0.506  -2.134
   66   HD23  LEU   8          2HD2      LEU   8  -7.448   0.959  -3.670
   67    H    ALA   9           H        ALA   9  -5.913   1.651  -7.161
   68    HA   ALA   9           HA       ALA   9  -7.864   3.038  -5.715
   69    HB1  ALA   9           1HB      ALA   9  -7.578   4.808  -7.459
   70    HB2  ALA   9           2HB      ALA   9  -6.074   4.244  -6.730
   71    HB3  ALA   9           3HB      ALA   9  -6.536   3.690  -8.339
   72    H    ALA  10           H        ALA  10  -7.992   1.552  -8.926
   73    HA   ALA  10           HA       ALA  10 -10.540   2.488  -9.660
   74    HB1  ALA  10           1HB      ALA  10  -8.970   0.067 -10.511
   75    HB2  ALA  10           2HB      ALA  10 -10.524   0.505 -11.221
   76    HB3  ALA  10           3HB      ALA  10  -9.151   1.603 -11.359
   77    H    SER  11           H        SER  11  -9.518  -0.479  -8.007
   78    HA   SER  11           HA       SER  11 -12.063  -1.674  -7.862
   79    HB2  SER  11           2HB      SER  11  -9.628  -2.005  -6.095
   80    HB3  SER  11           3HB      SER  11 -11.058  -3.033  -6.011
   81    HG   SER  11           HG       SER  11  -9.017  -3.407  -7.541
   82    H    PHE  12           H        PHE  12 -10.301   0.392  -5.579
   83    HA   PHE  12           HA       PHE  12 -12.343   0.352  -3.596
   84    HB2  PHE  12           2HB      PHE  12  -9.873   1.989  -4.055
   85    HB3  PHE  12           3HB      PHE  12 -11.031   2.481  -2.824
   86    HD1  PHE  12           HD2      PHE  12  -9.624  -0.804  -3.904
   87    HD2  PHE  12           HD1      PHE  12 -10.296   1.945  -0.725
   88    HE1  PHE  12           HE2      PHE  12  -8.608  -2.391  -2.322
   89    HE2  PHE  12           HE1      PHE  12  -9.281   0.363   0.863
   90    HZ   PHE  12           HZ       PHE  12  -8.436  -1.809   0.065
   91    H    ILE  13           H        ILE  13 -11.751   2.244  -6.441
   92    HA   ILE  13           HA       ILE  13 -13.488   4.413  -5.732
   93    HB   ILE  13           HB       ILE  13 -12.077   3.588  -8.237
   94   HG12  ILE  13          2HG1      ILE  13 -10.918   4.926  -6.506
   95   HG13  ILE  13          3HG1      ILE  13 -11.073   5.797  -8.028
   96   HG21  ILE  13          1HG2      ILE  13 -14.337   5.559  -8.036
   97   HG22  ILE  13          2HG2      ILE  13 -13.127   5.627  -9.317
   98   HG23  ILE  13          3HG2      ILE  13 -14.159   4.206  -9.154
   99   HD11  ILE  13          3HD1      ILE  13 -13.298   6.303  -6.244
  100   HD12  ILE  13          1HD1      ILE  13 -11.745   6.730  -5.528
  101   HD13  ILE  13          2HD1      ILE  13 -12.227   7.433  -7.072
  102    H    VAL  14           H        VAL  14 -13.777   1.479  -7.682
  103    HA   VAL  14           HA       VAL  14 -16.407   2.035  -8.623
  104    HB   VAL  14           HB       VAL  14 -14.964  -0.612  -8.421
  105   HG11  VAL  14          1HG1      VAL  14 -17.153  -1.256  -8.718
  106   HG12  VAL  14          2HG1      VAL  14 -17.573   0.202  -9.619
  107   HG13  VAL  14          3HG1      VAL  14 -16.624  -1.070 -10.390
  108   HG21  VAL  14          3HG2      VAL  14 -15.239   0.432 -11.078
  109   HG22  VAL  14          1HG2      VAL  14 -14.443   1.619 -10.044
  110   HG23  VAL  14          2HG2      VAL  14 -13.775  -0.006 -10.198
  111    H    ARG  15           H        ARG  15 -15.138   0.799  -5.679
  112    HA   ARG  15           HA       ARG  15 -17.546  -0.573  -4.881
  113    HB2  ARG  15           2HB      ARG  15 -16.221  -1.498  -3.337
  114    HB3  ARG  15           3HB      ARG  15 -14.883  -0.615  -4.061
  115    HG2  ARG  15           2HG      ARG  15 -15.257   1.236  -2.519
  116    HG3  ARG  15           3HG      ARG  15 -16.613   0.365  -1.800
  117    HD2  ARG  15           2HD      ARG  15 -13.875  -0.849  -1.926
  118    HD3  ARG  15           3HD      ARG  15 -14.322   0.259  -0.630
  119    HE   ARG  15           HE       ARG  15 -16.322  -1.601  -0.668
  120   HH11  ARG  15          1HH1      ARG  15 -12.857  -1.710  -0.358
  121   HH12  ARG  15          2HH1      ARG  15 -12.859  -3.136   0.625
  122   HH21  ARG  15          1HH2      ARG  15 -16.338  -3.479   0.626
  123   HH22  ARG  15          2HH2      ARG  15 -14.840  -4.142   1.184
  124    H    CYS  16           H        CYS  16 -15.993   2.527  -4.228
  125    HA   CYS  16           HA       CYS  16 -18.063   3.311  -2.359
  126    HB2  CYS  16           2HB      CYS  16 -15.743   4.878  -3.506
  127    HB3  CYS  16           3HB      CYS  16 -16.808   5.434  -2.221
  128    HG   CYS  16           HG       CYS  16 -15.252   4.578  -0.378
  129    H    ALA  17           H        ALA  17 -17.147   3.933  -5.689
  130    HA   ALA  17           HA       ALA  17 -18.831   6.128  -6.181
  131    HB1  ALA  17           1HB      ALA  17 -18.523   5.639  -8.528
  132    HB2  ALA  17           2HB      ALA  17 -16.996   5.425  -7.671
  133    HB3  ALA  17           3HB      ALA  17 -17.946   4.017  -8.144
  134    H    PHE  18           H        PHE  18 -19.393   2.650  -6.331
  135    HA   PHE  18           HA       PHE  18 -22.002   2.866  -7.474
  136    HB2  PHE  18           2HB      PHE  18 -20.381   0.835  -7.461
  137    HB3  PHE  18           3HB      PHE  18 -21.070   0.499  -5.876
  138    HD1  PHE  18           HD2      PHE  18 -21.837   0.824  -9.467
  139    HD2  PHE  18           HD1      PHE  18 -23.227  -0.443  -5.648
  140    HE1  PHE  18           HE2      PHE  18 -23.731  -0.323 -10.540
  141    HE2  PHE  18           HE1      PHE  18 -25.122  -1.592  -6.716
  142    HZ   PHE  18           HZ       PHE  18 -25.377  -1.532  -9.164
  143    H    GLU  19           H        GLU  19 -20.724   2.574  -4.203
  144    HA   GLU  19           HA       GLU  19 -23.323   2.339  -2.995
  145    HB2  GLU  19           2HB      GLU  19 -21.604   1.297  -1.776
  146    HB3  GLU  19           3HB      GLU  19 -20.533   2.683  -1.930
  147    HG2  GLU  19           2HG      GLU  19 -21.441   3.759  -0.170
  148    HG3  GLU  19           3HG      GLU  19 -23.063   3.150  -0.492
  149    H    HIS  20           H        HIS  20 -21.165   4.913  -3.859
  150    HA   HIS  20           HA       HIS  20 -22.269   6.908  -2.156
  151    HB2  HIS  20           2HB      HIS  20 -20.015   7.075  -3.183
  152    HB3  HIS  20           3HB      HIS  20 -20.773   7.263  -4.762
  153    HD1  HIS  20           HD1      HIS  20 -22.525   9.433  -4.810
  154    HD2  HIS  20           HD2      HIS  20 -19.457   9.439  -2.008
  155    HE1  HIS  20           HE1      HIS  20 -22.262  11.833  -4.106
  156    H    SER  21           H        SER  21 -22.971   5.790  -5.414
  157    HA   SER  21           HA       SER  21 -24.897   7.893  -5.892
  158    HB2  SER  21           2HB      SER  21 -24.362   5.395  -7.516
  159    HB3  SER  21           3HB      SER  21 -25.253   6.822  -8.045
  160    HG   SER  21           HG       SER  21 -22.598   7.063  -7.146
  161    H    ARG  22           H        ARG  22 -24.895   4.514  -4.950
  162    HA   ARG  22           HA       ARG  22 -27.580   3.893  -5.329
  163    HB2  ARG  22           2HB      ARG  22 -25.530   2.454  -4.504
  164    HB3  ARG  22           3HB      ARG  22 -26.149   2.872  -2.912
  165    HG2  ARG  22           2HG      ARG  22 -28.350   1.939  -3.586
  166    HG3  ARG  22           3HG      ARG  22 -27.608   1.404  -5.096
  167    HD2  ARG  22           2HD      ARG  22 -27.184  -0.492  -3.977
  168    HD3  ARG  22           3HD      ARG  22 -25.865   0.423  -3.248
  169    HE   ARG  22           HE       ARG  22 -28.186   0.864  -1.747
  170   HH11  ARG  22          1HH1      ARG  22 -25.959  -1.703  -2.506
  171   HH12  ARG  22          2HH1      ARG  22 -26.205  -2.535  -1.006
  172   HH21  ARG  22          1HH2      ARG  22 -28.518  -0.223   0.230
  173   HH22  ARG  22          2HH2      ARG  22 -27.661  -1.693   0.549
  174    H    ARG  23           H        ARG  23 -25.978   5.459  -2.591
  175    HA   ARG  23           HA       ARG  23 -28.139   5.541  -0.829
  176    HB2  ARG  23           2HB      ARG  23 -26.128   6.148   0.147
  177    HB3  ARG  23           3HB      ARG  23 -25.676   7.198  -1.189
  178    HG2  ARG  23           2HG      ARG  23 -26.158   8.514   0.772
  179    HG3  ARG  23           3HG      ARG  23 -27.378   8.817  -0.467
  180    HD2  ARG  23           2HD      ARG  23 -28.474   6.737   0.931
  181    HD3  ARG  23           3HD      ARG  23 -27.648   7.642   2.199
  182    HE   ARG  23           HE       ARG  23 -30.034   8.391   0.866
  183   HH11  ARG  23          1HH1      ARG  23 -27.101   9.701   2.209
  184   HH12  ARG  23          2HH1      ARG  23 -27.794  11.252   2.547
  185   HH21  ARG  23          1HH2      ARG  23 -30.959  10.429   1.308
  186   HH22  ARG  23          2HH2      ARG  23 -29.989  11.665   2.035
  187    H    PHE  24           H        PHE  24 -27.430   7.447  -3.649
  188    HA   PHE  24           HA       PHE  24 -29.374   9.491  -3.033
  189    HB2  PHE  24           2HB      PHE  24 -27.258   9.861  -4.385
  190    HB3  PHE  24           3HB      PHE  24 -28.045   8.988  -5.696
  191    HD1  PHE  24           HD1      PHE  24 -30.012   9.938  -6.813
  192    HD2  PHE  24           HD2      PHE  24 -27.867  12.099  -3.838
  193    HE1  PHE  24           HE1      PHE  24 -31.090  12.022  -7.554
  194    HE2  PHE  24           HE2      PHE  24 -28.942  14.186  -4.574
  195    HZ   PHE  24           HZ       PHE  24 -30.556  14.149  -6.433
  196    H    THR  25           H        THR  25 -29.149   6.666  -5.133
  197    HA   THR  25           HA       THR  25 -31.806   7.109  -6.209
  198    HB   THR  25           HB       THR  25 -29.848   6.120  -7.528
  199    HG1  THR  25           HG1      THR  25 -31.885   6.009  -8.419
  200   HG21  THR  25          3HG2      THR  25 -30.619   3.421  -6.690
  201   HG22  THR  25          1HG2      THR  25 -29.736   4.328  -5.462
  202   HG23  THR  25          2HG2      THR  25 -29.026   4.080  -7.058
  Start of MODEL    8
    1    H1   GLN   1           H        GLN   1   2.055   0.209   0.747
    2    HA   GLN   1           HA       GLN   1   3.309   0.535  -1.165
    3    HB2  GLN   1           2HB      GLN   1   1.723  -1.812  -1.229
    4    HB3  GLN   1           3HB      GLN   1   1.762  -1.173  -2.867
    5    HG2  GLN   1           2HG      GLN   1   4.077  -1.999  -1.145
    6    HG3  GLN   1           3HG      GLN   1   3.562  -2.682  -2.686
    7   HE21  GLN   1          1HE2      GLN   1   4.056  -1.612  -4.590
    8   HE22  GLN   1          2HE2      GLN   1   5.227  -0.344  -4.661
    9    H    ARG   2           H        ARG   2   3.502   1.927  -2.811
   10    HA   ARG   2           HA       ARG   2   1.207   3.439  -3.635
   11    HB2  ARG   2           2HB      ARG   2   3.955   3.613  -4.855
   12    HB3  ARG   2           3HB      ARG   2   2.730   4.870  -4.746
   13    HG2  ARG   2           2HG      ARG   2   3.272   5.410  -2.614
   14    HG3  ARG   2           3HG      ARG   2   3.744   3.761  -2.199
   15    HD2  ARG   2           2HD      ARG   2   5.754   4.109  -3.703
   16    HD3  ARG   2           3HD      ARG   2   5.318   5.817  -3.730
   17    HE   ARG   2           HE       ARG   2   5.488   4.876  -1.066
   18   HH11  ARG   2          1HH1      ARG   2   7.458   5.767  -3.794
   19   HH12  ARG   2          2HH1      ARG   2   8.818   6.231  -2.826
   20   HH21  ARG   2          1HH2      ARG   2   7.272   5.484   0.219
   21   HH22  ARG   2          2HH2      ARG   2   8.712   6.068  -0.543
   22    H    SER   3           H        SER   3   3.392   1.112  -5.160
   23    HA   SER   3           HA       SER   3   2.430   1.300  -7.776
   24    HB2  SER   3           2HB      SER   3   4.497   0.060  -6.981
   25    HB3  SER   3           3HB      SER   3   3.421  -1.248  -6.488
   26    HG   SER   3           HG       SER   3   4.395  -0.730  -8.912
   27    H    ASN   4           H        ASN   4   1.311  -0.631  -5.041
   28    HA   ASN   4           HA       ASN   4  -0.722  -1.957  -6.598
   29    HB2  ASN   4           2HB      ASN   4  -0.239  -1.886  -3.611
   30    HB3  ASN   4           3HB      ASN   4  -1.418  -2.916  -4.419
   31   HD21  ASN   4          1HD2      ASN   4  -0.438  -4.253  -6.245
   32   HD22  ASN   4          2HD2      ASN   4   1.064  -5.029  -5.888
   33    H    PHE   5           H        PHE   5  -0.430   0.982  -4.881
   34    HA   PHE   5           HA       PHE   5  -3.114   1.363  -4.089
   35    HB2  PHE   5           2HB      PHE   5  -1.150   2.692  -3.271
   36    HB3  PHE   5           3HB      PHE   5  -1.115   3.506  -4.831
   37    HD1  PHE   5           HD1      PHE   5  -2.976   3.077  -1.703
   38    HD2  PHE   5           HD2      PHE   5  -2.745   5.167  -5.404
   39    HE1  PHE   5           HE1      PHE   5  -4.618   4.714  -0.878
   40    HE2  PHE   5           HE2      PHE   5  -4.385   6.807  -4.584
   41    HZ   PHE   5           HZ       PHE   5  -5.323   6.582  -2.318
   42    H    HIS   6           H        HIS   6  -1.366   2.094  -7.062
   43    HA   HIS   6           HA       HIS   6  -3.286   3.658  -8.341
   44    HB2  HIS   6           2HB      HIS   6  -0.988   2.000  -9.199
   45    HB3  HIS   6           3HB      HIS   6  -2.186   2.359 -10.439
   46    HD1  HIS   6           HD1      HIS   6  -0.021   4.220  -7.932
   47    HD2  HIS   6           HD2      HIS   6  -1.864   4.784 -11.613
   48    HE1  HIS   6           HE1      HIS   6   0.745   6.479  -8.728
   49    HA   PRO   7           HA       PRO   7  -5.086  -0.404 -10.251
   50    HB2  PRO   7           2HB      PRO   7  -4.298  -2.750  -9.133
   51    HB3  PRO   7           3HB      PRO   7  -3.443  -1.994 -10.483
   52    HG2  PRO   7           2HG      PRO   7  -2.794  -1.939  -7.561
   53    HG3  PRO   7           3HG      PRO   7  -1.707  -2.158  -8.945
   54    HD2  PRO   7           2HD      PRO   7  -1.969   0.211  -7.661
   55    HD3  PRO   7           3HD      PRO   7  -1.623   0.100  -9.399
   56    H    LEU   8           H        LEU   8  -4.485  -0.126  -6.826
   57    HA   LEU   8           HA       LEU   8  -6.853  -1.583  -6.058
   58    HB2  LEU   8           2HB      LEU   8  -4.859  -1.575  -4.642
   59    HB3  LEU   8           3HB      LEU   8  -5.008   0.169  -4.441
   60    HG   LEU   8           HG       LEU   8  -5.796  -1.388  -2.540
   61   HD11  LEU   8          1HD1      LEU   8  -6.435   1.166  -3.280
   62   HD12  LEU   8          2HD1      LEU   8  -6.876   0.402  -1.753
   63   HD13  LEU   8          3HD1      LEU   8  -8.022   0.418  -3.094
   64   HD21  LEU   8          3HD2      LEU   8  -7.745  -2.536  -2.729
   65   HD22  LEU   8          1HD2      LEU   8  -7.234  -2.620  -4.415
   66   HD23  LEU   8          2HD2      LEU   8  -8.421  -1.416  -3.913
   67    H    ALA   9           H        ALA   9  -6.008   1.681  -6.807
   68    HA   ALA   9           HA       ALA   9  -7.997   3.074  -5.415
   69    HB1  ALA   9           1HB      ALA   9  -6.642   3.695  -8.033
   70    HB2  ALA   9           2HB      ALA   9  -7.697   4.819  -7.174
   71    HB3  ALA   9           3HB      ALA   9  -6.195   4.273  -6.428
   72    H    ALA  10           H        ALA  10  -8.051   1.515  -8.591
   73    HA   ALA  10           HA       ALA  10 -10.596   2.407  -9.391
   74    HB1  ALA  10           1HB      ALA  10 -10.531   0.400 -10.913
   75    HB2  ALA  10           2HB      ALA  10  -9.160   1.503 -11.044
   76    HB3  ALA  10           3HB      ALA  10  -8.990  -0.016 -10.164
   77    H    SER  11           H        SER  11  -9.568  -0.510  -7.656
   78    HA   SER  11           HA       SER  11 -12.096  -1.740  -7.533
   79    HB2  SER  11           2HB      SER  11  -9.698  -1.984  -5.704
   80    HB3  SER  11           3HB      SER  11 -11.112  -3.034  -5.625
   81    HG   SER  11           HG       SER  11 -10.499  -4.018  -7.406
   82    H    PHE  12           H        PHE  12 -10.418   0.404  -5.258
   83    HA   PHE  12           HA       PHE  12 -12.511   0.385  -3.327
   84    HB2  PHE  12           2HB      PHE  12 -10.002   1.942  -3.746
   85    HB3  PHE  12           3HB      PHE  12 -11.215   2.607  -2.655
   86    HD1  PHE  12           HD2      PHE  12 -10.526  -0.985  -3.142
   87    HD2  PHE  12           HD1      PHE  12 -10.028   2.412  -0.626
   88    HE1  PHE  12           HE2      PHE  12  -9.700  -2.444  -1.341
   89    HE2  PHE  12           HE1      PHE  12  -9.200   0.959   1.179
   90    HZ   PHE  12           HZ       PHE  12  -9.036  -1.473   0.823
   91    H    ILE  13           H        ILE  13 -11.863   2.222  -6.197
   92    HA   ILE  13           HA       ILE  13 -13.639   4.386  -5.585
   93    HB   ILE  13           HB       ILE  13 -12.160   3.513  -8.034
   94   HG12  ILE  13          2HG1      ILE  13 -11.063   4.913  -6.311
   95   HG13  ILE  13          3HG1      ILE  13 -11.187   5.738  -7.860
   96   HG21  ILE  13          1HG2      ILE  13 -14.449   5.459  -7.942
   97   HG22  ILE  13          2HG2      ILE  13 -13.209   5.509  -9.194
   98   HG23  ILE  13          3HG2      ILE  13 -14.226   4.079  -9.018
   99   HD11  ILE  13          3HD1      ILE  13 -13.462   6.265  -6.144
  100   HD12  ILE  13          1HD1      ILE  13 -11.931   6.739  -5.410
  101   HD13  ILE  13          2HD1      ILE  13 -12.391   7.384  -6.986
  102    H    VAL  14           H        VAL  14 -13.856   1.402  -7.467
  103    HA   VAL  14           HA       VAL  14 -16.469   1.908  -8.481
  104    HB   VAL  14           HB       VAL  14 -15.008  -0.720  -8.177
  105   HG11  VAL  14          1HG1      VAL  14 -16.650  -1.138 -10.234
  106   HG12  VAL  14          2HG1      VAL  14 -17.115  -1.476  -8.565
  107   HG13  VAL  14          3HG1      VAL  14 -17.630   0.023  -9.339
  108   HG21  VAL  14          3HG2      VAL  14 -14.355   1.433  -9.777
  109   HG22  VAL  14          1HG2      VAL  14 -13.851  -0.239 -10.024
  110   HG23  VAL  14          2HG2      VAL  14 -15.277   0.384 -10.854
  111    H    ARG  15           H        ARG  15 -15.257   0.760  -5.478
  112    HA   ARG  15           HA       ARG  15 -17.671  -0.614  -4.701
  113    HB2  ARG  15           2HB      ARG  15 -16.374  -1.486  -3.103
  114    HB3  ARG  15           3HB      ARG  15 -15.028  -0.610  -3.819
  115    HG2  ARG  15           2HG      ARG  15 -15.453   1.276  -2.334
  116    HG3  ARG  15           3HG      ARG  15 -16.819   0.412  -1.625
  117    HD2  ARG  15           2HD      ARG  15 -14.162  -0.926  -1.665
  118    HD3  ARG  15           3HD      ARG  15 -14.424   0.378  -0.508
  119    HE   ARG  15           HE       ARG  15 -15.505  -2.264  -0.394
  120   HH11  ARG  15          1HH1      ARG  15 -16.086   1.058   0.471
  121   HH12  ARG  15          2HH1      ARG  15 -17.122   0.666   1.803
  122   HH21  ARG  15          1HH2      ARG  15 -16.867  -2.793   1.357
  123   HH22  ARG  15          2HH2      ARG  15 -17.565  -1.525   2.307
  124    H    CYS  16           H        CYS  16 -16.161   2.515  -4.091
  125    HA   CYS  16           HA       CYS  16 -18.280   3.328  -2.290
  126    HB2  CYS  16           2HB      CYS  16 -15.949   4.888  -3.425
  127    HB3  CYS  16           3HB      CYS  16 -17.047   5.465  -2.177
  128    HG   CYS  16           HG       CYS  16 -14.459   3.337  -1.936
  129    H    ALA  17           H        ALA  17 -17.290   3.876  -5.613
  130    HA   ALA  17           HA       ALA  17 -18.977   6.043  -6.203
  131    HB1  ALA  17           1HB      ALA  17 -17.110   5.312  -7.635
  132    HB2  ALA  17           2HB      ALA  17 -18.039   3.880  -8.084
  133    HB3  ALA  17           3HB      ALA  17 -18.620   5.485  -8.530
  134    H    PHE  18           H        PHE  18 -19.519   2.558  -6.275
  135    HA   PHE  18           HA       PHE  18 -22.113   2.741  -7.464
  136    HB2  PHE  18           2HB      PHE  18 -20.471   0.719  -7.386
  137    HB3  PHE  18           3HB      PHE  18 -21.204   0.401  -5.817
  138    HD1  PHE  18           HD2      PHE  18 -22.418   1.349  -9.221
  139    HD2  PHE  18           HD1      PHE  18 -22.814  -1.218  -5.850
  140    HE1  PHE  18           HE2      PHE  18 -24.277   0.182 -10.333
  141    HE2  PHE  18           HE1      PHE  18 -24.674  -2.390  -6.956
  142    HZ   PHE  18           HZ       PHE  18 -25.408  -1.690  -9.200
  143    H    GLU  19           H        GLU  19 -20.880   2.481  -4.170
  144    HA   GLU  19           HA       GLU  19 -23.483   2.241  -2.987
  145    HB2  GLU  19           2HB      GLU  19 -21.760   1.267  -1.724
  146    HB3  GLU  19           3HB      GLU  19 -20.714   2.668  -1.904
  147    HG2  GLU  19           2HG      GLU  19 -21.657   3.771  -0.179
  148    HG3  GLU  19           3HG      GLU  19 -23.265   3.125  -0.502
  149    H    HIS  20           H        HIS  20 -21.365   4.843  -3.877
  150    HA   HIS  20           HA       HIS  20 -22.551   6.848  -2.238
  151    HB2  HIS  20           2HB      HIS  20 -20.272   7.032  -3.218
  152    HB3  HIS  20           3HB      HIS  20 -21.001   7.193  -4.813
  153    HD1  HIS  20           HD1      HIS  20 -20.574   9.041  -1.570
  154    HD2  HIS  20           HD2      HIS  20 -21.995   9.710  -5.416
  155    HE1  HIS  20           HE1      HIS  20 -20.925  11.526  -1.734
  156    H    SER  21           H        SER  21 -23.162   5.627  -5.472
  157    HA   SER  21           HA       SER  21 -25.089   7.692  -6.078
  158    HB2  SER  21           2HB      SER  21 -24.525   5.120  -7.572
  159    HB3  SER  21           3HB      SER  21 -25.402   6.522  -8.184
  160    HG   SER  21           HG       SER  21 -22.789   6.864  -7.232
  161    H    ARG  22           H        ARG  22 -25.105   4.343  -5.014
  162    HA   ARG  22           HA       ARG  22 -27.803   3.746  -5.392
  163    HB2  ARG  22           2HB      ARG  22 -25.795   2.782  -3.363
  164    HB3  ARG  22           3HB      ARG  22 -27.436   2.155  -3.425
  165    HG2  ARG  22           2HG      ARG  22 -26.151   2.123  -6.025
  166    HG3  ARG  22           3HG      ARG  22 -25.260   1.195  -4.816
  167    HD2  ARG  22           2HD      ARG  22 -28.186   0.890  -5.483
  168    HD3  ARG  22           3HD      ARG  22 -26.893  -0.196  -5.990
  169    HE   ARG  22           HE       ARG  22 -26.667  -0.183  -3.295
  170   HH11  ARG  22          1HH1      ARG  22 -29.329  -0.736  -5.471
  171   HH12  ARG  22          2HH1      ARG  22 -30.146  -1.827  -4.401
  172   HH21  ARG  22          1HH2      ARG  22 -27.734  -1.618  -1.879
  173   HH22  ARG  22          2HH2      ARG  22 -29.239  -2.327  -2.358
  174    H    ARG  23           H        ARG  23 -26.167   5.326  -2.682
  175    HA   ARG  23           HA       ARG  23 -28.320   5.458  -0.912
  176    HB2  ARG  23           2HB      ARG  23 -26.298   6.046   0.052
  177    HB3  ARG  23           3HB      ARG  23 -25.834   7.072  -1.299
  178    HG2  ARG  23           2HG      ARG  23 -26.986   8.876  -0.511
  179    HG3  ARG  23           3HG      ARG  23 -28.173   7.884   0.340
  180    HD2  ARG  23           2HD      ARG  23 -27.019   8.043   2.232
  181    HD3  ARG  23           3HD      ARG  23 -25.564   7.437   1.440
  182    HE   ARG  23           HE       ARG  23 -26.054  10.194   0.867
  183   HH11  ARG  23          1HH1      ARG  23 -24.737   7.994   3.222
  184   HH12  ARG  23          2HH1      ARG  23 -23.654   9.164   3.901
  185   HH21  ARG  23          1HH2      ARG  23 -24.633  11.743   1.753
  186   HH22  ARG  23          2HH2      ARG  23 -23.597  11.296   3.066
  187    H    PHE  24           H        PHE  24 -27.608   7.304  -3.766
  188    HA   PHE  24           HA       PHE  24 -29.504   9.397  -3.165
  189    HB2  PHE  24           2HB      PHE  24 -27.399   9.699  -4.552
  190    HB3  PHE  24           3HB      PHE  24 -28.220   8.815  -5.834
  191    HD1  PHE  24           HD2      PHE  24 -30.460   9.749  -6.653
  192    HD2  PHE  24           HD1      PHE  24 -27.682  11.989  -4.334
  193    HE1  PHE  24           HE2      PHE  24 -31.508  11.838  -7.421
  194    HE2  PHE  24           HE1      PHE  24 -28.726  14.082  -5.097
  195    HZ   PHE  24           HZ       PHE  24 -30.641  14.008  -6.644
  196    H    THR  25           H        THR  25 -29.361   6.528  -5.213
  197    HA   THR  25           HA       THR  25 -32.027   7.001  -6.259
  198    HB   THR  25           HB       THR  25 -30.101   5.954  -7.586
  199    HG1  THR  25           HG1      THR  25 -31.933   5.719  -8.666
  200   HG21  THR  25          3HG2      THR  25 -31.006   3.366  -6.386
  201   HG22  THR  25          1HG2      THR  25 -29.710   4.284  -5.621
  202   HG23  THR  25          2HG2      THR  25 -29.533   3.727  -7.286
  Start of MODEL    9
    1    H1   GLN   1           H        GLN   1   4.238  -0.529  -0.882
    2    HA   GLN   1           HA       GLN   1   2.159  -1.057  -1.862
    3    HB2  GLN   1           2HB      GLN   1   2.107  -0.315   0.645
    4    HB3  GLN   1           3HB      GLN   1   1.240   1.082   0.022
    5    HG2  GLN   1           2HG      GLN   1  -0.639  -0.074  -0.022
    6    HG3  GLN   1           3HG      GLN   1   0.091  -1.260  -1.103
    7   HE21  GLN   1          1HE2      GLN   1  -1.551  -1.016   1.642
    8   HE22  GLN   1          2HE2      GLN   1  -0.937  -2.376   2.512
    9    H    ARG   2           H        ARG   2   3.527   1.635  -2.869
   10    HA   ARG   2           HA       ARG   2   1.275   3.190  -3.721
   11    HB2  ARG   2           2HB      ARG   2   4.044   3.327  -4.895
   12    HB3  ARG   2           3HB      ARG   2   2.841   4.605  -4.790
   13    HG2  ARG   2           2HG      ARG   2   3.380   5.129  -2.660
   14    HG3  ARG   2           3HG      ARG   2   3.766   3.461  -2.232
   15    HD2  ARG   2           2HD      ARG   2   5.913   4.037  -2.361
   16    HD3  ARG   2           3HD      ARG   2   5.690   4.150  -4.106
   17    HE   ARG   2           HE       ARG   2   5.942   6.334  -2.236
   18   HH11  ARG   2          1HH1      ARG   2   4.897   5.337  -5.403
   19   HH12  ARG   2          2HH1      ARG   2   5.002   6.927  -6.082
   20   HH21  ARG   2          1HH2      ARG   2   6.084   8.433  -3.117
   21   HH22  ARG   2          2HH2      ARG   2   5.678   8.688  -4.781
   22    H    SER   3           H        SER   3   3.443   0.841  -5.237
   23    HA   SER   3           HA       SER   3   2.525   1.076  -7.866
   24    HB2  SER   3           2HB      SER   3   3.569  -1.401  -6.472
   25    HB3  SER   3           3HB      SER   3   3.471  -1.165  -8.216
   26    HG   SER   3           HG       SER   3   4.790   0.869  -7.526
   27    H    ASN   4           H        ASN   4   1.333  -0.868  -5.172
   28    HA   ASN   4           HA       ASN   4  -0.697  -2.141  -6.776
   29    HB2  ASN   4           2HB      ASN   4  -0.258  -2.116  -3.781
   30    HB3  ASN   4           3HB      ASN   4  -1.442  -3.115  -4.619
   31   HD21  ASN   4          1HD2      ASN   4  -0.077  -4.703  -3.333
   32   HD22  ASN   4          2HD2      ASN   4   1.260  -5.408  -4.170
   33    H    PHE   5           H        PHE   5  -0.383   0.771  -5.016
   34    HA   PHE   5           HA       PHE   5  -3.072   1.186  -4.261
   35    HB2  PHE   5           2HB      PHE   5  -1.102   2.471  -3.393
   36    HB3  PHE   5           3HB      PHE   5  -1.024   3.303  -4.942
   37    HD1  PHE   5           HD1      PHE   5  -3.448   2.557  -2.210
   38    HD2  PHE   5           HD2      PHE   5  -2.115   5.313  -5.167
   39    HE1  PHE   5           HE1      PHE   5  -5.076   4.213  -1.396
   40    HE2  PHE   5           HE2      PHE   5  -3.739   6.974  -4.357
   41    HZ   PHE   5           HZ       PHE   5  -5.222   6.425  -2.468
   42    H    HIS   6           H        HIS   6  -1.266   1.926  -7.196
   43    HA   HIS   6           HA       HIS   6  -3.139   3.540  -8.484
   44    HB2  HIS   6           2HB      HIS   6  -0.857   1.853  -9.328
   45    HB3  HIS   6           3HB      HIS   6  -2.029   2.248 -10.582
   46    HD1  HIS   6           HD1      HIS   6  -2.628   5.041 -10.446
   47    HD2  HIS   6           HD2      HIS   6   1.119   3.677  -9.279
   48    HE1  HIS   6           HE1      HIS   6  -1.111   7.042 -10.583
   49    HA   PRO   7           HA       PRO   7  -4.979  -0.466 -10.474
   50    HB2  PRO   7           2HB      PRO   7  -4.249  -2.839  -9.375
   51    HB3  PRO   7           3HB      PRO   7  -3.361  -2.081 -10.702
   52    HG2  PRO   7           2HG      PRO   7  -2.756  -2.075  -7.770
   53    HG3  PRO   7           3HG      PRO   7  -1.652  -2.295  -9.140
   54    HD2  PRO   7           2HD      PRO   7  -1.893   0.061  -7.829
   55    HD3  PRO   7           3HD      PRO   7  -1.522  -0.033  -9.563
   56    H    LEU   8           H        LEU   8  -4.425  -0.246  -7.036
   57    HA   LEU   8           HA       LEU   8  -6.833  -1.668  -6.326
   58    HB2  LEU   8           2HB      LEU   8  -4.995  -1.819  -4.817
   59    HB3  LEU   8           3HB      LEU   8  -4.844  -0.065  -4.736
   60    HG   LEU   8           HG       LEU   8  -7.387  -1.287  -3.799
   61   HD11  LEU   8          1HD1      LEU   8  -4.824  -2.060  -2.771
   62   HD12  LEU   8          2HD1      LEU   8  -6.433  -2.585  -2.277
   63   HD13  LEU   8          3HD1      LEU   8  -5.716  -1.145  -1.555
   64   HD21  LEU   8          3HD2      LEU   8  -7.484   0.984  -3.565
   65   HD22  LEU   8          1HD2      LEU   8  -5.748   1.143  -3.294
   66   HD23  LEU   8          2HD2      LEU   8  -6.791   0.550  -2.001
   67    H    ALA   9           H        ALA   9  -5.923   1.581  -7.040
   68    HA   ALA   9           HA       ALA   9  -7.877   3.013  -5.644
   69    HB1  ALA   9           1HB      ALA   9  -6.519   3.598  -8.268
   70    HB2  ALA   9           2HB      ALA   9  -7.559   4.744  -7.422
   71    HB3  ALA   9           3HB      ALA   9  -6.067   4.183  -6.667
   72    H    ALA  10           H        ALA  10  -7.985   1.460  -8.824
   73    HA   ALA  10           HA       ALA  10 -10.518   2.399  -9.603
   74    HB1  ALA  10           1HB      ALA  10 -10.504   0.383 -11.120
   75    HB2  ALA  10           2HB      ALA  10  -9.121   1.467 -11.269
   76    HB3  ALA  10           3HB      ALA  10  -8.959  -0.051 -10.387
   77    H    SER  11           H        SER  11  -9.536  -0.540  -7.877
   78    HA   SER  11           HA       SER  11 -12.092  -1.711  -7.731
   79    HB2  SER  11           2HB      SER  11  -9.677  -2.023  -5.934
   80    HB3  SER  11           3HB      SER  11 -11.116  -3.038  -5.842
   81    HG   SER  11           HG       SER  11  -9.232  -2.829  -7.935
   82    H    PHE  12           H        PHE  12 -10.335   0.389  -5.476
   83    HA   PHE  12           HA       PHE  12 -12.397   0.408  -3.512
   84    HB2  PHE  12           2HB      PHE  12  -9.910   2.016  -3.982
   85    HB3  PHE  12           3HB      PHE  12 -11.076   2.543  -2.774
   86    HD1  PHE  12           HD1      PHE  12  -9.683  -0.775  -3.769
   87    HD2  PHE  12           HD2      PHE  12 -10.368   2.045  -0.655
   88    HE1  PHE  12           HE1      PHE  12  -8.696  -2.335  -2.143
   89    HE2  PHE  12           HE2      PHE  12  -9.381   0.490   0.975
   90    HZ   PHE  12           HZ       PHE  12  -8.542  -1.703   0.232
   91    H    ILE  13           H        ILE  13 -11.763   2.234  -6.391
   92    HA   ILE  13           HA       ILE  13 -13.490   4.431  -5.746
   93    HB   ILE  13           HB       ILE  13 -12.062   3.540  -8.219
   94   HG12  ILE  13          2HG1      ILE  13 -10.909   4.907  -6.507
   95   HG13  ILE  13          3HG1      ILE  13 -11.043   5.746  -8.049
   96   HG21  ILE  13          1HG2      ILE  13 -14.308   5.532  -8.083
   97   HG22  ILE  13          2HG2      ILE  13 -13.086   5.563  -9.353
   98   HG23  ILE  13          3HG2      ILE  13 -14.130   4.154  -9.169
   99   HD11  ILE  13          3HD1      ILE  13 -12.196   7.410  -7.143
  100   HD12  ILE  13          1HD1      ILE  13 -13.280   6.307  -6.295
  101   HD13  ILE  13          2HD1      ILE  13 -11.727   6.743  -5.580
  102    H    VAL  14           H        VAL  14 -13.783   1.457  -7.635
  103    HA   VAL  14           HA       VAL  14 -16.400   2.013  -8.613
  104    HB   VAL  14           HB       VAL  14 -14.981  -0.641  -8.338
  105   HG11  VAL  14          1HG1      VAL  14 -17.643   0.104  -9.294
  106   HG12  VAL  14          2HG1      VAL  14 -16.714  -0.868 -10.437
  107   HG13  VAL  14          3HG1      VAL  14 -17.011  -1.468  -8.805
  108   HG21  VAL  14          3HG2      VAL  14 -14.405   1.543  -9.994
  109   HG22  VAL  14          1HG2      VAL  14 -13.782  -0.101 -10.130
  110   HG23  VAL  14          2HG2      VAL  14 -15.230   0.370 -11.020
  111    H    ARG  15           H        ARG  15 -15.169   0.832  -5.630
  112    HA   ARG  15           HA       ARG  15 -17.595  -0.504  -4.826
  113    HB2  ARG  15           2HB      ARG  15 -16.292  -1.403  -3.248
  114    HB3  ARG  15           3HB      ARG  15 -14.940  -0.547  -3.979
  115    HG2  ARG  15           2HG      ARG  15 -15.315   1.341  -2.482
  116    HG3  ARG  15           3HG      ARG  15 -16.685   0.497  -1.758
  117    HD2  ARG  15           2HD      ARG  15 -14.167  -1.020  -1.824
  118    HD3  ARG  15           3HD      ARG  15 -14.151   0.415  -0.800
  119    HE   ARG  15           HE       ARG  15 -16.481  -1.060  -0.274
  120   HH11  ARG  15          1HH1      ARG  15 -13.032  -1.249   0.159
  121   HH12  ARG  15          2HH1      ARG  15 -13.133  -2.228   1.585
  122   HH21  ARG  15          1HH2      ARG  15 -16.628  -2.348   1.603
  123   HH22  ARG  15          2HH2      ARG  15 -15.179  -2.854   2.405
  124    H    CYS  16           H        CYS  16 -16.025   2.598  -4.225
  125    HA   CYS  16           HA       CYS  16 -18.108   3.438  -2.395
  126    HB2  CYS  16           2HB      CYS  16 -15.765   4.964  -3.553
  127    HB3  CYS  16           3HB      CYS  16 -16.838   5.555  -2.290
  128    HG   CYS  16           HG       CYS  16 -14.411   3.194  -2.093
  129    H    ALA  17           H        ALA  17 -17.151   3.982  -5.728
  130    HA   ALA  17           HA       ALA  17 -18.809   6.179  -6.290
  131    HB1  ALA  17           1HB      ALA  17 -18.492   5.624  -8.622
  132    HB2  ALA  17           2HB      ALA  17 -16.973   5.421  -7.749
  133    HB3  ALA  17           3HB      ALA  17 -17.931   4.008  -8.190
  134    H    PHE  18           H        PHE  18 -19.410   2.704  -6.366
  135    HA   PHE  18           HA       PHE  18 -22.015   2.934  -7.522
  136    HB2  PHE  18           2HB      PHE  18 -20.407   0.885  -7.471
  137    HB3  PHE  18           3HB      PHE  18 -21.124   0.574  -5.894
  138    HD1  PHE  18           HD1      PHE  18 -23.601   0.217  -5.735
  139    HD2  PHE  18           HD2      PHE  18 -21.528   0.317  -9.451
  140    HE1  PHE  18           HE1      PHE  18 -25.496  -0.918  -6.819
  141    HE2  PHE  18           HE2      PHE  18 -23.419  -0.817 -10.541
  142    HZ   PHE  18           HZ       PHE  18 -25.407  -1.436  -9.226
  143    H    GLU  19           H        GLU  19 -20.746   2.643  -4.244
  144    HA   GLU  19           HA       GLU  19 -23.338   2.444  -3.030
  145    HB2  GLU  19           2HB      GLU  19 -21.616   1.436  -1.791
  146    HB3  GLU  19           3HB      GLU  19 -20.548   2.820  -1.979
  147    HG2  GLU  19           2HG      GLU  19 -21.452   3.932  -0.240
  148    HG3  GLU  19           3HG      GLU  19 -23.075   3.315  -0.545
  149    H    HIS  20           H        HIS  20 -21.187   5.012  -3.938
  150    HA   HIS  20           HA       HIS  20 -22.319   7.031  -2.278
  151    HB2  HIS  20           2HB      HIS  20 -20.048   7.179  -3.281
  152    HB3  HIS  20           3HB      HIS  20 -20.790   7.360  -4.868
  153    HD1  HIS  20           HD1      HIS  20 -22.228   9.587  -5.215
  154    HD2  HIS  20           HD2      HIS  20 -19.809   9.493  -1.838
  155    HE1  HIS  20           HE1      HIS  20 -22.046  11.976  -4.451
  156    H    SER  21           H        SER  21 -22.985   5.831  -5.509
  157    HA   SER  21           HA       SER  21 -24.881   7.932  -6.090
  158    HB2  SER  21           2HB      SER  21 -24.379   5.353  -7.594
  159    HB3  SER  21           3HB      SER  21 -25.239   6.771  -8.195
  160    HG   SER  21           HG       SER  21 -22.617   7.086  -7.268
  161    H    ARG  22           H        ARG  22 -24.948   4.583  -5.032
  162    HA   ARG  22           HA       ARG  22 -27.662   4.039  -5.382
  163    HB2  ARG  22           2HB      ARG  22 -25.649   3.027  -3.380
  164    HB3  ARG  22           3HB      ARG  22 -27.303   2.432  -3.426
  165    HG2  ARG  22           2HG      ARG  22 -26.048   2.386  -6.040
  166    HG3  ARG  22           3HG      ARG  22 -25.162   1.437  -4.845
  167    HD2  ARG  22           2HD      ARG  22 -28.126   1.162  -5.019
  168    HD3  ARG  22           3HD      ARG  22 -27.119   0.370  -6.230
  169    HE   ARG  22           HE       ARG  22 -26.251  -0.173  -3.562
  170   HH11  ARG  22          1HH1      ARG  22 -28.543  -1.077  -6.021
  171   HH12  ARG  22          2HH1      ARG  22 -28.756  -2.686  -5.416
  172   HH21  ARG  22          1HH2      ARG  22 -26.522  -2.290  -2.755
  173   HH22  ARG  22          2HH2      ARG  22 -27.606  -3.375  -3.558
  174    H    ARG  23           H        ARG  23 -25.963   5.571  -2.682
  175    HA   ARG  23           HA       ARG  23 -28.097   5.740  -0.891
  176    HB2  ARG  23           2HB      ARG  23 -26.029   6.262   0.035
  177    HB3  ARG  23           3HB      ARG  23 -25.590   7.328  -1.293
  178    HG2  ARG  23           2HG      ARG  23 -26.709   9.112  -0.419
  179    HG3  ARG  23           3HG      ARG  23 -27.888   8.102   0.419
  180    HD2  ARG  23           2HD      ARG  23 -25.148   7.746   1.369
  181    HD3  ARG  23           3HD      ARG  23 -25.763   9.384   1.585
  182    HE   ARG  23           HE       ARG  23 -27.699   7.554   2.472
  183   HH11  ARG  23          1HH1      ARG  23 -24.552   8.764   3.341
  184   HH12  ARG  23          2HH1      ARG  23 -24.772   8.492   5.038
  185   HH21  ARG  23          1HH2      ARG  23 -28.000   7.190   4.703
  186   HH22  ARG  23          2HH2      ARG  23 -26.734   7.596   5.811
  187    H    PHE  24           H        PHE  24 -27.401   7.547  -3.762
  188    HA   PHE  24           HA       PHE  24 -29.197   9.715  -3.131
  189    HB2  PHE  24           2HB      PHE  24 -27.134   9.918  -4.594
  190    HB3  PHE  24           3HB      PHE  24 -28.029   9.045  -5.833
  191    HD1  PHE  24           HD2      PHE  24 -30.332  10.050  -6.492
  192    HD2  PHE  24           HD1      PHE  24 -27.255  12.218  -4.505
  193    HE1  PHE  24           HE2      PHE  24 -31.330  12.164  -7.260
  194    HE2  PHE  24           HE1      PHE  24 -28.248  14.335  -5.269
  195    HZ   PHE  24           HZ       PHE  24 -30.288  14.310  -6.650
  196    H    THR  25           H        THR  25 -29.245   6.794  -5.101
  197    HA   THR  25           HA       THR  25 -31.524   7.142  -6.588
  198    HB   THR  25           HB       THR  25 -29.889   5.080  -6.351
  199    HG1  THR  25           HG1      THR  25 -32.627   5.031  -7.116
  200   HG21  THR  25          3HG2      THR  25 -30.539   3.347  -5.009
  201   HG22  THR  25          1HG2      THR  25 -32.237   3.820  -5.031
  202   HG23  THR  25          2HG2      THR  25 -31.091   4.695  -4.015
  Start of MODEL   10
    1    H1   GLN   1           H        GLN   1   2.042  -0.113   0.614
    2    HA   GLN   1           HA       GLN   1   3.326   0.390  -1.294
    3    HB2  GLN   1           2HB      GLN   1   1.455  -1.843  -1.544
    4    HB3  GLN   1           3HB      GLN   1   2.024  -1.244  -3.096
    5    HG2  GLN   1           2HG      GLN   1   4.047  -1.705  -0.983
    6    HG3  GLN   1           3HG      GLN   1   3.306  -3.118  -1.733
    7   HE21  GLN   1          1HE2      GLN   1   3.567  -3.439  -3.975
    8   HE22  GLN   1          2HE2      GLN   1   4.873  -2.706  -4.836
    9    H    ARG   2           H        ARG   2   3.519   1.817  -2.904
   10    HA   ARG   2           HA       ARG   2   1.232   3.354  -3.703
   11    HB2  ARG   2           2HB      ARG   2   3.979   3.530  -4.924
   12    HB3  ARG   2           3HB      ARG   2   2.762   4.792  -4.795
   13    HG2  ARG   2           2HG      ARG   2   3.309   5.298  -2.656
   14    HG3  ARG   2           3HG      ARG   2   3.772   3.640  -2.265
   15    HD2  ARG   2           2HD      ARG   2   5.782   3.999  -3.766
   16    HD3  ARG   2           3HD      ARG   2   5.357   5.710  -3.767
   17    HE   ARG   2           HE       ARG   2   6.648   4.272  -1.677
   18   HH11  ARG   2          1HH1      ARG   2   4.438   6.885  -2.313
   19   HH12  ARG   2          2HH1      ARG   2   4.808   7.729  -0.846
   20   HH21  ARG   2          1HH2      ARG   2   7.144   5.373   0.258
   21   HH22  ARG   2          2HH2      ARG   2   6.348   6.868   0.616
   22    H    SER   3           H        SER   3   3.401   1.037  -5.265
   23    HA   SER   3           HA       SER   3   2.438   1.270  -7.877
   24    HB2  SER   3           2HB      SER   3   4.498   0.006  -7.103
   25    HB3  SER   3           3HB      SER   3   3.415  -1.302  -6.628
   26    HG   SER   3           HG       SER   3   3.546  -0.204  -9.241
   27    H    ASN   4           H        ASN   4   1.311  -0.695  -5.169
   28    HA   ASN   4           HA       ASN   4  -0.731  -1.986  -6.744
   29    HB2  ASN   4           2HB      ASN   4  -0.246  -1.963  -3.757
   30    HB3  ASN   4           3HB      ASN   4  -1.431  -2.974  -4.579
   31   HD21  ASN   4          1HD2      ASN   4   0.792  -3.802  -2.953
   32   HD22  ASN   4          2HD2      ASN   4   1.806  -4.779  -3.955
   33    H    PHE   5           H        PHE   5  -0.420   0.925  -4.983
   34    HA   PHE   5           HA       PHE   5  -3.101   1.310  -4.182
   35    HB2  PHE   5           2HB      PHE   5  -1.129   2.615  -3.346
   36    HB3  PHE   5           3HB      PHE   5  -1.090   3.452  -4.895
   37    HD1  PHE   5           HD2      PHE   5  -3.504   2.645  -2.167
   38    HD2  PHE   5           HD1      PHE   5  -2.157   5.475  -5.047
   39    HE1  PHE   5           HE2      PHE   5  -5.136   4.279  -1.319
   40    HE2  PHE   5           HE1      PHE   5  -3.786   7.115  -4.202
   41    HZ   PHE   5           HZ       PHE   5  -5.279   6.517  -2.336
   42    H    HIS   6           H        HIS   6  -1.353   2.075  -7.146
   43    HA   HIS   6           HA       HIS   6  -3.265   3.669  -8.399
   44    HB2  HIS   6           2HB      HIS   6  -0.978   2.011  -9.285
   45    HB3  HIS   6           3HB      HIS   6  -2.175   2.395 -10.518
   46    HD1  HIS   6           HD1      HIS   6   0.901   3.529  -9.910
   47    HD2  HIS   6           HD2      HIS   6  -2.743   5.516  -9.723
   48    HE1  HIS   6           HE1      HIS   6   1.451   5.968 -10.184
   49    HA   PRO   7           HA       PRO   7  -5.090  -0.354 -10.368
   50    HB2  PRO   7           2HB      PRO   7  -4.315  -2.720  -9.286
   51    HB3  PRO   7           3HB      PRO   7  -3.457  -1.949 -10.626
   52    HG2  PRO   7           2HG      PRO   7  -2.804  -1.941  -7.704
   53    HG3  PRO   7           3HG      PRO   7  -1.720  -2.146  -9.092
   54    HD2  PRO   7           2HD      PRO   7  -1.968   0.205  -7.773
   55    HD3  PRO   7           3HD      PRO   7  -1.624   0.118  -9.512
   56    H    LEU   8           H        LEU   8  -4.484  -0.130  -6.940
   57    HA   LEU   8           HA       LEU   8  -6.860  -1.585  -6.191
   58    HB2  LEU   8           2HB      LEU   8  -4.864  -1.610  -4.778
   59    HB3  LEU   8           3HB      LEU   8  -5.002   0.132  -4.550
   60    HG   LEU   8           HG       LEU   8  -5.798  -1.448  -2.672
   61   HD11  LEU   8          1HD1      LEU   8  -6.865   0.337  -1.858
   62   HD12  LEU   8          2HD1      LEU   8  -8.013   0.379  -3.196
   63   HD13  LEU   8          3HD1      LEU   8  -6.422   1.120  -3.374
   64   HD21  LEU   8          3HD2      LEU   8  -7.246  -2.643  -4.562
   65   HD22  LEU   8          1HD2      LEU   8  -8.425  -1.440  -4.040
   66   HD23  LEU   8          2HD2      LEU   8  -7.755  -2.581  -2.874
   67    H    ALA   9           H        ALA   9  -5.996   1.685  -6.892
   68    HA   ALA   9           HA       ALA   9  -7.976   3.069  -5.477
   69    HB1  ALA   9           1HB      ALA   9  -6.620   3.720  -8.087
   70    HB2  ALA   9           2HB      ALA   9  -7.668   4.837  -7.212
   71    HB3  ALA   9           3HB      ALA   9  -6.169   4.274  -6.474
   72    H    ALA  10           H        ALA  10  -8.043   1.557  -8.675
   73    HA   ALA  10           HA       ALA  10 -10.584   2.476  -9.458
   74    HB1  ALA  10           1HB      ALA  10 -10.533   0.491 -11.010
   75    HB2  ALA  10           2HB      ALA  10  -9.157   1.588 -11.127
   76    HB3  ALA  10           3HB      ALA  10  -8.992   0.055 -10.270
   77    H    SER  11           H        SER  11  -9.571  -0.473  -7.769
   78    HA   SER  11           HA       SER  11 -12.105  -1.690  -7.660
   79    HB2  SER  11           2HB      SER  11  -9.706  -1.975  -5.838
   80    HB3  SER  11           3HB      SER  11 -11.127  -3.018  -5.774
   81    HG   SER  11           HG       SER  11  -9.611  -2.639  -8.134
   82    H    PHE  12           H        PHE  12 -10.411   0.411  -5.356
   83    HA   PHE  12           HA       PHE  12 -12.502   0.375  -3.423
   84    HB2  PHE  12           2HB      PHE  12  -9.985   1.923  -3.822
   85    HB3  PHE  12           3HB      PHE  12 -11.192   2.579  -2.720
   86    HD1  PHE  12           HD1      PHE  12 -10.524  -1.008  -3.260
   87    HD2  PHE  12           HD2      PHE  12 -10.006   2.347  -0.694
   88    HE1  PHE  12           HE1      PHE  12  -9.705  -2.499  -1.482
   89    HE2  PHE  12           HE2      PHE  12  -9.185   0.863   1.088
   90    HZ   PHE  12           HZ       PHE  12  -9.033  -1.564   0.695
   91    H    ILE  13           H        ILE  13 -11.848   2.251  -6.265
   92    HA   ILE  13           HA       ILE  13 -13.611   4.416  -5.619
   93    HB   ILE  13           HB       ILE  13 -12.140   3.570  -8.083
   94   HG12  ILE  13          2HG1      ILE  13 -11.032   4.938  -6.341
   95   HG13  ILE  13          3HG1      ILE  13 -11.155   5.788  -7.878
   96   HG21  ILE  13          1HG2      ILE  13 -14.418   5.528  -7.958
   97   HG22  ILE  13          2HG2      ILE  13 -13.179   5.590  -9.211
   98   HG23  ILE  13          3HG2      ILE  13 -14.204   4.163  -9.055
   99   HD11  ILE  13          3HD1      ILE  13 -11.886   6.755  -5.411
  100   HD12  ILE  13          1HD1      ILE  13 -12.345   7.428  -6.975
  101   HD13  ILE  13          2HD1      ILE  13 -13.423   6.302  -6.148
  102    H    VAL  14           H        VAL  14 -13.847   1.461  -7.545
  103    HA   VAL  14           HA       VAL  14 -16.458   1.997  -8.547
  104    HB   VAL  14           HB       VAL  14 -15.012  -0.643  -8.285
  105   HG11  VAL  14          1HG1      VAL  14 -16.719  -0.863 -10.408
  106   HG12  VAL  14          2HG1      VAL  14 -17.025  -1.490  -8.787
  107   HG13  VAL  14          3HG1      VAL  14 -17.672   0.081  -9.262
  108   HG21  VAL  14          3HG2      VAL  14 -13.792  -0.060 -10.049
  109   HG22  VAL  14          1HG2      VAL  14 -15.238   0.382 -10.957
  110   HG23  VAL  14          2HG2      VAL  14 -14.453   1.570  -9.916
  111    H    ARG  15           H        ARG  15 -15.249   0.797  -5.563
  112    HA   ARG  15           HA       ARG  15 -17.670  -0.573  -4.803
  113    HB2  ARG  15           2HB      ARG  15 -16.376  -1.479  -3.222
  114    HB3  ARG  15           3HB      ARG  15 -15.025  -0.600  -3.926
  115    HG2  ARG  15           2HG      ARG  15 -15.437   1.265  -2.411
  116    HG3  ARG  15           3HG      ARG  15 -16.807   0.398  -1.713
  117    HD2  ARG  15           2HD      ARG  15 -14.365  -1.184  -1.745
  118    HD3  ARG  15           3HD      ARG  15 -14.194   0.312  -0.827
  119    HE   ARG  15           HE       ARG  15 -15.774  -1.982  -0.124
  120   HH11  ARG  15          1HH1      ARG  15 -15.375   1.451   0.288
  121   HH12  ARG  15          2HH1      ARG  15 -16.195   1.495   1.813
  122   HH21  ARG  15          1HH2      ARG  15 -16.855  -1.937   1.884
  123   HH22  ARG  15          2HH2      ARG  15 -17.036  -0.433   2.721
  124    H    CYS  16           H        CYS  16 -16.140   2.537  -4.149
  125    HA   CYS  16           HA       CYS  16 -18.250   3.335  -2.332
  126    HB2  CYS  16           2HB      CYS  16 -15.911   4.897  -3.448
  127    HB3  CYS  16           3HB      CYS  16 -17.004   5.463  -2.190
  128    HG   CYS  16           HG       CYS  16 -14.453   3.275  -1.988
  129    H    ALA  17           H        ALA  17 -17.266   3.924  -5.649
  130    HA   ALA  17           HA       ALA  17 -18.945   6.109  -6.200
  131    HB1  ALA  17           1HB      ALA  17 -18.013   3.980  -8.121
  132    HB2  ALA  17           2HB      ALA  17 -18.585   5.597  -8.534
  133    HB3  ALA  17           3HB      ALA  17 -17.077   5.397  -7.643
  134    H    PHE  18           H        PHE  18 -19.494   2.628  -6.324
  135    HA   PHE  18           HA       PHE  18 -22.079   2.825  -7.525
  136    HB2  PHE  18           2HB      PHE  18 -20.452   0.798  -7.457
  137    HB3  PHE  18           3HB      PHE  18 -21.174   0.477  -5.884
  138    HD1  PHE  18           HD2      PHE  18 -21.958   0.897  -9.478
  139    HD2  PHE  18           HD1      PHE  18 -23.240  -0.604  -5.707
  140    HE1  PHE  18           HE2      PHE  18 -23.825  -0.266 -10.580
  141    HE2  PHE  18           HE1      PHE  18 -25.109  -1.770  -6.803
  142    HZ   PHE  18           HZ       PHE  18 -25.404  -1.601  -9.242
  143    H    GLU  19           H        GLU  19 -20.869   2.570  -4.225
  144    HA   GLU  19           HA       GLU  19 -23.492   2.339  -3.069
  145    HB2  GLU  19           2HB      GLU  19 -21.797   1.315  -1.804
  146    HB3  GLU  19           3HB      GLU  19 -20.727   2.702  -1.951
  147    HG2  GLU  19           2HG      GLU  19 -21.674   3.795  -0.221
  148    HG3  GLU  19           3HG      GLU  19 -23.287   3.176  -0.570
  149    H    HIS  20           H        HIS  20 -21.324   4.911  -3.914
  150    HA   HIS  20           HA       HIS  20 -22.470   6.919  -2.255
  151    HB2  HIS  20           2HB      HIS  20 -20.196   7.083  -3.237
  152    HB3  HIS  20           3HB      HIS  20 -20.920   7.253  -4.833
  153    HD1  HIS  20           HD1      HIS  20 -21.353   9.033  -1.486
  154    HD2  HIS  20           HD2      HIS  20 -20.999   9.847  -5.545
  155    HE1  HIS  20           HE1      HIS  20 -21.448  11.539  -1.681
  156    H    SER  21           H        SER  21 -23.100   5.766  -5.516
  157    HA   SER  21           HA       SER  21 -25.022   7.858  -6.056
  158    HB2  SER  21           2HB      SER  21 -24.445   5.345  -7.643
  159    HB3  SER  21           3HB      SER  21 -25.329   6.764  -8.205
  160    HG   SER  21           HG       SER  21 -22.754   7.166  -7.222
  161    H    ARG  22           H        ARG  22 -25.029   4.489  -5.079
  162    HA   ARG  22           HA       ARG  22 -27.703   3.855  -5.509
  163    HB2  ARG  22           2HB      ARG  22 -25.666   2.432  -4.625
  164    HB3  ARG  22           3HB      ARG  22 -26.321   2.864  -3.051
  165    HG2  ARG  22           2HG      ARG  22 -28.504   1.916  -3.762
  166    HG3  ARG  22           3HG      ARG  22 -27.728   1.369  -5.250
  167    HD2  ARG  22           2HD      ARG  22 -26.277  -0.086  -4.056
  168    HD3  ARG  22           3HD      ARG  22 -26.740   0.620  -2.508
  169    HE   ARG  22           HE       ARG  22 -29.053  -0.394  -3.638
  170   HH11  ARG  22          1HH1      ARG  22 -25.977  -1.612  -2.554
  171   HH12  ARG  22          2HH1      ARG  22 -26.599  -3.170  -2.123
  172   HH21  ARG  22          1HH2      ARG  22 -29.884  -2.442  -3.076
  173   HH22  ARG  22          2HH2      ARG  22 -28.821  -3.642  -2.422
  174    H    ARG  23           H        ARG  23 -26.165   5.454  -2.753
  175    HA   ARG  23           HA       ARG  23 -28.362   5.547  -1.038
  176    HB2  ARG  23           2HB      ARG  23 -26.386   6.180  -0.017
  177    HB3  ARG  23           3HB      ARG  23 -25.893   7.197  -1.364
  178    HG2  ARG  23           2HG      ARG  23 -27.089   8.996  -0.630
  179    HG3  ARG  23           3HG      ARG  23 -28.289   8.000   0.196
  180    HD2  ARG  23           2HD      ARG  23 -26.985   9.119   1.858
  181    HD3  ARG  23           3HD      ARG  23 -26.541   7.412   1.874
  182    HE   ARG  23           HE       ARG  23 -24.705   8.495   0.221
  183   HH11  ARG  23          1HH1      ARG  23 -25.801   9.323   3.420
  184   HH12  ARG  23          2HH1      ARG  23 -24.277   9.982   3.913
  185   HH21  ARG  23          1HH2      ARG  23 -22.693   9.361   0.859
  186   HH22  ARG  23          2HH2      ARG  23 -22.510  10.004   2.455
  187    H    PHE  24           H        PHE  24 -27.604   7.427  -3.863
  188    HA   PHE  24           HA       PHE  24 -29.572   9.466  -3.310
  189    HB2  PHE  24           2HB      PHE  24 -27.429   9.834  -4.620
  190    HB3  PHE  24           3HB      PHE  24 -28.183   8.942  -5.938
  191    HD1  PHE  24           HD1      PHE  24 -30.440   9.825  -6.797
  192    HD2  PHE  24           HD2      PHE  24 -27.753  12.117  -4.422
  193    HE1  PHE  24           HE1      PHE  24 -31.515  11.894  -7.584
  194    HE2  PHE  24           HE2      PHE  24 -28.824  14.189  -5.204
  195    HZ   PHE  24           HZ       PHE  24 -30.708  14.080  -6.786
  196    H    THR  25           H        THR  25 -29.286   6.621  -5.375
  197    HA   THR  25           HA       THR  25 -31.923   7.037  -6.511
  198    HB   THR  25           HB       THR  25 -29.932   6.046  -7.778
  199    HG1  THR  25           HG1      THR  25 -32.569   5.101  -7.722
  200   HG21  THR  25          3HG2      THR  25 -29.108   4.017  -7.270
  201   HG22  THR  25          1HG2      THR  25 -30.704   3.350  -6.929
  202   HG23  THR  25          2HG2      THR  25 -29.853   4.276  -5.693
  Start of MODEL   11
    1    H1   GLN   1           H        GLN   1   2.089   0.035   0.669
    2    HA   GLN   1           HA       GLN   1   3.361   0.399  -1.217
    3    HB2  GLN   1           2HB      GLN   1   1.970  -1.991  -1.297
    4    HB3  GLN   1           3HB      GLN   1   1.688  -1.306  -2.893
    5    HG2  GLN   1           2HG      GLN   1   3.625  -2.256  -3.438
    6    HG3  GLN   1           3HG      GLN   1   4.365  -0.907  -2.577
    7   HE21  GLN   1          1HE2      GLN   1   3.122  -4.182  -2.108
    8   HE22  GLN   1          2HE2      GLN   1   4.243  -4.620  -0.869
    9    H    ARG   2           H        ARG   2   3.569   1.822  -2.840
   10    HA   ARG   2           HA       ARG   2   1.281   3.365  -3.628
   11    HB2  ARG   2           2HB      ARG   2   4.032   3.558  -4.839
   12    HB3  ARG   2           3HB      ARG   2   2.812   4.817  -4.699
   13    HG2  ARG   2           2HG      ARG   2   3.353   5.300  -2.553
   14    HG3  ARG   2           3HG      ARG   2   3.818   3.638  -2.180
   15    HD2  ARG   2           2HD      ARG   2   5.872   4.650  -2.173
   16    HD3  ARG   2           3HD      ARG   2   5.771   4.154  -3.862
   17    HE   ARG   2           HE       ARG   2   5.725   6.359  -4.463
   18   HH11  ARG   2          1HH1      ARG   2   4.979   6.094  -1.073
   19   HH12  ARG   2          2HH1      ARG   2   5.010   7.805  -0.800
   20   HH21  ARG   2          1HH2      ARG   2   5.769   8.613  -4.116
   21   HH22  ARG   2          2HH2      ARG   2   5.459   9.237  -2.531
   22    H    SER   3           H        SER   3   3.458   1.069  -5.209
   23    HA   SER   3           HA       SER   3   2.501   1.329  -7.821
   24    HB2  SER   3           2HB      SER   3   4.561   0.059  -7.055
   25    HB3  SER   3           3HB      SER   3   3.478  -1.256  -6.599
   26    HG   SER   3           HG       SER   3   4.517  -1.029  -8.885
   27    H    ASN   4           H        ASN   4   1.370  -0.668  -5.138
   28    HA   ASN   4           HA       ASN   4  -0.667  -1.944  -6.732
   29    HB2  ASN   4           2HB      ASN   4  -0.188  -1.953  -3.744
   30    HB3  ASN   4           3HB      ASN   4  -1.371  -2.956  -4.579
   31   HD21  ASN   4          1HD2      ASN   4   0.009  -4.561  -3.354
   32   HD22  ASN   4          2HD2      ASN   4   1.352  -5.231  -4.210
   33    H    PHE   5           H        PHE   5  -0.364   0.948  -4.938
   34    HA   PHE   5           HA       PHE   5  -3.048   1.321  -4.140
   35    HB2  PHE   5           2HB      PHE   5  -1.080   2.619  -3.284
   36    HB3  PHE   5           3HB      PHE   5  -1.037   3.472  -4.824
   37    HD1  PHE   5           HD2      PHE   5  -3.911   2.478  -2.677
   38    HD2  PHE   5           HD1      PHE   5  -1.654   5.652  -4.393
   39    HE1  PHE   5           HE2      PHE   5  -5.547   4.102  -1.817
   40    HE2  PHE   5           HE1      PHE   5  -3.286   7.281  -3.535
   41    HZ   PHE   5           HZ       PHE   5  -5.236   6.507  -2.246
   42    H    HIS   6           H        HIS   6  -1.292   2.121  -7.091
   43    HA   HIS   6           HA       HIS   6  -3.204   3.726  -8.332
   44    HB2  HIS   6           2HB      HIS   6  -0.912   2.080  -9.230
   45    HB3  HIS   6           3HB      HIS   6  -2.107   2.477 -10.461
   46    HD1  HIS   6           HD1      HIS   6   0.941   3.598 -10.018
   47    HD2  HIS   6           HD2      HIS   6  -2.655   5.600  -9.448
   48    HE1  HIS   6           HE1      HIS   6   1.494   6.043 -10.216
   49    HA   PRO   7           HA       PRO   7  -5.019  -0.277 -10.349
   50    HB2  PRO   7           2HB      PRO   7  -4.243  -2.654  -9.291
   51    HB3  PRO   7           3HB      PRO   7  -3.383  -1.868 -10.620
   52    HG2  PRO   7           2HG      PRO   7  -2.737  -1.891  -7.697
   53    HG3  PRO   7           3HG      PRO   7  -1.650  -2.080  -9.085
   54    HD2  PRO   7           2HD      PRO   7  -1.903   0.257  -7.740
   55    HD3  PRO   7           3HD      PRO   7  -1.555   0.189  -9.479
   56    H    LEU   8           H        LEU   8  -4.421  -0.091  -6.917
   57    HA   LEU   8           HA       LEU   8  -6.797  -1.557  -6.190
   58    HB2  LEU   8           2HB      LEU   8  -4.805  -1.595  -4.772
   59    HB3  LEU   8           3HB      LEU   8  -4.946   0.145  -4.526
   60    HG   LEU   8           HG       LEU   8  -5.745  -1.457  -2.667
   61   HD11  LEU   8          1HD1      LEU   8  -7.959   0.374  -3.177
   62   HD12  LEU   8          2HD1      LEU   8  -6.369   1.118  -3.342
   63   HD13  LEU   8          3HD1      LEU   8  -6.815   0.318  -1.835
   64   HD21  LEU   8          3HD2      LEU   8  -8.368  -1.437  -4.042
   65   HD22  LEU   8          1HD2      LEU   8  -7.698  -2.590  -2.887
   66   HD23  LEU   8          2HD2      LEU   8  -7.186  -2.633  -4.575
   67    H    ALA   9           H        ALA   9  -5.936   1.722  -6.854
   68    HA   ALA   9           HA       ALA   9  -7.921   3.088  -5.428
   69    HB1  ALA   9           1HB      ALA   9  -6.113   4.305  -6.407
   70    HB2  ALA   9           2HB      ALA   9  -6.560   3.770  -8.027
   71    HB3  ALA   9           3HB      ALA   9  -7.612   4.875  -7.142
   72    H    ALA  10           H        ALA  10  -7.979   1.611  -8.643
   73    HA   ALA  10           HA       ALA  10 -10.519   2.535  -9.422
   74    HB1  ALA  10           1HB      ALA  10  -9.085   1.668 -11.096
   75    HB2  ALA  10           2HB      ALA  10  -8.922   0.125 -10.257
   76    HB3  ALA  10           3HB      ALA  10 -10.461   0.568 -10.996
   77    H    SER  11           H        SER  11  -9.506  -0.431  -7.763
   78    HA   SER  11           HA       SER  11 -12.039  -1.653  -7.674
   79    HB2  SER  11           2HB      SER  11  -9.643  -1.954  -5.850
   80    HB3  SER  11           3HB      SER  11 -11.063  -2.999  -5.799
   81    HG   SER  11           HG       SER  11  -9.247  -3.762  -7.105
   82    H    PHE  12           H        PHE  12 -10.354   0.425  -5.342
   83    HA   PHE  12           HA       PHE  12 -12.449   0.365  -3.415
   84    HB2  PHE  12           2HB      PHE  12  -9.933   1.922  -3.790
   85    HB3  PHE  12           3HB      PHE  12 -11.144   2.563  -2.684
   86    HD1  PHE  12           HD2      PHE  12 -10.469  -1.018  -3.263
   87    HD2  PHE  12           HD1      PHE  12  -9.961   2.311  -0.659
   88    HE1  PHE  12           HE2      PHE  12  -9.651  -2.526  -1.500
   89    HE2  PHE  12           HE1      PHE  12  -9.141   0.807   1.107
   90    HZ   PHE  12           HZ       PHE  12  -8.986  -1.615   0.689
   91    H    ILE  13           H        ILE  13 -11.791   2.273  -6.235
   92    HA   ILE  13           HA       ILE  13 -13.558   4.428  -5.570
   93    HB   ILE  13           HB       ILE  13 -12.080   3.612  -8.038
   94   HG12  ILE  13          2HG1      ILE  13 -10.978   4.962  -6.279
   95   HG13  ILE  13          3HG1      ILE  13 -11.098   5.828  -7.806
   96   HG21  ILE  13          1HG2      ILE  13 -14.360   5.565  -7.898
   97   HG22  ILE  13          2HG2      ILE  13 -13.118   5.643  -9.147
   98   HG23  ILE  13          3HG2      ILE  13 -14.142   4.213  -9.010
   99   HD11  ILE  13          3HD1      ILE  13 -11.836   6.767  -5.331
  100   HD12  ILE  13          1HD1      ILE  13 -12.293   7.457  -6.889
  101   HD13  ILE  13          2HD1      ILE  13 -13.371   6.321  -6.077
  102    H    VAL  14           H        VAL  14 -13.785   1.494  -7.529
  103    HA   VAL  14           HA       VAL  14 -16.394   2.038  -8.532
  104    HB   VAL  14           HB       VAL  14 -14.945  -0.603  -8.295
  105   HG11  VAL  14          1HG1      VAL  14 -17.543   0.194  -9.506
  106   HG12  VAL  14          2HG1      VAL  14 -16.567  -1.024 -10.330
  107   HG13  VAL  14          3HG1      VAL  14 -17.095  -1.292  -8.668
  108   HG21  VAL  14          3HG2      VAL  14 -15.155   0.431 -10.959
  109   HG22  VAL  14          1HG2      VAL  14 -14.403   1.633  -9.910
  110   HG23  VAL  14          2HG2      VAL  14 -13.711   0.016 -10.037
  111    H    ARG  15           H        ARG  15 -15.191   0.807  -5.558
  112    HA   ARG  15           HA       ARG  15 -17.613  -0.575  -4.819
  113    HB2  ARG  15           2HB      ARG  15 -16.321  -1.496  -3.245
  114    HB3  ARG  15           3HB      ARG  15 -14.970  -0.608  -3.936
  115    HG2  ARG  15           2HG      ARG  15 -15.388   1.240  -2.401
  116    HG3  ARG  15           3HG      ARG  15 -16.758   0.363  -1.716
  117    HD2  ARG  15           2HD      ARG  15 -14.668  -1.448  -1.586
  118    HD3  ARG  15           3HD      ARG  15 -13.918   0.095  -1.180
  119    HE   ARG  15           HE       ARG  15 -15.068   0.093   0.800
  120   HH11  ARG  15          1HH1      ARG  15 -16.478  -2.260  -1.344
  121   HH12  ARG  15          2HH1      ARG  15 -17.525  -2.927  -0.135
  122   HH21  ARG  15          1HH2      ARG  15 -16.442  -0.776   2.400
  123   HH22  ARG  15          2HH2      ARG  15 -17.504  -2.081   1.994
  124    H    CYS  16           H        CYS  16 -16.088   2.530  -4.127
  125    HA   CYS  16           HA       CYS  16 -18.204   3.305  -2.307
  126    HB2  CYS  16           2HB      CYS  16 -15.865   4.883  -3.399
  127    HB3  CYS  16           3HB      CYS  16 -16.961   5.433  -2.138
  128    HG   CYS  16           HG       CYS  16 -14.434   3.205  -1.957
  129    H    ALA  17           H        ALA  17 -17.212   3.932  -5.614
  130    HA   ALA  17           HA       ALA  17 -18.893   6.121  -6.146
  131    HB1  ALA  17           1HB      ALA  17 -18.527   5.636  -8.484
  132    HB2  ALA  17           2HB      ALA  17 -17.020   5.427  -7.592
  133    HB3  ALA  17           3HB      ALA  17 -17.953   4.015  -8.088
  134    H    PHE  18           H        PHE  18 -19.437   2.640  -6.310
  135    HA   PHE  18           HA       PHE  18 -22.019   2.847  -7.515
  136    HB2  PHE  18           2HB      PHE  18 -20.390   0.822  -7.466
  137    HB3  PHE  18           3HB      PHE  18 -21.114   0.482  -5.898
  138    HD1  PHE  18           HD1      PHE  18 -21.812   0.827  -9.503
  139    HD2  PHE  18           HD2      PHE  18 -23.260  -0.488  -5.723
  140    HE1  PHE  18           HE1      PHE  18 -23.676  -0.326 -10.622
  141    HE2  PHE  18           HE2      PHE  18 -25.125  -1.644  -6.835
  142    HZ   PHE  18           HZ       PHE  18 -25.334  -1.565  -9.288
  143    H    GLU  19           H        GLU  19 -20.817   2.558  -4.215
  144    HA   GLU  19           HA       GLU  19 -23.442   2.310  -3.069
  145    HB2  GLU  19           2HB      GLU  19 -21.749   1.275  -1.811
  146    HB3  GLU  19           3HB      GLU  19 -20.681   2.665  -1.939
  147    HG2  GLU  19           2HG      GLU  19 -21.634   3.737  -0.200
  148    HG3  GLU  19           3HG      GLU  19 -23.246   3.120  -0.560
  149    H    HIS  20           H        HIS  20 -21.276   4.894  -3.880
  150    HA   HIS  20           HA       HIS  20 -22.429   6.882  -2.202
  151    HB2  HIS  20           2HB      HIS  20 -20.153   7.061  -3.175
  152    HB3  HIS  20           3HB      HIS  20 -20.873   7.246  -4.771
  153    HD1  HIS  20           HD1      HIS  20 -21.797   9.536  -5.387
  154    HD2  HIS  20           HD2      HIS  20 -20.473   9.299  -1.456
  155    HE1  HIS  20           HE1      HIS  20 -21.774  11.904  -4.541
  156    H    SER  21           H        SER  21 -23.049   5.764  -5.476
  157    HA   SER  21           HA       SER  21 -24.973   7.859  -5.998
  158    HB2  SER  21           2HB      SER  21 -24.388   5.366  -7.611
  159    HB3  SER  21           3HB      SER  21 -25.272   6.789  -8.160
  160    HG   SER  21           HG       SER  21 -22.532   6.432  -7.757
  161    H    ARG  22           H        ARG  22 -24.977   4.480  -5.058
  162    HA   ARG  22           HA       ARG  22 -27.650   3.847  -5.502
  163    HB2  ARG  22           2HB      ARG  22 -25.613   2.418  -4.628
  164    HB3  ARG  22           3HB      ARG  22 -26.273   2.831  -3.052
  165    HG2  ARG  22           2HG      ARG  22 -28.452   1.887  -3.779
  166    HG3  ARG  22           3HG      ARG  22 -27.672   1.359  -5.271
  167    HD2  ARG  22           2HD      ARG  22 -27.095  -0.511  -4.217
  168    HD3  ARG  22           3HD      ARG  22 -26.010   0.458  -3.221
  169    HE   ARG  22           HE       ARG  22 -27.486   0.267  -1.471
  170   HH11  ARG  22          1HH1      ARG  22 -29.016  -0.799  -4.411
  171   HH12  ARG  22          2HH1      ARG  22 -30.404  -1.451  -3.605
  172   HH21  ARG  22          1HH2      ARG  22 -29.309  -0.587  -0.399
  173   HH22  ARG  22          2HH2      ARG  22 -30.571  -1.329  -1.324
  174    H    ARG  23           H        ARG  23 -26.121   5.418  -2.725
  175    HA   ARG  23           HA       ARG  23 -28.322   5.489  -1.014
  176    HB2  ARG  23           2HB      ARG  23 -26.350   6.114   0.019
  177    HB3  ARG  23           3HB      ARG  23 -25.855   7.146  -1.316
  178    HG2  ARG  23           2HG      ARG  23 -27.055   8.935  -0.565
  179    HG3  ARG  23           3HG      ARG  23 -28.256   7.928   0.247
  180    HD2  ARG  23           2HD      ARG  23 -26.871   9.116   1.863
  181    HD3  ARG  23           3HD      ARG  23 -26.626   7.374   1.979
  182    HE   ARG  23           HE       ARG  23 -24.680   8.322   0.262
  183   HH11  ARG  23          1HH1      ARG  23 -25.616   8.798   3.581
  184   HH12  ARG  23          2HH1      ARG  23 -24.008   9.152   4.120
  185   HH21  ARG  23          1HH2      ARG  23 -22.558   8.787   0.960
  186   HH22  ARG  23          2HH2      ARG  23 -22.269   9.146   2.628
  187    H    PHE  24           H        PHE  24 -27.559   7.401  -3.817
  188    HA   PHE  24           HA       PHE  24 -29.531   9.432  -3.246
  189    HB2  PHE  24           2HB      PHE  24 -27.386   9.816  -4.547
  190    HB3  PHE  24           3HB      PHE  24 -28.136   8.939  -5.877
  191    HD1  PHE  24           HD1      PHE  24 -30.444   9.825  -6.667
  192    HD2  PHE  24           HD2      PHE  24 -27.660  12.100  -4.388
  193    HE1  PHE  24           HE1      PHE  24 -31.520  11.902  -7.432
  194    HE2  PHE  24           HE2      PHE  24 -28.731  14.180  -5.149
  195    HZ   PHE  24           HZ       PHE  24 -30.664  14.083  -6.672
  196    H    THR  25           H        THR  25 -29.237   6.609  -5.342
  197    HA   THR  25           HA       THR  25 -31.871   7.035  -6.480
  198    HB   THR  25           HB       THR  25 -29.875   6.060  -7.753
  199    HG1  THR  25           HG1      THR  25 -31.427   4.376  -8.684
  200   HG21  THR  25          3HG2      THR  25 -29.800   4.268  -5.687
  201   HG22  THR  25          1HG2      THR  25 -29.050   4.027  -7.265
  202   HG23  THR  25          2HG2      THR  25 -30.647   3.355  -6.935
  Start of MODEL   12
    1    H1   GLN   1           H        GLN   1   1.940  -0.518   0.644
    2    HA   GLN   1           HA       GLN   1   3.362   0.312  -1.108
    3    HB2  GLN   1           2HB      GLN   1   1.460  -1.580  -2.479
    4    HB3  GLN   1           3HB      GLN   1   3.182  -1.377  -2.771
    5    HG2  GLN   1           2HG      GLN   1   1.878  -2.598  -0.352
    6    HG3  GLN   1           3HG      GLN   1   2.835  -3.420  -1.584
    7   HE21  GLN   1          1HE2      GLN   1   4.949  -1.712  -1.866
    8   HE22  GLN   1          2HE2      GLN   1   5.859  -1.660  -0.398
    9    H    ARG   2           H        ARG   2   3.592   1.748  -2.728
   10    HA   ARG   2           HA       ARG   2   1.309   3.305  -3.501
   11    HB2  ARG   2           2HB      ARG   2   4.068   3.524  -4.689
   12    HB3  ARG   2           3HB      ARG   2   2.846   4.779  -4.532
   13    HG2  ARG   2           2HG      ARG   2   3.371   5.219  -2.373
   14    HG3  ARG   2           3HG      ARG   2   3.835   3.551  -2.030
   15    HD2  ARG   2           2HD      ARG   2   5.888   4.562  -1.987
   16    HD3  ARG   2           3HD      ARG   2   5.799   4.102  -3.687
   17    HE   ARG   2           HE       ARG   2   4.792   6.741  -3.131
   18   HH11  ARG   2          1HH1      ARG   2   7.607   4.837  -3.889
   19   HH12  ARG   2          2HH1      ARG   2   8.487   6.169  -4.562
   20   HH21  ARG   2          1HH2      ARG   2   5.941   8.502  -4.015
   21   HH22  ARG   2          2HH2      ARG   2   7.539   8.253  -4.633
   22    H    SER   3           H        SER   3   3.499   1.042  -5.112
   23    HA   SER   3           HA       SER   3   2.560   1.354  -7.726
   24    HB2  SER   3           2HB      SER   3   3.648  -1.155  -6.424
   25    HB3  SER   3           3HB      SER   3   3.534  -0.861  -8.159
   26    HG   SER   3           HG       SER   3   4.839   1.151  -7.464
   27    H    ASN   4           H        ASN   4   1.413  -0.698  -5.092
   28    HA   ASN   4           HA       ASN   4  -0.610  -1.944  -6.725
   29    HB2  ASN   4           2HB      ASN   4  -0.152  -2.013  -3.734
   30    HB3  ASN   4           3HB      ASN   4  -1.327  -3.000  -4.598
   31   HD21  ASN   4          1HD2      ASN   4  -0.638  -4.730  -5.809
   32   HD22  ASN   4          2HD2      ASN   4   0.976  -5.342  -5.734
   33    H    PHE   5           H        PHE   5  -0.324   0.912  -4.871
   34    HA   PHE   5           HA       PHE   5  -3.014   1.264  -4.085
   35    HB2  PHE   5           2HB      PHE   5  -1.054   2.548  -3.189
   36    HB3  PHE   5           3HB      PHE   5  -1.001   3.431  -4.711
   37    HD1  PHE   5           HD2      PHE   5  -3.622   2.461  -2.232
   38    HD2  PHE   5           HD1      PHE   5  -1.891   5.533  -4.616
   39    HE1  PHE   5           HE2      PHE   5  -5.266   4.066  -1.352
   40    HE2  PHE   5           HE1      PHE   5  -3.531   7.143  -3.739
   41    HZ   PHE   5           HZ       PHE   5  -5.223   6.410  -2.106
   42    H    HIS   6           H        HIS   6  -1.240   2.125  -7.007
   43    HA   HIS   6           HA       HIS   6  -3.145   3.753  -8.228
   44    HB2  HIS   6           2HB      HIS   6  -0.844   2.128  -9.143
   45    HB3  HIS   6           3HB      HIS   6  -2.031   2.547 -10.375
   46    HD1  HIS   6           HD1      HIS   6  -2.614   5.280 -10.345
   47    HD2  HIS   6           HD2      HIS   6   1.050   4.025  -8.843
   48    HE1  HIS   6           HE1      HIS   6  -1.141   7.318 -10.374
   49    HA   PRO   7           HA       PRO   7  -4.940  -0.212 -10.337
   50    HB2  PRO   7           2HB      PRO   7  -4.168  -2.609  -9.322
   51    HB3  PRO   7           3HB      PRO   7  -3.300  -1.795 -10.629
   52    HG2  PRO   7           2HG      PRO   7  -2.674  -1.876  -7.703
   53    HG3  PRO   7           3HG      PRO   7  -1.577  -2.035  -9.086
   54    HD2  PRO   7           2HD      PRO   7  -1.843   0.274  -7.697
   55    HD3  PRO   7           3HD      PRO   7  -1.483   0.242  -9.435
   56    H    LEU   8           H        LEU   8  -4.366  -0.094  -6.898
   57    HA   LEU   8           HA       LEU   8  -6.745  -1.577  -6.217
   58    HB2  LEU   8           2HB      LEU   8  -4.762  -1.640  -4.787
   59    HB3  LEU   8           3HB      LEU   8  -4.907   0.094  -4.507
   60    HG   LEU   8           HG       LEU   8  -5.716  -1.546  -2.686
   61   HD11  LEU   8          1HD1      LEU   8  -7.930   0.291  -3.174
   62   HD12  LEU   8          2HD1      LEU   8  -6.341   1.041  -3.313
   63   HD13  LEU   8          3HD1      LEU   8  -6.796   0.210  -1.826
   64   HD21  LEU   8          3HD2      LEU   8  -7.143  -2.686  -4.626
   65   HD22  LEU   8          1HD2      LEU   8  -8.330  -1.502  -4.077
   66   HD23  LEU   8          2HD2      LEU   8  -7.667  -2.678  -2.941
   67    H    ALA   9           H        ALA   9  -5.884   1.716  -6.809
   68    HA   ALA   9           HA       ALA   9  -7.881   3.050  -5.370
   69    HB1  ALA   9           1HB      ALA   9  -6.503   3.785  -7.946
   70    HB2  ALA   9           2HB      ALA   9  -7.562   4.872  -7.047
   71    HB3  ALA   9           3HB      ALA   9  -6.068   4.289  -6.313
   72    H    ALA  10           H        ALA  10  -7.914   1.637  -8.615
   73    HA   ALA  10           HA       ALA  10 -10.450   2.574  -9.393
   74    HB1  ALA  10           1HB      ALA  10  -8.843   0.183 -10.263
   75    HB2  ALA  10           2HB      ALA  10 -10.377   0.637 -11.005
   76    HB3  ALA  10           3HB      ALA  10  -9.004   1.741 -11.074
   77    H    SER  11           H        SER  11  -9.444  -0.424  -7.786
   78    HA   SER  11           HA       SER  11 -11.976  -1.650  -7.739
   79    HB2  SER  11           2HB      SER  11  -9.593  -1.985  -5.904
   80    HB3  SER  11           3HB      SER  11 -11.011  -3.033  -5.885
   81    HG   SER  11           HG       SER  11  -9.123  -3.702  -7.208
   82    H    PHE  12           H        PHE  12 -10.310   0.382  -5.355
   83    HA   PHE  12           HA       PHE  12 -12.418   0.281  -3.444
   84    HB2  PHE  12           2HB      PHE  12  -9.903   1.848  -3.770
   85    HB3  PHE  12           3HB      PHE  12 -11.122   2.465  -2.660
   86    HD1  PHE  12           HD2      PHE  12 -10.437  -1.102  -3.306
   87    HD2  PHE  12           HD1      PHE  12  -9.953   2.174  -0.632
   88    HE1  PHE  12           HE2      PHE  12  -9.629  -2.644  -1.568
   89    HE2  PHE  12           HE1      PHE  12  -9.143   0.637   1.110
   90    HZ   PHE  12           HZ       PHE  12  -8.982  -1.776   0.644
   91    H    ILE  13           H        ILE  13 -11.743   2.246  -6.221
   92    HA   ILE  13           HA       ILE  13 -13.518   4.385  -5.524
   93    HB   ILE  13           HB       ILE  13 -12.022   3.621  -7.998
   94   HG12  ILE  13          2HG1      ILE  13 -10.934   4.936  -6.204
   95   HG13  ILE  13          3HG1      ILE  13 -11.045   5.833  -7.715
   96   HG21  ILE  13          1HG2      ILE  13 -14.306   5.567  -7.835
   97   HG22  ILE  13          2HG2      ILE  13 -13.055   5.672  -9.073
   98   HG23  ILE  13          3HG2      ILE  13 -14.078   4.238  -8.972
   99   HD11  ILE  13          3HD1      ILE  13 -11.803   6.721  -5.227
  100   HD12  ILE  13          1HD1      ILE  13 -12.249   7.441  -6.773
  101   HD13  ILE  13          2HD1      ILE  13 -13.331   6.288  -5.992
  102    H    VAL  14           H        VAL  14 -13.728   1.491  -7.543
  103    HA   VAL  14           HA       VAL  14 -16.330   2.051  -8.554
  104    HB   VAL  14           HB       VAL  14 -14.879  -0.592  -8.360
  105   HG11  VAL  14          1HG1      VAL  14 -17.527   0.163  -9.359
  106   HG12  VAL  14          2HG1      VAL  14 -16.557  -0.773 -10.498
  107   HG13  VAL  14          3HG1      VAL  14 -16.897  -1.416  -8.891
  108   HG21  VAL  14          3HG2      VAL  14 -14.354   1.684  -9.943
  109   HG22  VAL  14          1HG2      VAL  14 -13.623   0.083 -10.061
  110   HG23  VAL  14          2HG2      VAL  14 -15.061   0.468 -11.007
  111    H    ARG  15           H        ARG  15 -15.146   0.762  -5.597
  112    HA   ARG  15           HA       ARG  15 -17.571  -0.638  -4.903
  113    HB2  ARG  15           2HB      ARG  15 -16.289  -1.589  -3.338
  114    HB3  ARG  15           3HB      ARG  15 -14.934  -0.685  -4.002
  115    HG2  ARG  15           2HG      ARG  15 -15.366   1.131  -2.433
  116    HG3  ARG  15           3HG      ARG  15 -16.739   0.239  -1.776
  117    HD2  ARG  15           2HD      ARG  15 -13.820  -0.478  -1.642
  118    HD3  ARG  15           3HD      ARG  15 -14.915  -0.128  -0.305
  119    HE   ARG  15           HE       ARG  15 -14.616  -2.629  -1.696
  120   HH11  ARG  15          1HH1      ARG  15 -16.716  -0.664   0.265
  121   HH12  ARG  15          2HH1      ARG  15 -17.629  -2.009   0.866
  122   HH21  ARG  15          1HH2      ARG  15 -15.810  -4.408  -0.912
  123   HH22  ARG  15          2HH2      ARG  15 -17.112  -4.138   0.196
  124    H    CYS  16           H        CYS  16 -16.056   2.455  -4.138
  125    HA   CYS  16           HA       CYS  16 -18.185   3.190  -2.318
  126    HB2  CYS  16           2HB      CYS  16 -15.841   4.793  -3.361
  127    HB3  CYS  16           3HB      CYS  16 -16.947   5.316  -2.097
  128    HG   CYS  16           HG       CYS  16 -15.743   4.177  -0.131
  129    H    ALA  17           H        ALA  17 -17.171   3.885  -5.604
  130    HA   ALA  17           HA       ALA  17 -18.852   6.082  -6.103
  131    HB1  ALA  17           1HB      ALA  17 -16.968   5.420  -7.549
  132    HB2  ALA  17           2HB      ALA  17 -17.895   4.017  -8.081
  133    HB3  ALA  17           3HB      ALA  17 -18.468   5.643  -8.449
  134    H    PHE  18           H        PHE  18 -19.389   2.604  -6.342
  135    HA   PHE  18           HA       PHE  18 -21.964   2.832  -7.560
  136    HB2  PHE  18           2HB      PHE  18 -20.332   0.809  -7.540
  137    HB3  PHE  18           3HB      PHE  18 -21.067   0.436  -5.984
  138    HD1  PHE  18           HD2      PHE  18 -22.364   1.576  -9.296
  139    HD2  PHE  18           HD1      PHE  18 -22.586  -1.265  -6.135
  140    HE1  PHE  18           HE2      PHE  18 -24.219   0.444 -10.449
  141    HE2  PHE  18           HE1      PHE  18 -24.441  -2.403  -7.283
  142    HZ   PHE  18           HZ       PHE  18 -25.260  -1.548  -9.443
  143    H    GLU  19           H        GLU  19 -20.784   2.478  -4.258
  144    HA   GLU  19           HA       GLU  19 -23.417   2.204  -3.135
  145    HB2  GLU  19           2HB      GLU  19 -21.731   1.146  -1.886
  146    HB3  GLU  19           3HB      GLU  19 -20.664   2.540  -1.979
  147    HG2  GLU  19           2HG      GLU  19 -21.631   3.575  -0.226
  148    HG3  GLU  19           3HG      GLU  19 -23.239   2.964  -0.609
  149    H    HIS  20           H        HIS  20 -21.249   4.806  -3.879
  150    HA   HIS  20           HA       HIS  20 -22.416   6.759  -2.170
  151    HB2  HIS  20           2HB      HIS  20 -20.133   6.960  -3.124
  152    HB3  HIS  20           3HB      HIS  20 -20.843   7.177  -4.721
  153    HD1  HIS  20           HD1      HIS  20 -19.911   9.545  -5.003
  154    HD2  HIS  20           HD2      HIS  20 -22.333   9.094  -1.658
  155    HE1  HIS  20           HE1      HIS  20 -20.369  11.879  -4.185
  156    H    SER  21           H        SER  21 -23.012   5.706  -5.470
  157    HA   SER  21           HA       SER  21 -24.935   7.809  -5.963
  158    HB2  SER  21           2HB      SER  21 -24.335   5.349  -7.622
  159    HB3  SER  21           3HB      SER  21 -25.218   6.782  -8.148
  160    HG   SER  21           HG       SER  21 -22.638   7.125  -7.135
  161    H    ARG  22           H        ARG  22 -24.941   4.411  -5.092
  162    HA   ARG  22           HA       ARG  22 -27.610   3.784  -5.567
  163    HB2  ARG  22           2HB      ARG  22 -25.577   2.340  -4.708
  164    HB3  ARG  22           3HB      ARG  22 -26.248   2.721  -3.128
  165    HG2  ARG  22           2HG      ARG  22 -28.421   1.790  -3.889
  166    HG3  ARG  22           3HG      ARG  22 -27.630   1.291  -5.386
  167    HD2  ARG  22           2HD      ARG  22 -26.693  -0.487  -4.413
  168    HD3  ARG  22           3HD      ARG  22 -26.167   0.455  -3.019
  169    HE   ARG  22           HE       ARG  22 -28.430  -1.249  -3.156
  170   HH11  ARG  22          1HH1      ARG  22 -27.307   1.746  -1.781
  171   HH12  ARG  22          2HH1      ARG  22 -28.377   1.673  -0.420
  172   HH21  ARG  22          1HH2      ARG  22 -29.843  -1.356  -1.368
  173   HH22  ARG  22          2HH2      ARG  22 -29.818  -0.092  -0.186
  174    H    ARG  23           H        ARG  23 -26.102   5.301  -2.748
  175    HA   ARG  23           HA       ARG  23 -28.315   5.335  -1.052
  176    HB2  ARG  23           2HB      ARG  23 -26.352   5.941   0.007
  177    HB3  ARG  23           3HB      ARG  23 -25.848   7.000  -1.303
  178    HG2  ARG  23           2HG      ARG  23 -27.057   8.772  -0.525
  179    HG3  ARG  23           3HG      ARG  23 -28.261   7.748   0.258
  180    HD2  ARG  23           2HD      ARG  23 -26.232   7.069   1.777
  181    HD3  ARG  23           3HD      ARG  23 -25.575   8.610   1.226
  182    HE   ARG  23           HE       ARG  23 -27.763   8.208   3.052
  183   HH11  ARG  23          1HH1      ARG  23 -26.250  10.405   0.816
  184   HH12  ARG  23          2HH1      ARG  23 -26.932  11.821   1.543
  185   HH21  ARG  23          1HH2      ARG  23 -28.668  10.065   4.019
  186   HH22  ARG  23          2HH2      ARG  23 -28.306  11.627   3.366
  187    H    PHE  24           H        PHE  24 -27.536   7.304  -3.810
  188    HA   PHE  24           HA       PHE  24 -29.515   9.320  -3.212
  189    HB2  PHE  24           2HB      PHE  24 -27.361   9.734  -4.490
  190    HB3  PHE  24           3HB      PHE  24 -28.099   8.881  -5.842
  191    HD1  PHE  24           HD2      PHE  24 -30.354   9.784  -6.692
  192    HD2  PHE  24           HD1      PHE  24 -27.692  12.008  -4.226
  193    HE1  PHE  24           HE2      PHE  24 -31.427  11.874  -7.424
  194    HE2  PHE  24           HE1      PHE  24 -28.761  14.102  -4.953
  195    HZ   PHE  24           HZ       PHE  24 -30.630  14.036  -6.555
  196    H    THR  25           H        THR  25 -29.201   6.540  -5.362
  197    HA   THR  25           HA       THR  25 -31.829   6.985  -6.510
  198    HB   THR  25           HB       THR  25 -29.823   6.040  -7.789
  199    HG1  THR  25           HG1      THR  25 -32.438   4.986  -7.775
  200   HG21  THR  25          3HG2      THR  25 -30.595   3.317  -7.031
  201   HG22  THR  25          1HG2      THR  25 -29.759   4.206  -5.758
  202   HG23  THR  25          2HG2      THR  25 -28.997   3.998  -7.336
  Start of MODEL   13
    1    H1   GLN   1           H        GLN   1   4.569  -0.482  -1.759
    2    HA   GLN   1           HA       GLN   1   2.397  -0.990  -2.220
    3    HB2  GLN   1           2HB      GLN   1   2.412  -0.393   0.298
    4    HB3  GLN   1           3HB      GLN   1   1.602   1.086  -0.200
    5    HG2  GLN   1           2HG      GLN   1  -0.205  -0.206   0.264
    6    HG3  GLN   1           3HG      GLN   1   0.011  -0.602  -1.440
    7   HE21  GLN   1          1HE2      GLN   1   1.047  -2.587  -1.979
    8   HE22  GLN   1          2HE2      GLN   1   1.009  -3.920  -0.881
    9    H    ARG   2           H        ARG   2   3.708   1.744  -3.191
   10    HA   ARG   2           HA       ARG   2   1.405   3.298  -3.911
   11    HB2  ARG   2           2HB      ARG   2   4.137   3.526  -5.157
   12    HB3  ARG   2           3HB      ARG   2   2.916   4.778  -4.972
   13    HG2  ARG   2           2HG      ARG   2   3.487   5.214  -2.824
   14    HG3  ARG   2           3HG      ARG   2   3.962   3.547  -2.495
   15    HD2  ARG   2           2HD      ARG   2   5.952   3.963  -4.005
   16    HD3  ARG   2           3HD      ARG   2   5.519   5.671  -3.948
   17    HE   ARG   2           HE       ARG   2   6.791   4.142  -1.886
   18   HH11  ARG   2          1HH1      ARG   2   4.751   6.887  -2.536
   19   HH12  ARG   2          2HH1      ARG   2   5.179   7.716  -1.076
   20   HH21  ARG   2          1HH2      ARG   2   7.363   5.223   0.039
   21   HH22  ARG   2          2HH2      ARG   2   6.666   6.769   0.388
   22    H    SER   3           H        SER   3   3.565   1.043  -5.574
   23    HA   SER   3           HA       SER   3   2.569   1.358  -8.165
   24    HB2  SER   3           2HB      SER   3   4.643   0.078  -7.457
   25    HB3  SER   3           3HB      SER   3   3.571  -1.250  -7.014
   26    HG   SER   3           HG       SER   3   4.011  -0.129  -9.574
   27    H    ASN   4           H        ASN   4   1.482  -0.700  -5.511
   28    HA   ASN   4           HA       ASN   4  -0.573  -1.948  -7.103
   29    HB2  ASN   4           2HB      ASN   4  -0.051  -2.021  -4.123
   30    HB3  ASN   4           3HB      ASN   4  -1.243  -3.009  -4.963
   31   HD21  ASN   4          1HD2      ASN   4   0.320  -4.508  -3.659
   32   HD22  ASN   4          2HD2      ASN   4   1.589  -5.204  -4.601
   33    H    PHE   5           H        PHE   5  -0.253   0.905  -5.250
   34    HA   PHE   5           HA       PHE   5  -2.926   1.252  -4.406
   35    HB2  PHE   5           2HB      PHE   5  -0.949   2.537  -3.550
   36    HB3  PHE   5           3HB      PHE   5  -0.931   3.424  -5.071
   37    HD1  PHE   5           HD2      PHE   5  -3.681   2.389  -2.772
   38    HD2  PHE   5           HD1      PHE   5  -1.638   5.576  -4.717
   39    HE1  PHE   5           HE2      PHE   5  -5.308   3.989  -1.853
   40    HE2  PHE   5           HE1      PHE   5  -3.262   7.181  -3.800
   41    HZ   PHE   5           HZ       PHE   5  -5.101   6.388  -2.367
   42    H    HIS   6           H        HIS   6  -1.216   2.122  -7.364
   43    HA   HIS   6           HA       HIS   6  -3.150   3.748  -8.540
   44    HB2  HIS   6           2HB      HIS   6  -0.866   2.130  -9.507
   45    HB3  HIS   6           3HB      HIS   6  -2.080   2.549 -10.713
   46    HD1  HIS   6           HD1      HIS   6   1.013   3.702  -9.811
   47    HD2  HIS   6           HD2      HIS   6  -2.664   5.615 -10.103
   48    HE1  HIS   6           HE1      HIS   6   1.545   6.145 -10.086
   49    HA   PRO   7           HA       PRO   7  -4.982  -0.216 -10.619
   50    HB2  PRO   7           2HB      PRO   7  -4.184  -2.613  -9.625
   51    HB3  PRO   7           3HB      PRO   7  -3.346  -1.795 -10.949
   52    HG2  PRO   7           2HG      PRO   7  -2.658  -1.880  -8.037
   53    HG3  PRO   7           3HG      PRO   7  -1.590  -2.035  -9.444
   54    HD2  PRO   7           2HD      PRO   7  -1.831   0.271  -8.044
   55    HD3  PRO   7           3HD      PRO   7  -1.508   0.243  -9.789
   56    H    LEU   8           H        LEU   8  -4.335  -0.103  -7.193
   57    HA   LEU   8           HA       LEU   8  -6.696  -1.592  -6.464
   58    HB2  LEU   8           2HB      LEU   8  -4.683  -1.654  -5.076
   59    HB3  LEU   8           3HB      LEU   8  -4.826   0.079  -4.789
   60    HG   LEU   8           HG       LEU   8  -5.592  -1.567  -2.955
   61   HD11  LEU   8          1HD1      LEU   8  -6.658   0.185  -2.070
   62   HD12  LEU   8          2HD1      LEU   8  -7.821   0.266  -3.392
   63   HD13  LEU   8          3HD1      LEU   8  -6.237   1.021  -3.565
   64   HD21  LEU   8          3HD2      LEU   8  -7.546  -2.702  -3.173
   65   HD22  LEU   8          1HD2      LEU   8  -7.057  -2.706  -4.867
   66   HD23  LEU   8          2HD2      LEU   8  -8.236  -1.526  -4.293
   67    H    ALA   9           H        ALA   9  -5.854   1.703  -7.067
   68    HA   ALA   9           HA       ALA   9  -7.822   3.031  -5.583
   69    HB1  ALA   9           1HB      ALA   9  -6.032   4.275  -6.561
   70    HB2  ALA   9           2HB      ALA   9  -6.501   3.775  -8.186
   71    HB3  ALA   9           3HB      ALA   9  -7.542   4.857  -7.262
   72    H    ALA  10           H        ALA  10  -7.922   1.625  -8.829
   73    HA   ALA  10           HA       ALA  10 -10.476   2.558  -9.551
   74    HB1  ALA  10           1HB      ALA  10 -10.435   0.626 -11.169
   75    HB2  ALA  10           2HB      ALA  10  -9.064   1.732 -11.265
   76    HB3  ALA  10           3HB      ALA  10  -8.884   0.172 -10.461
   77    H    SER  11           H        SER  11  -9.430  -0.440  -7.972
   78    HA   SER  11           HA       SER  11 -11.958  -1.671  -7.874
   79    HB2  SER  11           2HB      SER  11  -9.535  -2.006  -6.092
   80    HB3  SER  11           3HB      SER  11 -10.951  -3.056  -6.042
   81    HG   SER  11           HG       SER  11  -8.879  -3.322  -7.589
   82    H    PHE  12           H        PHE  12 -10.246   0.359  -5.521
   83    HA   PHE  12           HA       PHE  12 -12.313   0.250  -3.566
   84    HB2  PHE  12           2HB      PHE  12  -9.807   1.823  -3.943
   85    HB3  PHE  12           3HB      PHE  12 -11.004   2.436  -2.806
   86    HD1  PHE  12           HD2      PHE  12 -10.329  -1.129  -3.472
   87    HD2  PHE  12           HD1      PHE  12  -9.789   2.143  -0.805
   88    HE1  PHE  12           HE2      PHE  12  -9.482  -2.673  -1.755
   89    HE2  PHE  12           HE1      PHE  12  -8.940   0.604   0.917
   90    HZ   PHE  12           HZ       PHE  12  -8.787  -1.808   0.443
   91    H    ILE  13           H        ILE  13 -11.700   2.222  -6.353
   92    HA   ILE  13           HA       ILE  13 -13.464   4.357  -5.615
   93    HB   ILE  13           HB       ILE  13 -12.020   3.600  -8.122
   94   HG12  ILE  13          2HG1      ILE  13 -10.896   4.914  -6.348
   95   HG13  ILE  13          3HG1      ILE  13 -11.040   5.813  -7.855
   96   HG21  ILE  13          1HG2      ILE  13 -14.303   5.542  -7.906
   97   HG22  ILE  13          2HG2      ILE  13 -13.079   5.651  -9.170
   98   HG23  ILE  13          3HG2      ILE  13 -14.097   4.216  -9.050
   99   HD11  ILE  13          3HD1      ILE  13 -13.291   6.260  -6.085
  100   HD12  ILE  13          1HD1      ILE  13 -11.748   6.695  -5.349
  101   HD13  ILE  13          2HD1      ILE  13 -12.228   7.417  -6.886
  102    H    VAL  14           H        VAL  14 -13.711   1.466  -7.634
  103    HA   VAL  14           HA       VAL  14 -16.336   2.024  -8.588
  104    HB   VAL  14           HB       VAL  14 -14.876  -0.617  -8.430
  105   HG11  VAL  14          1HG1      VAL  14 -17.104  -1.206  -8.728
  106   HG12  VAL  14          2HG1      VAL  14 -17.450   0.213  -9.718
  107   HG13  VAL  14          3HG1      VAL  14 -16.494  -1.114 -10.380
  108   HG21  VAL  14          3HG2      VAL  14 -14.317   1.640  -9.977
  109   HG22  VAL  14          1HG2      VAL  14 -13.696   0.006 -10.209
  110   HG23  VAL  14          2HG2      VAL  14 -15.150   0.527 -11.061
  111    H    ARG  15           H        ARG  15 -15.087   0.731  -5.659
  112    HA   ARG  15           HA       ARG  15 -17.494  -0.675  -4.917
  113    HB2  ARG  15           2HB      ARG  15 -16.177  -1.626  -3.382
  114    HB3  ARG  15           3HB      ARG  15 -14.838  -0.719  -4.072
  115    HG2  ARG  15           2HG      ARG  15 -15.239   1.094  -2.491
  116    HG3  ARG  15           3HG      ARG  15 -16.597   0.198  -1.806
  117    HD2  ARG  15           2HD      ARG  15 -14.075  -1.298  -1.938
  118    HD3  ARG  15           3HD      ARG  15 -14.041   0.108  -0.875
  119    HE   ARG  15           HE       ARG  15 -15.505  -2.340  -0.475
  120   HH11  ARG  15          1HH1      ARG  15 -15.260   1.036   0.338
  121   HH12  ARG  15          2HH1      ARG  15 -16.107   0.870   1.840
  122   HH21  ARG  15          1HH2      ARG  15 -16.622  -2.572   1.501
  123   HH22  ARG  15          2HH2      ARG  15 -16.881  -1.183   2.501
  124    H    CYS  16           H        CYS  16 -15.968   2.419  -4.178
  125    HA   CYS  16           HA       CYS  16 -18.059   3.147  -2.311
  126    HB2  CYS  16           2HB      CYS  16 -15.740   4.756  -3.402
  127    HB3  CYS  16           3HB      CYS  16 -16.820   5.275  -2.113
  128    HG   CYS  16           HG       CYS  16 -14.036   3.711  -1.812
  129    H    ALA  17           H        ALA  17 -17.117   3.850  -5.618
  130    HA   ALA  17           HA       ALA  17 -18.812   6.045  -6.076
  131    HB1  ALA  17           1HB      ALA  17 -16.958   5.389  -7.563
  132    HB2  ALA  17           2HB      ALA  17 -17.893   3.985  -8.078
  133    HB3  ALA  17           3HB      ALA  17 -18.478   5.611  -8.430
  134    H    PHE  18           H        PHE  18 -19.348   2.567  -6.310
  135    HA   PHE  18           HA       PHE  18 -21.948   2.792  -7.472
  136    HB2  PHE  18           2HB      PHE  18 -20.313   0.772  -7.491
  137    HB3  PHE  18           3HB      PHE  18 -21.014   0.395  -5.921
  138    HD1  PHE  18           HD1      PHE  18 -23.615   0.283  -5.842
  139    HD2  PHE  18           HD2      PHE  18 -21.303  -0.053  -9.400
  140    HE1  PHE  18           HE1      PHE  18 -25.494  -0.853  -6.952
  141    HE2  PHE  18           HE2      PHE  18 -23.178  -1.189 -10.516
  142    HZ   PHE  18           HZ       PHE  18 -25.277  -1.590  -9.292
  143    H    GLU  19           H        GLU  19 -20.698   2.434  -4.197
  144    HA   GLU  19           HA       GLU  19 -23.306   2.153  -3.019
  145    HB2  GLU  19           2HB      GLU  19 -21.592   1.096  -1.808
  146    HB3  GLU  19           3HB      GLU  19 -20.529   2.491  -1.922
  147    HG2  GLU  19           2HG      GLU  19 -21.460   3.523  -0.147
  148    HG3  GLU  19           3HG      GLU  19 -23.075   2.909  -0.496
  149    H    HIS  20           H        HIS  20 -21.158   4.761  -3.804
  150    HA   HIS  20           HA       HIS  20 -22.292   6.709  -2.066
  151    HB2  HIS  20           2HB      HIS  20 -20.030   6.915  -3.068
  152    HB3  HIS  20           3HB      HIS  20 -20.774   7.134  -4.649
  153    HD1  HIS  20           HD1      HIS  20 -22.499   9.303  -4.707
  154    HD2  HIS  20           HD2      HIS  20 -19.542   9.245  -1.790
  155    HE1  HIS  20           HE1      HIS  20 -22.270  11.685  -3.935
  156    H    SER  21           H        SER  21 -22.956   5.661  -5.355
  157    HA   SER  21           HA       SER  21 -24.892   7.761  -5.804
  158    HB2  SER  21           2HB      SER  21 -24.324   5.305  -7.479
  159    HB3  SER  21           3HB      SER  21 -25.220   6.738  -7.984
  160    HG   SER  21           HG       SER  21 -22.600   7.036  -7.036
  161    H    ARG  22           H        ARG  22 -24.875   4.362  -4.938
  162    HA   ARG  22           HA       ARG  22 -27.552   3.732  -5.358
  163    HB2  ARG  22           2HB      ARG  22 -25.499   2.289  -4.545
  164    HB3  ARG  22           3HB      ARG  22 -26.139   2.666  -2.950
  165    HG2  ARG  22           2HG      ARG  22 -28.324   1.731  -3.666
  166    HG3  ARG  22           3HG      ARG  22 -27.567   1.241  -5.183
  167    HD2  ARG  22           2HD      ARG  22 -26.025  -0.190  -3.999
  168    HD3  ARG  22           3HD      ARG  22 -26.638   0.379  -2.447
  169    HE   ARG  22           HE       ARG  22 -27.788  -1.635  -4.115
  170   HH11  ARG  22          1HH1      ARG  22 -28.515   0.837  -1.774
  171   HH12  ARG  22          2HH1      ARG  22 -29.977   0.080  -1.236
  172   HH21  ARG  22          1HH2      ARG  22 -29.712  -2.641  -3.415
  173   HH22  ARG  22          2HH2      ARG  22 -30.657  -1.899  -2.169
  174    H    ARG  23           H        ARG  23 -25.987   5.245  -2.568
  175    HA   ARG  23           HA       ARG  23 -28.164   5.273  -0.826
  176    HB2  ARG  23           2HB      ARG  23 -26.176   5.877   0.191
  177    HB3  ARG  23           3HB      ARG  23 -25.706   6.944  -1.125
  178    HG2  ARG  23           2HG      ARG  23 -26.901   8.709  -0.311
  179    HG3  ARG  23           3HG      ARG  23 -28.085   7.677   0.494
  180    HD2  ARG  23           2HD      ARG  23 -26.482   7.117   2.215
  181    HD3  ARG  23           3HD      ARG  23 -25.224   8.026   1.378
  182    HE   ARG  23           HE       ARG  23 -27.219   9.075   3.118
  183   HH11  ARG  23          1HH1      ARG  23 -25.317   9.801   0.293
  184   HH12  ARG  23          2HH1      ARG  23 -25.373  11.515   0.536
  185   HH21  ARG  23          1HH2      ARG  23 -27.300  11.330   3.448
  186   HH22  ARG  23          2HH2      ARG  23 -26.501  12.384   2.331
  187    H    PHE  24           H        PHE  24 -27.448   7.244  -3.598
  188    HA   PHE  24           HA       PHE  24 -29.409   9.263  -2.954
  189    HB2  PHE  24           2HB      PHE  24 -27.287   9.671  -4.287
  190    HB3  PHE  24           3HB      PHE  24 -28.062   8.819  -5.619
  191    HD1  PHE  24           HD2      PHE  24 -30.344   9.724  -6.401
  192    HD2  PHE  24           HD1      PHE  24 -27.598  11.947  -4.028
  193    HE1  PHE  24           HE2      PHE  24 -31.432  11.815  -7.108
  194    HE2  PHE  24           HE1      PHE  24 -28.682  14.042  -4.730
  195    HZ   PHE  24           HZ       PHE  24 -30.600  13.977  -6.273
  196    H    THR  25           H        THR  25 -29.155   6.480  -5.108
  197    HA   THR  25           HA       THR  25 -31.812   6.928  -6.185
  198    HB   THR  25           HB       THR  25 -29.837   5.984  -7.517
  199    HG1  THR  25           HG1      THR  25 -32.210   4.413  -7.564
  200   HG21  THR  25          3HG2      THR  25 -29.468   4.238  -5.596
  201   HG22  THR  25          1HG2      THR  25 -29.188   3.783  -7.276
  202   HG23  THR  25          2HG2      THR  25 -30.689   3.317  -6.474
  Start of MODEL   14
    1    H1   GLN   1           H        GLN   1   1.985  -0.021   0.630
    2    HA   GLN   1           HA       GLN   1   3.277   0.425  -1.304
    3    HB2  GLN   1           2HB      GLN   1   1.202  -1.685  -1.672
    4    HB3  GLN   1           3HB      GLN   1   2.206  -1.258  -3.051
    5    HG2  GLN   1           2HG      GLN   1   3.363  -2.004  -0.385
    6    HG3  GLN   1           3HG      GLN   1   2.981  -3.197  -1.625
    7   HE21  GLN   1          1HE2      GLN   1   5.480  -1.779  -0.338
    8   HE22  GLN   1          2HE2      GLN   1   6.507  -1.553  -1.709
    9    H    ARG   2           H        ARG   2   3.481   1.805  -2.949
   10    HA   ARG   2           HA       ARG   2   1.211   3.342  -3.798
   11    HB2  ARG   2           2HB      ARG   2   3.959   3.445  -5.025
   12    HB3  ARG   2           3HB      ARG   2   2.756   4.725  -4.937
   13    HG2  ARG   2           2HG      ARG   2   3.312   5.294  -2.816
   14    HG3  ARG   2           3HG      ARG   2   3.756   3.645  -2.371
   15    HD2  ARG   2           2HD      ARG   2   5.769   3.930  -3.884
   16    HD3  ARG   2           3HD      ARG   2   5.363   5.644  -3.943
   17    HE   ARG   2           HE       ARG   2   6.592   4.237  -1.774
   18   HH11  ARG   2          1HH1      ARG   2   4.590   6.957  -2.617
   19   HH12  ARG   2          2HH1      ARG   2   5.013   7.872  -1.207
   20   HH21  ARG   2          1HH2      ARG   2   7.157   5.431   0.086
   21   HH22  ARG   2          2HH2      ARG   2   6.474   7.003   0.329
   22    H    SER   3           H        SER   3   3.352   0.949  -5.283
   23    HA   SER   3           HA       SER   3   2.388   1.106  -7.901
   24    HB2  SER   3           2HB      SER   3   4.434  -0.156  -7.086
   25    HB3  SER   3           3HB      SER   3   3.337  -1.435  -6.568
   26    HG   SER   3           HG       SER   3   4.187  -1.776  -8.683
   27    H    ASN   4           H        ASN   4   1.241  -0.755  -5.128
   28    HA   ASN   4           HA       ASN   4  -0.817  -2.073  -6.658
   29    HB2  ASN   4           2HB      ASN   4  -0.328  -1.957  -3.674
   30    HB3  ASN   4           3HB      ASN   4  -1.526  -2.980  -4.460
   31   HD21  ASN   4          1HD2      ASN   4  -0.812  -4.690  -5.790
   32   HD22  ASN   4          2HD2      ASN   4   0.770  -5.360  -5.605
   33    H    PHE   5           H        PHE   5  -0.471   0.891  -4.994
   34    HA   PHE   5           HA       PHE   5  -3.146   1.333  -4.205
   35    HB2  PHE   5           2HB      PHE   5  -1.158   2.642  -3.414
   36    HB3  PHE   5           3HB      PHE   5  -1.111   3.426  -4.989
   37    HD1  PHE   5           HD2      PHE   5  -3.677   2.670  -2.382
   38    HD2  PHE   5           HD1      PHE   5  -2.009   5.525  -5.062
   39    HE1  PHE   5           HE2      PHE   5  -5.288   4.351  -1.588
   40    HE2  PHE   5           HE1      PHE   5  -3.617   7.211  -4.271
   41    HZ   PHE   5           HZ       PHE   5  -5.260   6.625  -2.533
   42    H    HIS   6           H        HIS   6  -1.392   1.979  -7.194
   43    HA   HIS   6           HA       HIS   6  -3.287   3.553  -8.498
   44    HB2  HIS   6           2HB      HIS   6  -1.020   1.840  -9.330
   45    HB3  HIS   6           3HB      HIS   6  -2.214   2.197 -10.574
   46    HD1  HIS   6           HD1      HIS   6  -0.935   3.848 -11.960
   47    HD2  HIS   6           HD2      HIS   6  -0.926   4.814  -7.919
   48    HE1  HIS   6           HE1      HIS   6   0.103   6.135 -11.817
   49    HA   PRO   7           HA       PRO   7  -5.161  -0.511 -10.330
   50    HB2  PRO   7           2HB      PRO   7  -4.412  -2.849  -9.171
   51    HB3  PRO   7           3HB      PRO   7  -3.547  -2.133 -10.537
   52    HG2  PRO   7           2HG      PRO   7  -2.891  -2.036  -7.618
   53    HG3  PRO   7           3HG      PRO   7  -1.811  -2.300  -8.999
   54    HD2  PRO   7           2HD      PRO   7  -2.029   0.097  -7.758
   55    HD3  PRO   7           3HD      PRO   7  -1.689  -0.052  -9.494
   56    H    LEU   8           H        LEU   8  -4.548  -0.181  -6.912
   57    HA   LEU   8           HA       LEU   8  -6.940  -1.583  -6.114
   58    HB2  LEU   8           2HB      LEU   8  -4.944  -1.584  -4.702
   59    HB3  LEU   8           3HB      LEU   8  -5.061   0.166  -4.532
   60    HG   LEU   8           HG       LEU   8  -5.873  -1.341  -2.602
   61   HD11  LEU   8          1HD1      LEU   8  -6.918   0.483  -1.847
   62   HD12  LEU   8          2HD1      LEU   8  -8.066   0.494  -3.185
   63   HD13  LEU   8          3HD1      LEU   8  -6.468   1.210  -3.390
   64   HD21  LEU   8          3HD2      LEU   8  -8.502  -1.347  -3.967
   65   HD22  LEU   8          1HD2      LEU   8  -7.842  -2.457  -2.766
   66   HD23  LEU   8          2HD2      LEU   8  -7.337  -2.581  -4.451
   67    H    ALA   9           H        ALA   9  -6.039   1.652  -6.924
   68    HA   ALA   9           HA       ALA   9  -8.001   3.105  -5.554
   69    HB1  ALA   9           1HB      ALA   9  -6.181   4.254  -6.591
   70    HB2  ALA   9           2HB      ALA   9  -6.641   3.655  -8.185
   71    HB3  ALA   9           3HB      ALA   9  -7.674   4.812  -7.346
   72    H    ALA  10           H        ALA  10  -8.090   1.489  -8.701
   73    HA   ALA  10           HA       ALA  10 -10.620   2.411  -9.512
   74    HB1  ALA  10           1HB      ALA  10  -9.204   1.453 -11.151
   75    HB2  ALA  10           2HB      ALA  10  -9.057  -0.053 -10.244
   76    HB3  ALA  10           3HB      ALA  10 -10.593   0.376 -10.998
   77    H    SER  11           H        SER  11  -9.639  -0.492  -7.727
   78    HA   SER  11           HA       SER  11 -12.188  -1.675  -7.576
   79    HB2  SER  11           2HB      SER  11  -9.790  -1.927  -5.747
   80    HB3  SER  11           3HB      SER  11 -11.223  -2.951  -5.647
   81    HG   SER  11           HG       SER  11  -9.225  -3.551  -7.023
   82    H    PHE  12           H        PHE  12 -10.468   0.481  -5.343
   83    HA   PHE  12           HA       PHE  12 -12.557   0.533  -3.409
   84    HB2  PHE  12           2HB      PHE  12 -10.022   2.039  -3.860
   85    HB3  PHE  12           3HB      PHE  12 -11.221   2.744  -2.780
   86    HD1  PHE  12           HD2      PHE  12 -10.594  -0.867  -3.203
   87    HD2  PHE  12           HD1      PHE  12 -10.035   2.565  -0.749
   88    HE1  PHE  12           HE2      PHE  12  -9.789  -2.307  -1.378
   89    HE2  PHE  12           HE1      PHE  12  -9.228   1.131   1.080
   90    HZ   PHE  12           HZ       PHE  12  -9.106  -1.309   0.768
   91    H    ILE  13           H        ILE  13 -11.884   2.306  -6.313
   92    HA   ILE  13           HA       ILE  13 -13.620   4.512  -5.737
   93    HB   ILE  13           HB       ILE  13 -12.162   3.569  -8.172
   94   HG12  ILE  13          2HG1      ILE  13 -11.036   4.980  -6.477
   95   HG13  ILE  13          3HG1      ILE  13 -11.150   5.779  -8.041
   96   HG21  ILE  13          1HG2      ILE  13 -14.416   5.555  -8.112
   97   HG22  ILE  13          2HG2      ILE  13 -13.177   5.562  -9.366
   98   HG23  ILE  13          3HG2      ILE  13 -14.219   4.153  -9.163
   99   HD11  ILE  13          3HD1      ILE  13 -12.325   7.461  -7.198
  100   HD12  ILE  13          1HD1      ILE  13 -13.411   6.377  -6.328
  101   HD13  ILE  13          2HD1      ILE  13 -11.867   6.841  -5.612
  102    H    VAL  14           H        VAL  14 -13.893   1.498  -7.565
  103    HA   VAL  14           HA       VAL  14 -16.498   2.032  -8.583
  104    HB   VAL  14           HB       VAL  14 -15.083  -0.615  -8.234
  105   HG11  VAL  14          1HG1      VAL  14 -17.688   0.155  -9.427
  106   HG12  VAL  14          2HG1      VAL  14 -16.729  -1.065 -10.267
  107   HG13  VAL  14          3HG1      VAL  14 -17.217  -1.324  -8.592
  108   HG21  VAL  14          3HG2      VAL  14 -14.532   1.544  -9.959
  109   HG22  VAL  14          1HG2      VAL  14 -13.841  -0.078  -9.995
  110   HG23  VAL  14          2HG2      VAL  14 -15.283   0.287 -10.942
  111    H    ARG  15           H        ARG  15 -15.301   0.917  -5.561
  112    HA   ARG  15           HA       ARG  15 -17.738  -0.399  -4.755
  113    HB2  ARG  15           2HB      ARG  15 -16.453  -1.267  -3.146
  114    HB3  ARG  15           3HB      ARG  15 -15.092  -0.428  -3.879
  115    HG2  ARG  15           2HG      ARG  15 -15.481   1.491  -2.426
  116    HG3  ARG  15           3HG      ARG  15 -16.860   0.663  -1.699
  117    HD2  ARG  15           2HD      ARG  15 -14.310  -0.822  -1.713
  118    HD3  ARG  15           3HD      ARG  15 -14.369   0.605  -0.679
  119    HE   ARG  15           HE       ARG  15 -15.721  -1.888  -0.264
  120   HH11  ARG  15          1HH1      ARG  15 -15.811   1.534   0.370
  121   HH12  ARG  15          2HH1      ARG  15 -16.767   1.375   1.807
  122   HH21  ARG  15          1HH2      ARG  15 -16.980  -2.110   1.626
  123   HH22  ARG  15          2HH2      ARG  15 -17.430  -0.698   2.520
  124    H    CYS  16           H        CYS  16 -16.170   2.713  -4.205
  125    HA   CYS  16           HA       CYS  16 -18.269   3.595  -2.415
  126    HB2  CYS  16           2HB      CYS  16 -15.913   5.093  -3.583
  127    HB3  CYS  16           3HB      CYS  16 -16.998   5.712  -2.343
  128    HG   CYS  16           HG       CYS  16 -14.503   3.455  -2.073
  129    H    ALA  17           H        ALA  17 -17.281   4.063  -5.749
  130    HA   ALA  17           HA       ALA  17 -18.935   6.248  -6.372
  131    HB1  ALA  17           1HB      ALA  17 -18.584   5.654  -8.688
  132    HB2  ALA  17           2HB      ALA  17 -17.077   5.466  -7.792
  133    HB3  ALA  17           3HB      ALA  17 -18.030   4.046  -8.222
  134    H    PHE  18           H        PHE  18 -19.525   2.771  -6.382
  135    HA   PHE  18           HA       PHE  18 -22.111   2.963  -7.583
  136    HB2  PHE  18           2HB      PHE  18 -20.506   0.921  -7.459
  137    HB3  PHE  18           3HB      PHE  18 -21.232   0.653  -5.877
  138    HD1  PHE  18           HD1      PHE  18 -21.953   0.897  -9.490
  139    HD2  PHE  18           HD2      PHE  18 -23.368  -0.313  -5.663
  140    HE1  PHE  18           HE1      PHE  18 -23.835  -0.274 -10.560
  141    HE2  PHE  18           HE2      PHE  18 -25.251  -1.486  -6.726
  142    HZ   PHE  18           HZ       PHE  18 -25.486  -1.469  -9.177
  143    H    GLU  19           H        GLU  19 -20.894   2.786  -4.280
  144    HA   GLU  19           HA       GLU  19 -23.512   2.615  -3.108
  145    HB2  GLU  19           2HB      GLU  19 -21.821   1.622  -1.816
  146    HB3  GLU  19           3HB      GLU  19 -20.739   2.993  -2.014
  147    HG2  GLU  19           2HG      GLU  19 -21.666   4.152  -0.318
  148    HG3  GLU  19           3HG      GLU  19 -23.288   3.538  -0.638
  149    H    HIS  20           H        HIS  20 -21.325   5.146  -4.035
  150    HA   HIS  20           HA       HIS  20 -22.449   7.213  -2.438
  151    HB2  HIS  20           2HB      HIS  20 -20.183   7.332  -3.444
  152    HB3  HIS  20           3HB      HIS  20 -20.920   7.453  -5.038
  153    HD1  HIS  20           HD1      HIS  20 -19.779   9.473  -2.248
  154    HD2  HIS  20           HD2      HIS  20 -22.530   9.894  -5.333
  155    HE1  HIS  20           HE1      HIS  20 -20.251  11.939  -2.397
  156    H    SER  21           H        SER  21 -23.113   5.963  -5.656
  157    HA   SER  21           HA       SER  21 -25.035   8.047  -6.236
  158    HB2  SER  21           2HB      SER  21 -24.463   5.499  -7.768
  159    HB3  SER  21           3HB      SER  21 -25.356   6.900  -8.357
  160    HG   SER  21           HG       SER  21 -22.775   7.333  -7.403
  161    H    ARG  22           H        ARG  22 -25.030   4.718  -5.145
  162    HA   ARG  22           HA       ARG  22 -27.687   4.032  -5.561
  163    HB2  ARG  22           2HB      ARG  22 -25.631   2.704  -4.552
  164    HB3  ARG  22           3HB      ARG  22 -26.355   3.193  -3.026
  165    HG2  ARG  22           2HG      ARG  22 -28.479   2.151  -3.746
  166    HG3  ARG  22           3HG      ARG  22 -27.663   1.578  -5.202
  167    HD2  ARG  22           2HD      ARG  22 -27.717  -0.192  -3.566
  168    HD3  ARG  22           3HD      ARG  22 -26.056   0.358  -3.779
  169    HE   ARG  22           HE       ARG  22 -27.440   1.635  -1.604
  170   HH11  ARG  22          1HH1      ARG  22 -25.525  -1.105  -2.576
  171   HH12  ARG  22          2HH1      ARG  22 -24.944  -1.432  -0.977
  172   HH21  ARG  22          1HH2      ARG  22 -26.681   1.216   0.506
  173   HH22  ARG  22          2HH2      ARG  22 -25.603  -0.111   0.775
  174    H    ARG  23           H        ARG  23 -26.212   5.786  -2.862
  175    HA   ARG  23           HA       ARG  23 -28.443   5.950  -1.198
  176    HB2  ARG  23           2HB      ARG  23 -26.437   8.177  -1.490
  177    HB3  ARG  23           3HB      ARG  23 -27.310   7.676  -0.048
  178    HG2  ARG  23           2HG      ARG  23 -25.878   5.423  -0.804
  179    HG3  ARG  23           3HG      ARG  23 -24.771   6.770  -1.078
  180    HD2  ARG  23           2HD      ARG  23 -24.317   6.483   1.113
  181    HD3  ARG  23           3HD      ARG  23 -25.766   7.465   1.322
  182    HE   ARG  23           HE       ARG  23 -26.565   4.802   1.167
  183   HH11  ARG  23          1HH1      ARG  23 -24.703   6.860   3.267
  184   HH12  ARG  23          2HH1      ARG  23 -25.071   5.954   4.697
  185   HH21  ARG  23          1HH2      ARG  23 -27.058   3.601   3.042
  186   HH22  ARG  23          2HH2      ARG  23 -26.410   4.100   4.568
  187    H    PHE  24           H        PHE  24 -27.633   7.703  -4.094
  188    HA   PHE  24           HA       PHE  24 -29.636   9.743  -3.684
  189    HB2  PHE  24           2HB      PHE  24 -27.465  10.074  -4.957
  190    HB3  PHE  24           3HB      PHE  24 -28.176   9.115  -6.251
  191    HD1  PHE  24           HD2      PHE  24 -30.038   9.976  -7.559
  192    HD2  PHE  24           HD1      PHE  24 -28.199  12.315  -4.516
  193    HE1  PHE  24           HE2      PHE  24 -31.113  11.995  -8.466
  194    HE2  PHE  24           HE1      PHE  24 -29.272  14.338  -5.417
  195    HZ   PHE  24           HZ       PHE  24 -30.730  14.180  -7.396
  196    H    THR  25           H        THR  25 -29.270   6.806  -5.604
  197    HA   THR  25           HA       THR  25 -31.881   7.140  -6.825
  198    HB   THR  25           HB       THR  25 -29.848   6.113  -7.994
  199    HG1  THR  25           HG1      THR  25 -31.290   4.485  -8.990
  200   HG21  THR  25          3HG2      THR  25 -30.618   3.453  -7.038
  201   HG22  THR  25          1HG2      THR  25 -29.806   4.443  -5.826
  202   HG23  THR  25          2HG2      THR  25 -29.019   4.118  -7.371
  Start of MODEL   15
    1    H1   GLN   1           H        GLN   1   4.368  -0.533  -1.137
    2    HA   GLN   1           HA       GLN   1   2.246  -1.011  -1.963
    3    HB2  GLN   1           2HB      GLN   1   2.232  -0.391   0.561
    4    HB3  GLN   1           3HB      GLN   1   1.402   1.067   0.032
    5    HG2  GLN   1           2HG      GLN   1  -0.462  -0.119   0.275
    6    HG3  GLN   1           3HG      GLN   1  -0.009  -0.889  -1.245
    7   HE21  GLN   1          1HE2      GLN   1  -0.070  -3.007  -1.205
    8   HE22  GLN   1          2HE2      GLN   1   0.191  -4.014   0.174
    9    H    ARG   2           H        ARG   2   3.583   1.718  -2.912
   10    HA   ARG   2           HA       ARG   2   1.299   3.282  -3.669
   11    HB2  ARG   2           2HB      ARG   2   4.051   3.494  -4.874
   12    HB3  ARG   2           3HB      ARG   2   2.834   4.753  -4.708
   13    HG2  ARG   2           2HG      ARG   2   3.375   5.189  -2.552
   14    HG3  ARG   2           3HG      ARG   2   3.835   3.519  -2.214
   15    HD2  ARG   2           2HD      ARG   2   5.891   4.527  -2.183
   16    HD3  ARG   2           3HD      ARG   2   5.791   4.064  -3.881
   17    HE   ARG   2           HE       ARG   2   4.736   6.589  -3.769
   18   HH11  ARG   2          1HH1      ARG   2   7.761   5.113  -2.882
   19   HH12  ARG   2          2HH1      ARG   2   8.693   6.545  -3.168
   20   HH21  ARG   2          1HH2      ARG   2   5.952   8.480  -4.150
   21   HH22  ARG   2          2HH2      ARG   2   7.663   8.460  -3.889
   22    H    SER   3           H        SER   3   3.472   1.014  -5.297
   23    HA   SER   3           HA       SER   3   2.517   1.333  -7.904
   24    HB2  SER   3           2HB      SER   3   3.606  -1.181  -6.612
   25    HB3  SER   3           3HB      SER   3   3.481  -0.884  -8.346
   26    HG   SER   3           HG       SER   3   4.787   1.140  -7.596
   27    H    ASN   4           H        ASN   4   1.381  -0.719  -5.265
   28    HA   ASN   4           HA       ASN   4  -0.657  -1.958  -6.886
   29    HB2  ASN   4           2HB      ASN   4  -0.179  -2.031  -3.898
   30    HB3  ASN   4           3HB      ASN   4  -1.363  -3.014  -4.755
   31   HD21  ASN   4          1HD2      ASN   4   0.367  -4.355  -3.302
   32   HD22  ASN   4          2HD2      ASN   4   1.572  -5.122  -4.274
   33    H    PHE   5           H        PHE   5  -0.350   0.895  -5.031
   34    HA   PHE   5           HA       PHE   5  -3.033   1.255  -4.226
   35    HB2  PHE   5           2HB      PHE   5  -1.064   2.531  -3.342
   36    HB3  PHE   5           3HB      PHE   5  -1.018   3.417  -4.863
   37    HD1  PHE   5           HD2      PHE   5  -3.277   2.612  -2.021
   38    HD2  PHE   5           HD1      PHE   5  -2.250   5.359  -5.106
   39    HE1  PHE   5           HE2      PHE   5  -4.910   4.221  -1.127
   40    HE2  PHE   5           HE1      PHE   5  -3.881   6.973  -4.217
   41    HZ   PHE   5           HZ       PHE   5  -5.214   6.404  -2.226
   42    H    HIS   6           H        HIS   6  -1.276   2.114  -7.159
   43    HA   HIS   6           HA       HIS   6  -3.185   3.749  -8.365
   44    HB2  HIS   6           2HB      HIS   6  -0.895   2.119  -9.297
   45    HB3  HIS   6           3HB      HIS   6  -2.089   2.543 -10.521
   46    HD1  HIS   6           HD1      HIS   6   0.934   3.649 -10.177
   47    HD2  HIS   6           HD2      HIS   6  -2.606   5.645  -9.317
   48    HE1  HIS   6           HE1      HIS   6   1.498   6.097 -10.292
   49    HA   PRO   7           HA       PRO   7  -5.005  -0.208 -10.467
   50    HB2  PRO   7           2HB      PRO   7  -4.234  -2.608  -9.460
   51    HB3  PRO   7           3HB      PRO   7  -3.372  -1.795 -10.772
   52    HG2  PRO   7           2HG      PRO   7  -2.727  -1.881  -7.850
   53    HG3  PRO   7           3HG      PRO   7  -1.639  -2.042  -9.241
   54    HD2  PRO   7           2HD      PRO   7  -1.890   0.265  -7.847
   55    HD3  PRO   7           3HD      PRO   7  -1.541   0.235  -9.587
   56    H    LEU   8           H        LEU   8  -4.408  -0.095  -7.032
   57    HA   LEU   8           HA       LEU   8  -6.787  -1.573  -6.337
   58    HB2  LEU   8           2HB      LEU   8  -4.795  -1.644  -4.920
   59    HB3  LEU   8           3HB      LEU   8  -4.933   0.090  -4.637
   60    HG   LEU   8           HG       LEU   8  -5.735  -1.550  -2.812
   61   HD11  LEU   8          1HD1      LEU   8  -7.946   0.296  -3.283
   62   HD12  LEU   8          2HD1      LEU   8  -6.355   1.041  -3.432
   63   HD13  LEU   8          3HD1      LEU   8  -6.803   0.209  -1.943
   64   HD21  LEU   8          3HD2      LEU   8  -8.358  -1.496  -4.187
   65   HD22  LEU   8          1HD2      LEU   8  -7.690  -2.675  -3.057
   66   HD23  LEU   8          2HD2      LEU   8  -7.177  -2.683  -4.745
   67    H    ALA   9           H        ALA   9  -5.920   1.718  -6.931
   68    HA   ALA   9           HA       ALA   9  -7.903   3.056  -5.476
   69    HB1  ALA   9           1HB      ALA   9  -6.093   4.291  -6.429
   70    HB2  ALA   9           2HB      ALA   9  -6.541   3.792  -8.060
   71    HB3  ALA   9           3HB      ALA   9  -7.590   4.879  -7.152
   72    H    ALA  10           H        ALA  10  -7.963   1.648  -8.722
   73    HA   ALA  10           HA       ALA  10 -10.501   2.593  -9.482
   74    HB1  ALA  10           1HB      ALA  10 -10.446   0.658 -11.097
   75    HB2  ALA  10           2HB      ALA  10  -9.069   1.759 -11.175
   76    HB3  ALA  10           3HB      ALA  10  -8.907   0.199 -10.367
   77    H    SER  11           H        SER  11  -9.493  -0.409  -7.886
   78    HA   SER  11           HA       SER  11 -12.028  -1.628  -7.823
   79    HB2  SER  11           2HB      SER  11  -9.633  -1.973  -6.006
   80    HB3  SER  11           3HB      SER  11 -11.055  -3.016  -5.977
   81    HG   SER  11           HG       SER  11  -9.518  -2.565  -8.313
   82    H    PHE  12           H        PHE  12 -10.340   0.396  -5.448
   83    HA   PHE  12           HA       PHE  12 -12.436   0.299  -3.523
   84    HB2  PHE  12           2HB      PHE  12  -9.918   1.859  -3.865
   85    HB3  PHE  12           3HB      PHE  12 -11.127   2.479  -2.746
   86    HD1  PHE  12           HD2      PHE  12 -10.458  -1.090  -3.400
   87    HD2  PHE  12           HD1      PHE  12  -9.945   2.182  -0.726
   88    HE1  PHE  12           HE2      PHE  12  -9.643  -2.637  -1.669
   89    HE2  PHE  12           HE1      PHE  12  -9.128   0.640   1.009
   90    HZ   PHE  12           HZ       PHE  12  -8.977  -1.773   0.539
   91    H    ILE  13           H        ILE  13 -11.774   2.265  -6.302
   92    HA   ILE  13           HA       ILE  13 -13.538   4.409  -5.591
   93    HB   ILE  13           HB       ILE  13 -12.061   3.643  -8.076
   94   HG12  ILE  13          2HG1      ILE  13 -10.957   4.953  -6.288
   95   HG13  ILE  13          3HG1      ILE  13 -11.075   5.852  -7.797
   96   HG21  ILE  13          1HG2      ILE  13 -14.338   5.596  -7.895
   97   HG22  ILE  13          2HG2      ILE  13 -13.096   5.698  -9.141
   98   HG23  ILE  13          3HG2      ILE  13 -14.121   4.268  -9.034
   99   HD11  ILE  13          3HD1      ILE  13 -11.813   6.740  -5.303
  100   HD12  ILE  13          1HD1      ILE  13 -12.268   7.463  -6.845
  101   HD13  ILE  13          2HD1      ILE  13 -13.348   6.311  -6.058
  102    H    VAL  14           H        VAL  14 -13.770   1.517  -7.611
  103    HA   VAL  14           HA       VAL  14 -16.378   2.087  -8.603
  104    HB   VAL  14           HB       VAL  14 -14.933  -0.561  -8.422
  105   HG11  VAL  14          1HG1      VAL  14 -16.574  -0.874 -10.497
  106   HG12  VAL  14          2HG1      VAL  14 -17.045  -1.285  -8.846
  107   HG13  VAL  14          3HG1      VAL  14 -17.549   0.251  -9.552
  108   HG21  VAL  14          3HG2      VAL  14 -15.156   0.565 -11.060
  109   HG22  VAL  14          1HG2      VAL  14 -14.356   1.698  -9.970
  110   HG23  VAL  14          2HG2      VAL  14 -13.714   0.067 -10.173
  111    H    ARG  15           H        ARG  15 -15.177   0.791  -5.656
  112    HA   ARG  15           HA       ARG  15 -17.601  -0.603  -4.947
  113    HB2  ARG  15           2HB      ARG  15 -16.311  -1.559  -3.392
  114    HB3  ARG  15           3HB      ARG  15 -14.958  -0.658  -4.064
  115    HG2  ARG  15           2HG      ARG  15 -15.374   1.157  -2.491
  116    HG3  ARG  15           3HG      ARG  15 -16.745   0.268  -1.824
  117    HD2  ARG  15           2HD      ARG  15 -13.997  -0.930  -1.909
  118    HD3  ARG  15           3HD      ARG  15 -14.489   0.139  -0.596
  119    HE   ARG  15           HE       ARG  15 -15.296  -2.580  -1.005
  120   HH11  ARG  15          1HH1      ARG  15 -16.218   0.479   0.378
  121   HH12  ARG  15          2HH1      ARG  15 -17.277  -0.225   1.555
  122   HH21  ARG  15          1HH2      ARG  15 -16.688  -3.518   0.540
  123   HH22  ARG  15          2HH2      ARG  15 -17.543  -2.498   1.646
  124    H    CYS  16           H        CYS  16 -16.071   2.484  -4.189
  125    HA   CYS  16           HA       CYS  16 -18.186   3.224  -2.353
  126    HB2  CYS  16           2HB      CYS  16 -15.844   4.821  -3.412
  127    HB3  CYS  16           3HB      CYS  16 -16.940   5.346  -2.139
  128    HG   CYS  16           HG       CYS  16 -14.484   3.012  -2.009
  129    H    ALA  17           H        ALA  17 -17.193   3.920  -5.646
  130    HA   ALA  17           HA       ALA  17 -18.870   6.122  -6.131
  131    HB1  ALA  17           1HB      ALA  17 -17.933   4.055  -8.117
  132    HB2  ALA  17           2HB      ALA  17 -18.504   5.684  -8.480
  133    HB3  ALA  17           3HB      ALA  17 -16.998   5.456  -7.591
  134    H    PHE  18           H        PHE  18 -19.419   2.647  -6.369
  135    HA   PHE  18           HA       PHE  18 -22.001   2.883  -7.570
  136    HB2  PHE  18           2HB      PHE  18 -20.375   0.855  -7.564
  137    HB3  PHE  18           3HB      PHE  18 -21.100   0.483  -6.003
  138    HD1  PHE  18           HD2      PHE  18 -23.701   0.377  -5.961
  139    HD2  PHE  18           HD1      PHE  18 -21.343   0.041  -9.488
  140    HE1  PHE  18           HE2      PHE  18 -25.569  -0.752  -7.098
  141    HE2  PHE  18           HE1      PHE  18 -23.207  -1.087 -10.631
  142    HZ   PHE  18           HZ       PHE  18 -25.323  -1.486  -9.435
  143    H    GLU  19           H        GLU  19 -20.800   2.522  -4.276
  144    HA   GLU  19           HA       GLU  19 -23.426   2.254  -3.136
  145    HB2  GLU  19           2HB      GLU  19 -21.735   1.190  -1.900
  146    HB3  GLU  19           3HB      GLU  19 -20.664   2.580  -1.999
  147    HG2  GLU  19           2HG      GLU  19 -21.616   3.617  -0.238
  148    HG3  GLU  19           3HG      GLU  19 -23.228   3.010  -0.611
  149    H    HIS  20           H        HIS  20 -21.255   4.851  -3.892
  150    HA   HIS  20           HA       HIS  20 -22.405   6.805  -2.172
  151    HB2  HIS  20           2HB      HIS  20 -20.129   7.000  -3.142
  152    HB3  HIS  20           3HB      HIS  20 -20.849   7.221  -4.734
  153    HD1  HIS  20           HD1      HIS  20 -22.053   9.488  -5.183
  154    HD2  HIS  20           HD2      HIS  20 -20.160   9.239  -1.493
  155    HE1  HIS  20           HE1      HIS  20 -21.954  11.847  -4.318
  156    H    SER  21           H        SER  21 -23.027   5.758  -5.470
  157    HA   SER  21           HA       SER  21 -24.947   7.867  -5.947
  158    HB2  SER  21           2HB      SER  21 -24.366   5.407  -7.613
  159    HB3  SER  21           3HB      SER  21 -25.248   6.843  -8.131
  160    HG   SER  21           HG       SER  21 -22.550   6.874  -7.258
  161    H    ARG  22           H        ARG  22 -24.957   4.468  -5.080
  162    HA   ARG  22           HA       ARG  22 -27.631   3.849  -5.537
  163    HB2  ARG  22           2HB      ARG  22 -25.596   2.398  -4.693
  164    HB3  ARG  22           3HB      ARG  22 -26.256   2.779  -3.108
  165    HG2  ARG  22           2HG      ARG  22 -28.436   1.855  -3.856
  166    HG3  ARG  22           3HG      ARG  22 -27.657   1.356  -5.359
  167    HD2  ARG  22           2HD      ARG  22 -26.479  -0.315  -4.355
  168    HD3  ARG  22           3HD      ARG  22 -26.368   0.540  -2.817
  169    HE   ARG  22           HE       ARG  22 -29.025  -0.351  -3.482
  170   HH11  ARG  22          1HH1      ARG  22 -26.002  -1.185  -1.970
  171   HH12  ARG  22          2HH1      ARG  22 -26.699  -2.397  -0.946
  172   HH21  ARG  22          1HH2      ARG  22 -29.954  -1.944  -2.139
  173   HH22  ARG  22          2HH2      ARG  22 -28.946  -2.828  -1.044
  174    H    ARG  23           H        ARG  23 -26.099   5.359  -2.727
  175    HA   ARG  23           HA       ARG  23 -28.301   5.397  -1.015
  176    HB2  ARG  23           2HB      ARG  23 -26.328   5.996   0.031
  177    HB3  ARG  23           3HB      ARG  23 -25.831   7.055  -1.282
  178    HG2  ARG  23           2HG      ARG  23 -27.028   8.830  -0.494
  179    HG3  ARG  23           3HG      ARG  23 -28.231   7.808   0.297
  180    HD2  ARG  23           2HD      ARG  23 -27.135   8.478   2.159
  181    HD3  ARG  23           3HD      ARG  23 -26.074   7.136   1.733
  182    HE   ARG  23           HE       ARG  23 -25.169   9.460   0.446
  183   HH11  ARG  23          1HH1      ARG  23 -25.425   8.090   3.636
  184   HH12  ARG  23          2HH1      ARG  23 -24.050   8.944   4.255
  185   HH21  ARG  23          1HH2      ARG  23 -23.357  10.590   1.249
  186   HH22  ARG  23          2HH2      ARG  23 -22.876  10.367   2.897
  187    H    PHE  24           H        PHE  24 -27.535   7.367  -3.776
  188    HA   PHE  24           HA       PHE  24 -29.504   9.387  -3.163
  189    HB2  PHE  24           2HB      PHE  24 -27.358   9.797  -4.455
  190    HB3  PHE  24           3HB      PHE  24 -28.108   8.948  -5.803
  191    HD1  PHE  24           HD1      PHE  24 -30.102   9.900  -6.905
  192    HD2  PHE  24           HD2      PHE  24 -27.943  12.030  -3.920
  193    HE1  PHE  24           HE1      PHE  24 -31.174  11.993  -7.629
  194    HE2  PHE  24           HE2      PHE  24 -29.012  14.127  -4.638
  195    HZ   PHE  24           HZ       PHE  24 -30.630  14.110  -6.494
  196    H    THR  25           H        THR  25 -29.213   6.610  -5.318
  197    HA   THR  25           HA       THR  25 -31.847   7.063  -6.448
  198    HB   THR  25           HB       THR  25 -29.853   6.113  -7.741
  199    HG1  THR  25           HG1      THR  25 -31.386   4.481  -8.739
  200   HG21  THR  25          3HG2      THR  25 -29.780   4.277  -5.713
  201   HG22  THR  25          1HG2      THR  25 -29.030   4.068  -7.295
  202   HG23  THR  25          2HG2      THR  25 -30.628   3.392  -6.981
  Start of MODEL   16
    1    H1   GLN   1           H        GLN   1   1.248  -0.659   0.589
    2    HA   GLN   1           HA       GLN   1   2.964   0.644  -0.770
    3    HB2  GLN   1           2HB      GLN   1   1.527  -1.801  -1.557
    4    HB3  GLN   1           3HB      GLN   1   2.382  -1.000  -2.868
    5    HG2  GLN   1           2HG      GLN   1   3.665  -1.733  -0.251
    6    HG3  GLN   1           3HG      GLN   1   3.673  -2.774  -1.674
    7   HE21  GLN   1          1HE2      GLN   1   5.292  -2.551  -3.047
    8   HE22  GLN   1          2HE2      GLN   1   6.375  -1.207  -3.125
    9    H    ARG   2           H        ARG   2   3.311   1.897  -2.587
   10    HA   ARG   2           HA       ARG   2   1.050   3.413  -3.495
   11    HB2  ARG   2           2HB      ARG   2   3.835   3.563  -4.631
   12    HB3  ARG   2           3HB      ARG   2   2.613   4.826  -4.570
   13    HG2  ARG   2           2HG      ARG   2   3.092   5.382  -2.426
   14    HG3  ARG   2           3HG      ARG   2   3.545   3.735  -1.984
   15    HD2  ARG   2           2HD      ARG   2   5.598   4.746  -1.951
   16    HD3  ARG   2           3HD      ARG   2   5.545   4.194  -3.625
   17    HE   ARG   2           HE       ARG   2   4.475   6.745  -3.599
   18   HH11  ARG   2          1HH1      ARG   2   7.513   5.226  -2.836
   19   HH12  ARG   2          2HH1      ARG   2   8.460   6.620  -3.239
   20   HH21  ARG   2          1HH2      ARG   2   5.710   8.587  -4.133
   21   HH22  ARG   2          2HH2      ARG   2   7.433   8.531  -3.976
   22    H    SER   3           H        SER   3   3.269   1.062  -4.931
   23    HA   SER   3           HA       SER   3   2.389   1.233  -7.577
   24    HB2  SER   3           2HB      SER   3   3.442  -1.202  -6.115
   25    HB3  SER   3           3HB      SER   3   3.364  -1.006  -7.866
   26    HG   SER   3           HG       SER   3   4.670   1.020  -7.307
   27    H    ASN   4           H        ASN   4   1.179  -0.671  -4.862
   28    HA   ASN   4           HA       ASN   4  -0.812  -2.001  -6.469
   29    HB2  ASN   4           2HB      ASN   4  -0.420  -1.907  -3.470
   30    HB3  ASN   4           3HB      ASN   4  -1.579  -2.938  -4.304
   31   HD21  ASN   4          1HD2      ASN   4  -0.920  -4.942  -4.459
   32   HD22  ASN   4          2HD2      ASN   4   0.710  -5.471  -4.681
   33    H    PHE   5           H        PHE   5  -0.559   0.951  -4.768
   34    HA   PHE   5           HA       PHE   5  -3.265   1.351  -4.063
   35    HB2  PHE   5           2HB      PHE   5  -1.324   2.678  -3.193
   36    HB3  PHE   5           3HB      PHE   5  -1.230   3.476  -4.759
   37    HD1  PHE   5           HD1      PHE   5  -4.078   2.586  -2.519
   38    HD2  PHE   5           HD2      PHE   5  -1.951   5.645  -4.577
   39    HE1  PHE   5           HE1      PHE   5  -5.738   4.240  -1.769
   40    HE2  PHE   5           HE2      PHE   5  -3.607   7.304  -3.829
   41    HZ   PHE   5           HZ       PHE   5  -5.503   6.603  -2.422
   42    H    HIS   6           H        HIS   6  -1.422   2.050  -6.986
   43    HA   HIS   6           HA       HIS   6  -3.294   3.612  -8.337
   44    HB2  HIS   6           2HB      HIS   6  -0.979   1.934  -9.110
   45    HB3  HIS   6           3HB      HIS   6  -2.137   2.290 -10.389
   46    HD1  HIS   6           HD1      HIS   6   0.912   3.498  -9.324
   47    HD2  HIS   6           HD2      HIS   6  -2.721   5.369 -10.073
   48    HE1  HIS   6           HE1      HIS   6   1.472   5.915  -9.735
   49    HA   PRO   7           HA       PRO   7  -5.055  -0.457 -10.267
   50    HB2  PRO   7           2HB      PRO   7  -4.315  -2.797  -9.106
   51    HB3  PRO   7           3HB      PRO   7  -3.415  -2.057 -10.436
   52    HG2  PRO   7           2HG      PRO   7  -2.855  -1.981  -7.496
   53    HG3  PRO   7           3HG      PRO   7  -1.728  -2.217  -8.844
   54    HD2  PRO   7           2HD      PRO   7  -2.017   0.164  -7.588
   55    HD3  PRO   7           3HD      PRO   7  -1.618   0.037  -9.313
   56    H    LEU   8           H        LEU   8  -4.557  -0.156  -6.827
   57    HA   LEU   8           HA       LEU   8  -6.959  -1.592  -6.123
   58    HB2  LEU   8           2HB      LEU   8  -5.142  -1.688  -4.584
   59    HB3  LEU   8           3HB      LEU   8  -5.014   0.069  -4.537
   60    HG   LEU   8           HG       LEU   8  -7.556  -1.166  -3.614
   61   HD11  LEU   8          1HD1      LEU   8  -4.999  -1.882  -2.531
   62   HD12  LEU   8          2HD1      LEU   8  -6.609  -2.418  -2.049
   63   HD13  LEU   8          3HD1      LEU   8  -5.921  -0.953  -1.349
   64   HD21  LEU   8          3HD2      LEU   8  -5.968   1.302  -3.162
   65   HD22  LEU   8          1HD2      LEU   8  -6.986   0.720  -1.844
   66   HD23  LEU   8          2HD2      LEU   8  -7.703   1.099  -3.410
   67    H    ALA   9           H        ALA   9  -6.076   1.651  -6.894
   68    HA   ALA   9           HA       ALA   9  -8.069   3.089  -5.559
   69    HB1  ALA   9           1HB      ALA   9  -6.257   4.259  -6.577
   70    HB2  ALA   9           2HB      ALA   9  -6.676   3.635  -8.173
   71    HB3  ALA   9           3HB      ALA   9  -7.743   4.785  -7.368
   72    H    ALA  10           H        ALA  10  -8.109   1.468  -8.705
   73    HA   ALA  10           HA       ALA  10 -10.641   2.358  -9.543
   74    HB1  ALA  10           1HB      ALA  10 -10.579   0.312 -11.017
   75    HB2  ALA  10           2HB      ALA  10  -9.205   1.409 -11.167
   76    HB3  ALA  10           3HB      ALA  10  -9.041  -0.089 -10.251
   77    H    SER  11           H        SER  11  -9.650  -0.530  -7.739
   78    HA   SER  11           HA       SER  11 -12.194  -1.730  -7.608
   79    HB2  SER  11           2HB      SER  11  -9.804  -1.973  -5.768
   80    HB3  SER  11           3HB      SER  11 -11.232  -3.004  -5.676
   81    HG   SER  11           HG       SER  11 -10.212  -4.168  -7.096
   82    H    PHE  12           H        PHE  12 -10.498   0.440  -5.372
   83    HA   PHE  12           HA       PHE  12 -12.590   0.475  -3.441
   84    HB2  PHE  12           2HB      PHE  12 -10.115   2.102  -3.907
   85    HB3  PHE  12           3HB      PHE  12 -11.306   2.641  -2.728
   86    HD1  PHE  12           HD1      PHE  12  -9.860  -0.681  -3.630
   87    HD2  PHE  12           HD2      PHE  12 -10.624   2.197  -0.589
   88    HE1  PHE  12           HE1      PHE  12  -8.879  -2.194  -1.957
   89    HE2  PHE  12           HE2      PHE  12  -9.644   0.689   1.089
   90    HZ   PHE  12           HZ       PHE  12  -8.769  -1.510   0.407
   91    H    ILE  13           H        ILE  13 -11.933   2.247  -6.348
   92    HA   ILE  13           HA       ILE  13 -13.695   4.435  -5.777
   93    HB   ILE  13           HB       ILE  13 -12.218   3.510  -8.208
   94   HG12  ILE  13          2HG1      ILE  13 -11.109   4.927  -6.508
   95   HG13  ILE  13          3HG1      ILE  13 -11.229   5.732  -8.069
   96   HG21  ILE  13          1HG2      ILE  13 -14.490   5.477  -8.149
   97   HG22  ILE  13          2HG2      ILE  13 -13.248   5.496  -9.400
   98   HG23  ILE  13          3HG2      ILE  13 -14.278   4.078  -9.203
   99   HD11  ILE  13          3HD1      ILE  13 -11.964   6.769  -5.629
  100   HD12  ILE  13          1HD1      ILE  13 -12.412   7.402  -7.213
  101   HD13  ILE  13          2HD1      ILE  13 -13.498   6.303  -6.362
  102    H    VAL  14           H        VAL  14 -13.924   1.419  -7.606
  103    HA   VAL  14           HA       VAL  14 -16.531   1.922  -8.636
  104    HB   VAL  14           HB       VAL  14 -15.084  -0.707  -8.283
  105   HG11  VAL  14          1HG1      VAL  14 -16.654  -1.426 -10.130
  106   HG12  VAL  14          2HG1      VAL  14 -17.385  -1.195  -8.541
  107   HG13  VAL  14          3HG1      VAL  14 -17.580   0.035  -9.790
  108   HG21  VAL  14          3HG2      VAL  14 -15.340   0.342 -10.980
  109   HG22  VAL  14          1HG2      VAL  14 -14.425   1.417  -9.922
  110   HG23  VAL  14          2HG2      VAL  14 -13.915  -0.258 -10.131
  111    H    ARG  15           H        ARG  15 -15.333   0.819  -5.610
  112    HA   ARG  15           HA       ARG  15 -17.756  -0.528  -4.815
  113    HB2  ARG  15           2HB      ARG  15 -16.467  -1.380  -3.200
  114    HB3  ARG  15           3HB      ARG  15 -15.114  -0.523  -3.927
  115    HG2  ARG  15           2HG      ARG  15 -15.534   1.391  -2.476
  116    HG3  ARG  15           3HG      ARG  15 -16.906   0.545  -1.755
  117    HD2  ARG  15           2HD      ARG  15 -14.091  -0.524  -1.733
  118    HD3  ARG  15           3HD      ARG  15 -14.767   0.460  -0.435
  119    HE   ARG  15           HE       ARG  15 -16.563  -1.552  -0.705
  120   HH11  ARG  15          1HH1      ARG  15 -13.112  -1.448  -0.251
  121   HH12  ARG  15          2HH1      ARG  15 -13.050  -2.947   0.616
  122   HH21  ARG  15          1HH2      ARG  15 -16.494  -3.526   0.435
  123   HH22  ARG  15          2HH2      ARG  15 -14.974  -4.129   1.004
  124    H    CYS  16           H        CYS  16 -16.231   2.604  -4.257
  125    HA   CYS  16           HA       CYS  16 -18.350   3.458  -2.476
  126    HB2  CYS  16           2HB      CYS  16 -16.008   4.986  -3.632
  127    HB3  CYS  16           3HB      CYS  16 -17.107   5.591  -2.398
  128    HG   CYS  16           HG       CYS  16 -15.988   4.474  -0.350
  129    H    ALA  17           H        ALA  17 -17.352   3.940  -5.806
  130    HA   ALA  17           HA       ALA  17 -19.031   6.104  -6.435
  131    HB1  ALA  17           1HB      ALA  17 -17.155   5.348  -7.845
  132    HB2  ALA  17           2HB      ALA  17 -18.088   3.916  -8.282
  133    HB3  ALA  17           3HB      ALA  17 -18.660   5.517  -8.750
  134    H    PHE  18           H        PHE  18 -19.576   2.620  -6.449
  135    HA   PHE  18           HA       PHE  18 -22.156   2.775  -7.666
  136    HB2  PHE  18           2HB      PHE  18 -20.528   0.754  -7.527
  137    HB3  PHE  18           3HB      PHE  18 -21.255   0.483  -5.946
  138    HD1  PHE  18           HD2      PHE  18 -23.748   0.130  -5.812
  139    HD2  PHE  18           HD1      PHE  18 -21.600   0.063  -9.486
  140    HE1  PHE  18           HE2      PHE  18 -25.612  -1.072  -6.876
  141    HE2  PHE  18           HE1      PHE  18 -23.461  -1.139 -10.556
  142    HZ   PHE  18           HZ       PHE  18 -25.470  -1.709  -9.251
  143    H    GLU  19           H        GLU  19 -20.960   2.629  -4.354
  144    HA   GLU  19           HA       GLU  19 -23.588   2.432  -3.203
  145    HB2  GLU  19           2HB      GLU  19 -21.897   1.452  -1.899
  146    HB3  GLU  19           3HB      GLU  19 -20.828   2.835  -2.085
  147    HG2  GLU  19           2HG      GLU  19 -21.784   3.981  -0.396
  148    HG3  GLU  19           3HG      GLU  19 -23.395   3.350  -0.732
  149    H    HIS  20           H        HIS  20 -21.419   4.978  -4.122
  150    HA   HIS  20           HA       HIS  20 -22.573   7.038  -2.534
  151    HB2  HIS  20           2HB      HIS  20 -20.296   7.174  -3.511
  152    HB3  HIS  20           3HB      HIS  20 -21.014   7.288  -5.115
  153    HD1  HIS  20           HD1      HIS  20 -21.743   9.565  -5.888
  154    HD2  HIS  20           HD2      HIS  20 -20.815   9.469  -1.839
  155    HE1  HIS  20           HE1      HIS  20 -21.771  11.964  -5.135
  156    H    SER  21           H        SER  21 -23.189   5.779  -5.758
  157    HA   SER  21           HA       SER  21 -25.113   7.850  -6.372
  158    HB2  SER  21           2HB      SER  21 -24.525   5.289  -7.875
  159    HB3  SER  21           3HB      SER  21 -25.409   6.687  -8.486
  160    HG   SER  21           HG       SER  21 -22.785   6.996  -7.528
  161    H    ARG  22           H        ARG  22 -25.118   4.514  -5.287
  162    HA   ARG  22           HA       ARG  22 -27.790   3.861  -5.707
  163    HB2  ARG  22           2HB      ARG  22 -25.754   2.472  -4.768
  164    HB3  ARG  22           3HB      ARG  22 -26.416   2.954  -3.212
  165    HG2  ARG  22           2HG      ARG  22 -28.594   1.979  -3.900
  166    HG3  ARG  22           3HG      ARG  22 -27.812   1.385  -5.367
  167    HD2  ARG  22           2HD      ARG  22 -26.582  -0.185  -4.238
  168    HD3  ARG  22           3HD      ARG  22 -26.574   0.742  -2.739
  169    HE   ARG  22           HE       ARG  22 -28.436  -1.262  -3.479
  170   HH11  ARG  22          1HH1      ARG  22 -28.187   1.793  -1.829
  171   HH12  ARG  22          2HH1      ARG  22 -29.545   1.494  -0.795
  172   HH21  ARG  22          1HH2      ARG  22 -30.226  -1.668  -2.125
  173   HH22  ARG  22          2HH2      ARG  22 -30.704  -0.475  -0.964
  174    H    ARG  23           H        ARG  23 -26.266   5.554  -2.999
  175    HA   ARG  23           HA       ARG  23 -28.468   5.698  -1.295
  176    HB2  ARG  23           2HB      ARG  23 -26.501   6.375  -0.289
  177    HB3  ARG  23           3HB      ARG  23 -26.003   7.342  -1.671
  178    HG2  ARG  23           2HG      ARG  23 -27.207   9.164  -1.009
  179    HG3  ARG  23           3HG      ARG  23 -28.407   8.197  -0.151
  180    HD2  ARG  23           2HD      ARG  23 -25.631   8.146   0.883
  181    HD3  ARG  23           3HD      ARG  23 -26.544   9.638   1.104
  182    HE   ARG  23           HE       ARG  23 -27.978   7.283   1.908
  183   HH11  ARG  23          1HH1      ARG  23 -25.689   9.713   2.894
  184   HH12  ARG  23          2HH1      ARG  23 -26.028   9.534   4.584
  185   HH21  ARG  23          1HH2      ARG  23 -28.434   7.037   4.130
  186   HH22  ARG  23          2HH2      ARG  23 -27.589   8.010   5.285
  187    H    PHE  24           H        PHE  24 -27.707   7.488  -4.178
  188    HA   PHE  24           HA       PHE  24 -29.682   9.537  -3.701
  189    HB2  PHE  24           2HB      PHE  24 -28.167   8.883  -6.237
  190    HB3  PHE  24           3HB      PHE  24 -29.080  10.355  -5.920
  191    HD1  PHE  24           HD2      PHE  24 -28.235  10.935  -3.146
  192    HD2  PHE  24           HD1      PHE  24 -25.989   9.636  -6.520
  193    HE1  PHE  24           HE2      PHE  24 -26.219  11.982  -2.202
  194    HE2  PHE  24           HE1      PHE  24 -23.968  10.680  -5.581
  195    HZ   PHE  24           HZ       PHE  24 -24.082  11.856  -3.420
  196    H    THR  25           H        THR  25 -29.397   6.604  -5.634
  197    HA   THR  25           HA       THR  25 -32.102   6.969  -6.680
  198    HB   THR  25           HB       THR  25 -29.830   5.152  -7.386
  199    HG1  THR  25           HG1      THR  25 -31.620   6.580  -9.068
  200   HG21  THR  25          3HG2      THR  25 -31.438   3.978  -8.945
  201   HG22  THR  25          1HG2      THR  25 -32.744   4.675  -7.988
  202   HG23  THR  25          2HG2      THR  25 -31.595   3.567  -7.237
  Start of MODEL   17
    1    H1   GLN   1           H        GLN   1   1.623  -0.252   0.968
    2    HA   GLN   1           HA       GLN   1   3.108   0.240  -0.731
    3    HB2  GLN   1           2HB      GLN   1   1.387  -1.741  -2.218
    4    HB3  GLN   1           3HB      GLN   1   3.118  -1.480  -2.386
    5    HG2  GLN   1           2HG      GLN   1   1.753  -2.582   0.060
    6    HG3  GLN   1           3HG      GLN   1   2.590  -3.535  -1.165
    7   HE21  GLN   1          1HE2      GLN   1   4.826  -2.111  -1.640
    8   HE22  GLN   1          2HE2      GLN   1   5.797  -2.009  -0.215
    9    H    ARG   2           H        ARG   2   3.423   1.759  -2.231
   10    HA   ARG   2           HA       ARG   2   1.248   3.256  -3.256
   11    HB2  ARG   2           2HB      ARG   2   3.260   4.439  -2.884
   12    HB3  ARG   2           3HB      ARG   2   4.208   3.275  -3.799
   13    HG2  ARG   2           2HG      ARG   2   2.152   4.477  -5.434
   14    HG3  ARG   2           3HG      ARG   2   3.204   5.693  -4.707
   15    HD2  ARG   2           2HD      ARG   2   4.705   3.430  -5.715
   16    HD3  ARG   2           3HD      ARG   2   3.725   4.178  -6.975
   17    HE   ARG   2           HE       ARG   2   6.081   5.239  -5.807
   18   HH11  ARG   2          1HH1      ARG   2   2.970   6.159  -7.070
   19   HH12  ARG   2          2HH1      ARG   2   3.480   7.751  -7.525
   20   HH21  ARG   2          1HH2      ARG   2   6.765   7.333  -6.402
   21   HH22  ARG   2          2HH2      ARG   2   5.639   8.417  -7.146
   22    H    SER   3           H        SER   3   3.447   0.890  -4.701
   23    HA   SER   3           HA       SER   3   2.607   1.131  -7.357
   24    HB2  SER   3           2HB      SER   3   3.614  -1.347  -5.938
   25    HB3  SER   3           3HB      SER   3   3.565  -1.107  -7.684
   26    HG   SER   3           HG       SER   3   5.291   0.103  -7.568
   27    H    ASN   4           H        ASN   4   1.349  -0.831  -4.703
   28    HA   ASN   4           HA       ASN   4  -0.646  -2.084  -6.370
   29    HB2  ASN   4           2HB      ASN   4  -0.263  -2.113  -3.368
   30    HB3  ASN   4           3HB      ASN   4  -1.429  -3.098  -4.246
   31   HD21  ASN   4          1HD2      ASN   4   0.437  -4.252  -2.624
   32   HD22  ASN   4          2HD2      ASN   4   1.587  -5.117  -3.581
   33    H    PHE   5           H        PHE   5  -0.367   0.794  -4.547
   34    HA   PHE   5           HA       PHE   5  -3.072   1.193  -3.840
   35    HB2  PHE   5           2HB      PHE   5  -1.096   2.456  -2.920
   36    HB3  PHE   5           3HB      PHE   5  -1.033   3.341  -4.441
   37    HD1  PHE   5           HD1      PHE   5  -3.859   2.315  -2.233
   38    HD2  PHE   5           HD2      PHE   5  -1.734   5.499  -4.094
   39    HE1  PHE   5           HE1      PHE   5  -5.507   3.920  -1.361
   40    HE2  PHE   5           HE2      PHE   5  -3.378   7.109  -3.224
   41    HZ   PHE   5           HZ       PHE   5  -5.268   6.320  -1.856
   42    H    HIS   6           H        HIS   6  -1.203   1.996  -6.719
   43    HA   HIS   6           HA       HIS   6  -3.049   3.637  -8.012
   44    HB2  HIS   6           2HB      HIS   6  -0.748   1.968  -8.844
   45    HB3  HIS   6           3HB      HIS   6  -1.893   2.392 -10.113
   46    HD1  HIS   6           HD1      HIS   6  -1.747   4.713 -11.056
   47    HD2  HIS   6           HD2      HIS   6   0.477   4.261  -7.576
   48    HE1  HIS   6           HE1      HIS   6  -0.418   6.835 -10.828
   49    HA   PRO   7           HA       PRO   7  -4.842  -0.326 -10.127
   50    HB2  PRO   7           2HB      PRO   7  -4.136  -2.721  -9.062
   51    HB3  PRO   7           3HB      PRO   7  -3.219  -1.936 -10.353
   52    HG2  PRO   7           2HG      PRO   7  -2.679  -1.991  -7.409
   53    HG3  PRO   7           3HG      PRO   7  -1.544  -2.183  -8.759
   54    HD2  PRO   7           2HD      PRO   7  -1.816   0.146  -7.404
   55    HD3  PRO   7           3HD      PRO   7  -1.406   0.088  -9.130
   56    H    LEU   8           H        LEU   8  -4.364  -0.180  -6.674
   57    HA   LEU   8           HA       LEU   8  -6.787  -1.615  -6.048
   58    HB2  LEU   8           2HB      LEU   8  -4.983  -1.800  -4.502
   59    HB3  LEU   8           3HB      LEU   8  -4.833  -0.048  -4.380
   60    HG   LEU   8           HG       LEU   8  -7.398  -1.287  -3.527
   61   HD11  LEU   8          1HD1      LEU   8  -4.860  -2.090  -2.462
   62   HD12  LEU   8          2HD1      LEU   8  -6.480  -2.619  -2.011
   63   HD13  LEU   8          3HD1      LEU   8  -5.773  -1.197  -1.245
   64   HD21  LEU   8          3HD2      LEU   8  -7.490   0.982  -3.252
   65   HD22  LEU   8          1HD2      LEU   8  -5.763   1.125  -2.922
   66   HD23  LEU   8          2HD2      LEU   8  -6.851   0.507  -1.678
   67    H    ALA   9           H        ALA   9  -5.862   1.648  -6.672
   68    HA   ALA   9           HA       ALA   9  -7.846   3.051  -5.289
   69    HB1  ALA   9           1HB      ALA   9  -7.490   4.818  -7.022
   70    HB2  ALA   9           2HB      ALA   9  -6.015   4.242  -6.246
   71    HB3  ALA   9           3HB      ALA   9  -6.430   3.691  -7.869
   72    H    ALA  10           H        ALA  10  -7.884   1.566  -8.502
   73    HA   ALA  10           HA       ALA  10 -10.400   2.522  -9.317
   74    HB1  ALA  10           1HB      ALA  10  -8.965   1.627 -10.971
   75    HB2  ALA  10           2HB      ALA  10  -8.824   0.088 -10.119
   76    HB3  ALA  10           3HB      ALA  10 -10.351   0.540 -10.877
   77    H    SER  11           H        SER  11  -9.455  -0.453  -7.633
   78    HA   SER  11           HA       SER  11 -12.014  -1.626  -7.568
   79    HB2  SER  11           2HB      SER  11  -9.639  -1.977  -5.726
   80    HB3  SER  11           3HB      SER  11 -11.080  -2.993  -5.686
   81    HG   SER  11           HG       SER  11  -9.036  -3.484  -7.097
   82    H    PHE  12           H        PHE  12 -10.307   0.425  -5.231
   83    HA   PHE  12           HA       PHE  12 -12.412   0.403  -3.313
   84    HB2  PHE  12           2HB      PHE  12  -9.915   2.019  -3.694
   85    HB3  PHE  12           3HB      PHE  12 -11.108   2.521  -2.500
   86    HD1  PHE  12           HD1      PHE  12  -9.692  -0.775  -3.535
   87    HD2  PHE  12           HD2      PHE  12 -10.448   1.978  -0.378
   88    HE1  PHE  12           HE1      PHE  12  -8.741  -2.370  -1.921
   89    HE2  PHE  12           HE2      PHE  12  -9.497   0.387   1.241
   90    HZ   PHE  12           HZ       PHE  12  -8.641  -1.789   0.470
   91    H    ILE  13           H        ILE  13 -11.715   2.290  -6.138
   92    HA   ILE  13           HA       ILE  13 -13.455   4.472  -5.484
   93    HB   ILE  13           HB       ILE  13 -11.973   3.635  -7.944
   94   HG12  ILE  13          2HG1      ILE  13 -10.858   4.964  -6.178
   95   HG13  ILE  13          3HG1      ILE  13 -10.959   5.836  -7.704
   96   HG21  ILE  13          1HG2      ILE  13 -14.222   5.624  -7.815
   97   HG22  ILE  13          2HG2      ILE  13 -12.972   5.682  -9.056
   98   HG23  ILE  13          3HG2      ILE  13 -14.019   4.269  -8.926
   99   HD11  ILE  13          3HD1      ILE  13 -12.130   7.481  -6.787
  100   HD12  ILE  13          1HD1      ILE  13 -13.233   6.361  -5.988
  101   HD13  ILE  13          2HD1      ILE  13 -11.697   6.779  -5.228
  102    H    VAL  14           H        VAL  14 -13.707   1.540  -7.443
  103    HA   VAL  14           HA       VAL  14 -16.301   2.118  -8.466
  104    HB   VAL  14           HB       VAL  14 -14.888  -0.542  -8.217
  105   HG11  VAL  14          1HG1      VAL  14 -17.079  -1.156  -8.578
  106   HG12  VAL  14          2HG1      VAL  14 -17.445   0.296  -9.512
  107   HG13  VAL  14          3HG1      VAL  14 -16.485  -0.998 -10.230
  108   HG21  VAL  14          3HG2      VAL  14 -13.635   0.059  -9.951
  109   HG22  VAL  14          1HG2      VAL  14 -15.068   0.496 -10.882
  110   HG23  VAL  14          2HG2      VAL  14 -14.303   1.687  -9.830
  111    H    ARG  15           H        ARG  15 -15.136   0.873  -5.483
  112    HA   ARG  15           HA       ARG  15 -17.579  -0.479  -4.761
  113    HB2  ARG  15           2HB      ARG  15 -16.311  -1.412  -3.175
  114    HB3  ARG  15           3HB      ARG  15 -14.944  -0.541  -3.857
  115    HG2  ARG  15           2HG      ARG  15 -15.352   1.314  -2.329
  116    HG3  ARG  15           3HG      ARG  15 -16.738   0.455  -1.653
  117    HD2  ARG  15           2HD      ARG  15 -13.898  -0.559  -1.628
  118    HD3  ARG  15           3HD      ARG  15 -14.689   0.251  -0.276
  119    HE   ARG  15           HE       ARG  15 -14.993  -2.474  -1.053
  120   HH11  ARG  15          1HH1      ARG  15 -16.656   0.231   0.374
  121   HH12  ARG  15          2HH1      ARG  15 -17.761  -0.755   1.272
  122   HH21  ARG  15          1HH2      ARG  15 -16.443  -3.783   0.125
  123   HH22  ARG  15          2HH2      ARG  15 -17.638  -3.038   1.131
  124    H    CYS  16           H        CYS  16 -16.024   2.608  -4.059
  125    HA   CYS  16           HA       CYS  16 -18.146   3.410  -2.259
  126    HB2  CYS  16           2HB      CYS  16 -15.779   4.960  -3.332
  127    HB3  CYS  16           3HB      CYS  16 -16.879   5.524  -2.080
  128    HG   CYS  16           HG       CYS  16 -14.484   3.122  -1.878
  129    H    ALA  17           H        ALA  17 -17.116   4.026  -5.557
  130    HA   ALA  17           HA       ALA  17 -18.761   6.234  -6.108
  131    HB1  ALA  17           1HB      ALA  17 -17.841   4.103  -8.033
  132    HB2  ALA  17           2HB      ALA  17 -18.392   5.728  -8.444
  133    HB3  ALA  17           3HB      ALA  17 -16.893   5.507  -7.542
  134    H    PHE  18           H        PHE  18 -19.361   2.762  -6.272
  135    HA   PHE  18           HA       PHE  18 -21.939   3.018  -7.479
  136    HB2  PHE  18           2HB      PHE  18 -20.332   0.967  -7.437
  137    HB3  PHE  18           3HB      PHE  18 -21.085   0.623  -5.884
  138    HD1  PHE  18           HD1      PHE  18 -21.631   0.870  -9.501
  139    HD2  PHE  18           HD2      PHE  18 -23.343  -0.162  -5.744
  140    HE1  PHE  18           HE1      PHE  18 -23.497  -0.238 -10.660
  141    HE2  PHE  18           HE2      PHE  18 -25.211  -1.272  -6.896
  142    HZ   PHE  18           HZ       PHE  18 -25.290  -1.312  -9.357
  143    H    GLU  19           H        GLU  19 -20.742   2.655  -4.182
  144    HA   GLU  19           HA       GLU  19 -23.360   2.430  -3.029
  145    HB2  GLU  19           2HB      GLU  19 -21.665   1.395  -1.775
  146    HB3  GLU  19           3HB      GLU  19 -20.594   2.783  -1.910
  147    HG2  GLU  19           2HG      GLU  19 -21.536   3.858  -0.167
  148    HG3  GLU  19           3HG      GLU  19 -23.151   3.247  -0.520
  149    H    HIS  20           H        HIS  20 -21.191   5.017  -3.834
  150    HA   HIS  20           HA       HIS  20 -22.358   7.000  -2.156
  151    HB2  HIS  20           2HB      HIS  20 -20.067   7.170  -3.110
  152    HB3  HIS  20           3HB      HIS  20 -20.778   7.384  -4.707
  153    HD1  HIS  20           HD1      HIS  20 -22.524   9.558  -4.774
  154    HD2  HIS  20           HD2      HIS  20 -19.544   9.513  -1.879
  155    HE1  HIS  20           HE1      HIS  20 -22.280  11.945  -4.024
  156    H    SER  21           H        SER  21 -22.959   5.870  -5.425
  157    HA   SER  21           HA       SER  21 -24.845   7.982  -5.996
  158    HB2  SER  21           2HB      SER  21 -24.311   5.440  -7.549
  159    HB3  SER  21           3HB      SER  21 -25.158   6.871  -8.134
  160    HG   SER  21           HG       SER  21 -22.584   7.232  -7.137
  161    H    ARG  22           H        ARG  22 -24.928   4.609  -5.017
  162    HA   ARG  22           HA       ARG  22 -27.631   4.067  -5.435
  163    HB2  ARG  22           2HB      ARG  22 -25.659   3.019  -3.412
  164    HB3  ARG  22           3HB      ARG  22 -27.310   2.421  -3.505
  165    HG2  ARG  22           2HG      ARG  22 -26.001   2.432  -6.093
  166    HG3  ARG  22           3HG      ARG  22 -25.137   1.460  -4.900
  167    HD2  ARG  22           2HD      ARG  22 -28.102   1.208  -5.271
  168    HD3  ARG  22           3HD      ARG  22 -26.973   0.330  -6.302
  169    HE   ARG  22           HE       ARG  22 -26.143  -0.269  -3.790
  170   HH11  ARG  22          1HH1      ARG  22 -29.207  -0.462  -5.432
  171   HH12  ARG  22          2HH1      ARG  22 -29.762  -1.822  -4.513
  172   HH21  ARG  22          1HH2      ARG  22 -26.863  -2.059  -2.572
  173   HH22  ARG  22          2HH2      ARG  22 -28.428  -2.728  -2.886
  174    H    ARG  23           H        ARG  23 -25.995   5.551  -2.670
  175    HA   ARG  23           HA       ARG  23 -28.162   5.675  -0.918
  176    HB2  ARG  23           2HB      ARG  23 -26.140   6.205   0.079
  177    HB3  ARG  23           3HB      ARG  23 -25.646   7.256  -1.242
  178    HG2  ARG  23           2HG      ARG  23 -26.775   9.059  -0.419
  179    HG3  ARG  23           3HG      ARG  23 -27.986   8.067   0.396
  180    HD2  ARG  23           2HD      ARG  23 -25.693   7.362   1.703
  181    HD3  ARG  23           3HD      ARG  23 -25.408   9.067   1.357
  182    HE   ARG  23           HE       ARG  23 -26.958   9.587   2.945
  183   HH11  ARG  23          1HH1      ARG  23 -27.473   6.298   1.926
  184   HH12  ARG  23          2HH1      ARG  23 -28.706   5.989   3.104
  185   HH21  ARG  23          1HH2      ARG  23 -28.580   9.192   4.500
  186   HH22  ARG  23          2HH2      ARG  23 -29.335   7.636   4.566
  187    H    PHE  24           H        PHE  24 -27.392   7.580  -3.717
  188    HA   PHE  24           HA       PHE  24 -29.259   9.688  -3.082
  189    HB2  PHE  24           2HB      PHE  24 -27.136   9.988  -4.441
  190    HB3  PHE  24           3HB      PHE  24 -27.961   9.153  -5.754
  191    HD1  PHE  24           HD1      PHE  24 -30.261  10.143  -6.459
  192    HD2  PHE  24           HD2      PHE  24 -27.297  12.280  -4.277
  193    HE1  PHE  24           HE1      PHE  24 -31.266  12.269  -7.182
  194    HE2  PHE  24           HE2      PHE  24 -28.298  14.410  -4.996
  195    HZ   PHE  24           HZ       PHE  24 -30.285  14.406  -6.450
  196    H    THR  25           H        THR  25 -29.145   6.869  -5.200
  197    HA   THR  25           HA       THR  25 -31.791   7.414  -6.258
  198    HB   THR  25           HB       THR  25 -29.871   6.368  -7.594
  199    HG1  THR  25           HG1      THR  25 -31.372   5.434  -8.869
  200   HG21  THR  25          3HG2      THR  25 -30.829   3.766  -6.469
  201   HG22  THR  25          1HG2      THR  25 -29.527   4.642  -5.667
  202   HG23  THR  25          2HG2      THR  25 -29.341   4.126  -7.344
  Start of MODEL   18
    1    H1   GLN   1           H        GLN   1   4.654  -0.120  -2.231
    2    HA   GLN   1           HA       GLN   1   2.475  -0.822  -2.316
    3    HB2  GLN   1           2HB      GLN   1   2.544  -0.103   0.197
    4    HB3  GLN   1           3HB      GLN   1   1.629   1.289  -0.365
    5    HG2  GLN   1           2HG      GLN   1  -0.218   0.092  -0.208
    6    HG3  GLN   1           3HG      GLN   1   0.388  -0.962  -1.484
    7   HE21  GLN   1          1HE2      GLN   1  -0.896  -1.000   1.475
    8   HE22  GLN   1          2HE2      GLN   1  -0.198  -2.448   2.107
    9    H    ARG   2           H        ARG   2   3.744   1.900  -3.372
   10    HA   ARG   2           HA       ARG   2   1.416   3.415  -4.095
   11    HB2  ARG   2           2HB      ARG   2   4.127   3.635  -5.389
   12    HB3  ARG   2           3HB      ARG   2   2.898   4.880  -5.216
   13    HG2  ARG   2           2HG      ARG   2   3.498   5.376  -3.089
   14    HG3  ARG   2           3HG      ARG   2   3.992   3.721  -2.725
   15    HD2  ARG   2           2HD      ARG   2   5.955   4.116  -4.277
   16    HD3  ARG   2           3HD      ARG   2   5.508   5.822  -4.254
   17    HE   ARG   2           HE       ARG   2   6.873   4.385  -2.209
   18   HH11  ARG   2          1HH1      ARG   2   4.620   6.979  -2.770
   19   HH12  ARG   2          2HH1      ARG   2   5.021   7.818  -1.308
   20   HH21  ARG   2          1HH2      ARG   2   7.410   5.480  -0.281
   21   HH22  ARG   2          2HH2      ARG   2   6.609   6.965   0.106
   22    H    SER   3           H        SER   3   3.571   1.138  -5.735
   23    HA   SER   3           HA       SER   3   2.533   1.379  -8.318
   24    HB2  SER   3           2HB      SER   3   4.629   0.135  -7.610
   25    HB3  SER   3           3HB      SER   3   3.575  -1.191  -7.118
   26    HG   SER   3           HG       SER   3   4.269  -0.314  -9.654
   27    H    ASN   4           H        ASN   4   1.505  -0.621  -5.597
   28    HA   ASN   4           HA       ASN   4  -0.563  -1.926  -7.125
   29    HB2  ASN   4           2HB      ASN   4   0.004  -1.920  -4.152
   30    HB3  ASN   4           3HB      ASN   4  -1.191  -2.939  -4.949
   31   HD21  ASN   4          1HD2      ASN   4   0.700  -4.129  -3.472
   32   HD22  ASN   4          2HD2      ASN   4   1.848  -4.939  -4.478
   33    H    PHE   5           H        PHE   5  -0.240   0.975  -5.349
   34    HA   PHE   5           HA       PHE   5  -2.903   1.320  -4.472
   35    HB2  PHE   5           2HB      PHE   5  -0.924   2.643  -3.680
   36    HB3  PHE   5           3HB      PHE   5  -0.939   3.493  -5.222
   37    HD1  PHE   5           HD1      PHE   5  -3.629   2.490  -2.839
   38    HD2  PHE   5           HD2      PHE   5  -1.673   5.644  -4.923
   39    HE1  PHE   5           HE1      PHE   5  -5.258   4.096  -1.931
   40    HE2  PHE   5           HE2      PHE   5  -3.298   7.255  -4.018
   41    HZ   PHE   5           HZ       PHE   5  -5.093   6.481  -2.519
   42    H    HIS   6           H        HIS   6  -1.246   2.130  -7.477
   43    HA   HIS   6           HA       HIS   6  -3.212   3.710  -8.664
   44    HB2  HIS   6           2HB      HIS   6  -0.929   2.087  -9.625
   45    HB3  HIS   6           3HB      HIS   6  -2.165   2.467 -10.822
   46    HD1  HIS   6           HD1      HIS   6   0.898   3.733  -9.628
   47    HD2  HIS   6           HD2      HIS   6  -2.733   5.475 -10.650
   48    HE1  HIS   6           HE1      HIS   6   1.413   6.156 -10.065
   49    HA   PRO   7           HA       PRO   7  -5.041  -0.320 -10.614
   50    HB2  PRO   7           2HB      PRO   7  -4.206  -2.685  -9.573
   51    HB3  PRO   7           3HB      PRO   7  -3.396  -1.893 -10.930
   52    HG2  PRO   7           2HG      PRO   7  -2.662  -1.899  -8.027
   53    HG3  PRO   7           3HG      PRO   7  -1.615  -2.080  -9.447
   54    HD2  PRO   7           2HD      PRO   7  -1.855   0.257  -8.101
   55    HD3  PRO   7           3HD      PRO   7  -1.558   0.189  -9.850
   56    H    LEU   8           H        LEU   8  -4.342  -0.116  -7.202
   57    HA   LEU   8           HA       LEU   8  -6.679  -1.606  -6.400
   58    HB2  LEU   8           2HB      LEU   8  -4.645  -1.617  -5.043
   59    HB3  LEU   8           3HB      LEU   8  -4.798   0.121  -4.797
   60    HG   LEU   8           HG       LEU   8  -5.522  -1.484  -2.911
   61   HD11  LEU   8          1HD1      LEU   8  -6.588   0.281  -2.053
   62   HD12  LEU   8          2HD1      LEU   8  -7.773   0.319  -3.358
   63   HD13  LEU   8          3HD1      LEU   8  -6.198   1.082  -3.575
   64   HD21  LEU   8          3HD2      LEU   8  -7.007  -2.682  -4.771
   65   HD22  LEU   8          1HD2      LEU   8  -8.186  -1.498  -4.206
   66   HD23  LEU   8          2HD2      LEU   8  -7.469  -2.640  -3.069
   67    H    ALA   9           H        ALA   9  -5.876   1.680  -7.099
   68    HA   ALA   9           HA       ALA   9  -7.832   3.028  -5.618
   69    HB1  ALA   9           1HB      ALA   9  -6.068   4.262  -6.654
   70    HB2  ALA   9           2HB      ALA   9  -6.558   3.717  -8.259
   71    HB3  ALA   9           3HB      ALA   9  -7.594   4.813  -7.346
   72    H    ALA  10           H        ALA  10  -7.970   1.540  -8.826
   73    HA   ALA  10           HA       ALA  10 -10.543   2.433  -9.530
   74    HB1  ALA  10           1HB      ALA  10  -8.943   0.039 -10.405
   75    HB2  ALA  10           2HB      ALA  10 -10.509   0.460 -11.099
   76    HB3  ALA  10           3HB      ALA  10  -9.151   1.576 -11.245
   77    H    SER  11           H        SER  11  -9.446  -0.516  -7.894
   78    HA   SER  11           HA       SER  11 -11.960  -1.767  -7.725
   79    HB2  SER  11           2HB      SER  11  -9.509  -2.034  -5.971
   80    HB3  SER  11           3HB      SER  11 -10.914  -3.097  -5.878
   81    HG   SER  11           HG       SER  11 -10.441  -3.303  -8.294
   82    H    PHE  12           H        PHE  12 -10.231   0.337  -5.451
   83    HA   PHE  12           HA       PHE  12 -12.267   0.260  -3.462
   84    HB2  PHE  12           2HB      PHE  12  -9.782   1.844  -3.917
   85    HB3  PHE  12           3HB      PHE  12 -10.966   2.475  -2.777
   86    HD1  PHE  12           HD1      PHE  12 -10.268  -1.099  -3.366
   87    HD2  PHE  12           HD2      PHE  12  -9.721   2.242  -0.787
   88    HE1  PHE  12           HE1      PHE  12  -9.381  -2.594  -1.624
   89    HE2  PHE  12           HE2      PHE  12  -8.832   0.754   0.959
   90    HZ   PHE  12           HZ       PHE  12  -8.660  -1.668   0.542
   91    H    ILE  13           H        ILE  13 -11.714   2.166  -6.306
   92    HA   ILE  13           HA       ILE  13 -13.484   4.304  -5.594
   93    HB   ILE  13           HB       ILE  13 -12.074   3.494  -8.104
   94   HG12  ILE  13          2HG1      ILE  13 -10.935   4.865  -6.385
   95   HG13  ILE  13          3HG1      ILE  13 -11.111   5.722  -7.912
   96   HG21  ILE  13          1HG2      ILE  13 -14.372   5.420  -7.903
   97   HG22  ILE  13          2HG2      ILE  13 -13.170   5.507  -9.189
   98   HG23  ILE  13          3HG2      ILE  13 -14.172   4.066  -9.014
   99   HD11  ILE  13          3HD1      ILE  13 -11.785   6.666  -5.421
  100   HD12  ILE  13          1HD1      ILE  13 -12.298   7.341  -6.967
  101   HD13  ILE  13          2HD1      ILE  13 -13.336   6.197  -6.116
  102    H    VAL  14           H        VAL  14 -13.741   1.361  -7.535
  103    HA   VAL  14           HA       VAL  14 -16.386   1.873  -8.458
  104    HB   VAL  14           HB       VAL  14 -14.903  -0.753  -8.257
  105   HG11  VAL  14          1HG1      VAL  14 -17.460   0.026  -9.634
  106   HG12  VAL  14          2HG1      VAL  14 -16.526  -1.398 -10.096
  107   HG13  VAL  14          3HG1      VAL  14 -17.194  -1.271  -8.469
  108   HG21  VAL  14          3HG2      VAL  14 -14.409   1.477  -9.883
  109   HG22  VAL  14          1HG2      VAL  14 -13.740  -0.146 -10.051
  110   HG23  VAL  14          2HG2      VAL  14 -15.213   0.295 -10.915
  111    H    ARG  15           H        ARG  15 -15.077   0.669  -5.518
  112    HA   ARG  15           HA       ARG  15 -17.455  -0.742  -4.699
  113    HB2  ARG  15           2HB      ARG  15 -16.104  -1.632  -3.157
  114    HB3  ARG  15           3HB      ARG  15 -14.787  -0.729  -3.894
  115    HG2  ARG  15           2HG      ARG  15 -15.186   1.124  -2.360
  116    HG3  ARG  15           3HG      ARG  15 -16.523   0.233  -1.629
  117    HD2  ARG  15           2HD      ARG  15 -13.623  -0.597  -1.662
  118    HD3  ARG  15           3HD      ARG  15 -14.513   0.032  -0.275
  119    HE   ARG  15           HE       ARG  15 -14.576  -2.647  -1.302
  120   HH11  ARG  15          1HH1      ARG  15 -16.337  -0.237   0.489
  121   HH12  ARG  15          2HH1      ARG  15 -17.303  -1.392   1.346
  122   HH21  ARG  15          1HH2      ARG  15 -15.841  -4.177  -0.181
  123   HH22  ARG  15          2HH2      ARG  15 -17.020  -3.633   0.965
  124    H    CYS  16           H        CYS  16 -15.957   2.389  -4.068
  125    HA   CYS  16           HA       CYS  16 -18.038   3.143  -2.197
  126    HB2  CYS  16           2HB      CYS  16 -15.739   4.740  -3.346
  127    HB3  CYS  16           3HB      CYS  16 -16.817   5.291  -2.070
  128    HG   CYS  16           HG       CYS  16 -14.143   3.320  -1.885
  129    H    ALA  17           H        ALA  17 -17.138   3.759  -5.531
  130    HA   ALA  17           HA       ALA  17 -18.838   5.935  -6.039
  131    HB1  ALA  17           1HB      ALA  17 -17.944   3.799  -7.971
  132    HB2  ALA  17           2HB      ALA  17 -18.558   5.399  -8.387
  133    HB3  ALA  17           3HB      ALA  17 -17.020   5.238  -7.539
  134    H    PHE  18           H        PHE  18 -19.389   2.452  -6.149
  135    HA   PHE  18           HA       PHE  18 -21.984   2.608  -7.300
  136    HB2  PHE  18           2HB      PHE  18 -20.365   0.580  -7.138
  137    HB3  PHE  18           3HB      PHE  18 -21.085   0.339  -5.549
  138    HD1  PHE  18           HD2      PHE  18 -22.333   1.142  -8.978
  139    HD2  PHE  18           HD1      PHE  18 -22.697  -1.278  -5.496
  140    HE1  PHE  18           HE2      PHE  18 -24.208  -0.065 -10.017
  141    HE2  PHE  18           HE1      PHE  18 -24.573  -2.489  -6.529
  142    HZ   PHE  18           HZ       PHE  18 -25.332  -1.882  -8.793
  143    H    GLU  19           H        GLU  19 -20.769   2.478  -3.991
  144    HA   GLU  19           HA       GLU  19 -23.403   2.352  -2.835
  145    HB2  GLU  19           2HB      GLU  19 -20.843   3.068  -1.411
  146    HB3  GLU  19           3HB      GLU  19 -22.310   2.391  -0.718
  147    HG2  GLU  19           2HG      GLU  19 -20.820   0.856  -2.793
  148    HG3  GLU  19           3HG      GLU  19 -20.232   0.885  -1.132
  149    H    HIS  20           H        HIS  20 -21.158   4.826  -3.761
  150    HA   HIS  20           HA       HIS  20 -22.241   6.920  -2.166
  151    HB2  HIS  20           2HB      HIS  20 -19.955   6.949  -3.175
  152    HB3  HIS  20           3HB      HIS  20 -20.699   7.161  -4.757
  153    HD1  HIS  20           HD1      HIS  20 -22.401   9.397  -4.770
  154    HD2  HIS  20           HD2      HIS  20 -19.254   9.301  -2.060
  155    HE1  HIS  20           HE1      HIS  20 -22.025  11.789  -4.091
  156    H    SER  21           H        SER  21 -22.900   5.683  -5.388
  157    HA   SER  21           HA       SER  21 -24.752   7.818  -6.004
  158    HB2  SER  21           2HB      SER  21 -24.254   5.237  -7.506
  159    HB3  SER  21           3HB      SER  21 -25.089   6.665  -8.117
  160    HG   SER  21           HG       SER  21 -22.506   7.017  -7.139
  161    H    ARG  22           H        ARG  22 -24.872   4.483  -4.921
  162    HA   ARG  22           HA       ARG  22 -27.566   3.926  -5.337
  163    HB2  ARG  22           2HB      ARG  22 -25.581   2.462  -4.407
  164    HB3  ARG  22           3HB      ARG  22 -26.217   2.967  -2.847
  165    HG2  ARG  22           2HG      ARG  22 -28.434   2.076  -3.531
  166    HG3  ARG  22           3HG      ARG  22 -27.676   1.448  -4.995
  167    HD2  ARG  22           2HD      ARG  22 -26.147   0.112  -3.616
  168    HD3  ARG  22           3HD      ARG  22 -26.930   0.730  -2.162
  169    HE   ARG  22           HE       ARG  22 -27.882  -1.352  -3.881
  170   HH11  ARG  22          1HH1      ARG  22 -28.846   1.156  -1.668
  171   HH12  ARG  22          2HH1      ARG  22 -30.342   0.390  -1.246
  172   HH21  ARG  22          1HH2      ARG  22 -29.848  -2.371  -3.334
  173   HH22  ARG  22          2HH2      ARG  22 -30.910  -1.617  -2.194
  174    H    ARG  23           H        ARG  23 -25.978   5.559  -2.629
  175    HA   ARG  23           HA       ARG  23 -28.173   5.778  -0.922
  176    HB2  ARG  23           2HB      ARG  23 -26.179   6.376   0.083
  177    HB3  ARG  23           3HB      ARG  23 -25.650   7.333  -1.294
  178    HG2  ARG  23           2HG      ARG  23 -26.787   9.193  -0.619
  179    HG3  ARG  23           3HG      ARG  23 -28.020   8.264   0.235
  180    HD2  ARG  23           2HD      ARG  23 -25.957   7.607   1.753
  181    HD3  ARG  23           3HD      ARG  23 -25.321   9.131   1.134
  182    HE   ARG  23           HE       ARG  23 -27.997   9.322   2.168
  183   HH11  ARG  23          1HH1      ARG  23 -24.606   9.430   2.949
  184   HH12  ARG  23          2HH1      ARG  23 -24.832  10.388   4.375
  185   HH21  ARG  23          1HH2      ARG  23 -28.307  10.584   4.043
  186   HH22  ARG  23          2HH2      ARG  23 -26.937  11.043   4.997
  187    H    PHE  24           H        PHE  24 -27.349   7.542  -3.803
  188    HA   PHE  24           HA       PHE  24 -29.248   9.662  -3.318
  189    HB2  PHE  24           2HB      PHE  24 -27.093   9.917  -4.635
  190    HB3  PHE  24           3HB      PHE  24 -27.875   9.010  -5.926
  191    HD1  PHE  24           HD2      PHE  24 -29.822   9.960  -7.100
  192    HD2  PHE  24           HD1      PHE  24 -27.620  12.196  -4.225
  193    HE1  PHE  24           HE2      PHE  24 -30.825  12.038  -7.953
  194    HE2  PHE  24           HE1      PHE  24 -28.620  14.278  -5.073
  195    HZ   PHE  24           HZ       PHE  24 -30.224  14.201  -6.940
  196    H    THR  25           H        THR  25 -29.056   6.746  -5.293
  197    HA   THR  25           HA       THR  25 -31.676   7.214  -6.448
  198    HB   THR  25           HB       THR  25 -29.717   6.118  -7.679
  199    HG1  THR  25           HG1      THR  25 -31.357   4.419  -8.492
  200   HG21  THR  25          3HG2      THR  25 -28.962   4.079  -7.105
  201   HG22  THR  25          1HG2      THR  25 -30.580   3.477  -6.748
  202   HG23  THR  25          2HG2      THR  25 -29.701   4.413  -5.539
  Start of MODEL   19
    1    H1   GLN   1           H        GLN   1   0.252  -0.249  -0.318
    2    HA   GLN   1           HA       GLN   1   3.048   0.427  -0.787
    3    HB2  GLN   1           2HB      GLN   1   1.616  -1.659  -2.440
    4    HB3  GLN   1           3HB      GLN   1   3.253  -1.069  -2.697
    5    HG2  GLN   1           2HG      GLN   1   2.947  -2.041  -0.012
    6    HG3  GLN   1           3HG      GLN   1   2.452  -3.266  -1.178
    7   HE21  GLN   1          1HE2      GLN   1   4.894  -2.662   0.638
    8   HE22  GLN   1          2HE2      GLN   1   6.232  -3.011  -0.396
    9    H    ARG   2           H        ARG   2   3.390   1.748  -2.586
   10    HA   ARG   2           HA       ARG   2   1.112   3.307  -3.371
   11    HB2  ARG   2           2HB      ARG   2   3.874   3.517  -4.551
   12    HB3  ARG   2           3HB      ARG   2   2.654   4.775  -4.402
   13    HG2  ARG   2           2HG      ARG   2   3.174   5.220  -2.243
   14    HG3  ARG   2           3HG      ARG   2   3.634   3.553  -1.893
   15    HD2  ARG   2           2HD      ARG   2   5.688   4.563  -1.847
   16    HD3  ARG   2           3HD      ARG   2   5.605   4.094  -3.545
   17    HE   ARG   2           HE       ARG   2   4.542   6.684  -3.219
   18   HH11  ARG   2          1HH1      ARG   2   7.571   4.969  -3.166
   19   HH12  ARG   2          2HH1      ARG   2   8.507   6.343  -3.655
   20   HH21  ARG   2          1HH2      ARG   2   5.762   8.499  -3.864
   21   HH22  ARG   2          2HH2      ARG   2   7.477   8.351  -4.051
   22    H    SER   3           H        SER   3   3.302   1.035  -4.969
   23    HA   SER   3           HA       SER   3   2.372   1.340  -7.586
   24    HB2  SER   3           2HB      SER   3   4.423   0.056  -6.821
   25    HB3  SER   3           3HB      SER   3   3.335  -1.266  -6.397
   26    HG   SER   3           HG       SER   3   3.793  -0.143  -8.958
   27    H    ASN   4           H        ASN   4   1.212  -0.700  -4.949
   28    HA   ASN   4           HA       ASN   4  -0.809  -1.947  -6.585
   29    HB2  ASN   4           2HB      ASN   4  -0.361  -2.007  -3.592
   30    HB3  ASN   4           3HB      ASN   4  -1.536  -2.995  -4.456
   31   HD21  ASN   4          1HD2      ASN   4  -0.725  -4.519  -6.020
   32   HD22  ASN   4          2HD2      ASN   4   0.840  -5.216  -5.798
   33    H    PHE   5           H        PHE   5  -0.522   0.914  -4.739
   34    HA   PHE   5           HA       PHE   5  -3.213   1.275  -3.962
   35    HB2  PHE   5           2HB      PHE   5  -1.253   2.557  -3.065
   36    HB3  PHE   5           3HB      PHE   5  -1.195   3.437  -4.589
   37    HD1  PHE   5           HD2      PHE   5  -4.088   2.407  -2.485
   38    HD2  PHE   5           HD1      PHE   5  -1.816   5.609  -4.127
   39    HE1  PHE   5           HE2      PHE   5  -5.732   4.016  -1.612
   40    HE2  PHE   5           HE1      PHE   5  -3.455   7.224  -3.256
   41    HZ   PHE   5           HZ       PHE   5  -5.417   6.428  -1.998
   42    H    HIS   6           H        HIS   6  -1.428   2.124  -6.881
   43    HA   HIS   6           HA       HIS   6  -3.326   3.752  -8.113
   44    HB2  HIS   6           2HB      HIS   6  -1.026   2.119  -9.016
   45    HB3  HIS   6           3HB      HIS   6  -2.208   2.538 -10.252
   46    HD1  HIS   6           HD1      HIS   6  -0.891   4.267 -11.513
   47    HD2  HIS   6           HD2      HIS   6  -1.030   5.021  -7.429
   48    HE1  HIS   6           HE1      HIS   6   0.105   6.558 -11.218
   49    HA   PRO   7           HA       PRO   7  -5.123  -0.216 -10.216
   50    HB2  PRO   7           2HB      PRO   7  -4.360  -2.611  -9.191
   51    HB3  PRO   7           3HB      PRO   7  -3.486  -1.803 -10.498
   52    HG2  PRO   7           2HG      PRO   7  -2.869  -1.876  -7.569
   53    HG3  PRO   7           3HG      PRO   7  -1.768  -2.042  -8.949
   54    HD2  PRO   7           2HD      PRO   7  -2.034   0.271  -7.567
   55    HD3  PRO   7           3HD      PRO   7  -1.668   0.233  -9.304
   56    H    LEU   8           H        LEU   8  -4.560  -0.088  -6.776
   57    HA   LEU   8           HA       LEU   8  -6.944  -1.564  -6.098
   58    HB2  LEU   8           2HB      LEU   8  -4.969  -1.629  -4.659
   59    HB3  LEU   8           3HB      LEU   8  -5.106   0.107  -4.388
   60    HG   LEU   8           HG       LEU   8  -5.929  -1.518  -2.561
   61   HD11  LEU   8          1HD1      LEU   8  -8.131   0.329  -3.068
   62   HD12  LEU   8          2HD1      LEU   8  -6.537   1.068  -3.203
   63   HD13  LEU   8          3HD1      LEU   8  -7.004   0.247  -1.714
   64   HD21  LEU   8          3HD2      LEU   8  -7.358  -2.658  -4.503
   65   HD22  LEU   8          1HD2      LEU   8  -8.540  -1.469  -3.956
   66   HD23  LEU   8          2HD2      LEU   8  -7.881  -2.645  -2.818
   67    H    ALA   9           H        ALA   9  -6.074   1.726  -6.694
   68    HA   ALA   9           HA       ALA   9  -8.077   3.066  -5.268
   69    HB1  ALA   9           1HB      ALA   9  -7.742   4.887  -6.939
   70    HB2  ALA   9           2HB      ALA   9  -6.253   4.299  -6.199
   71    HB3  ALA   9           3HB      ALA   9  -6.682   3.799  -7.835
   72    H    ALA  10           H        ALA  10  -8.090   1.650  -8.510
   73    HA   ALA  10           HA       ALA  10 -10.619   2.591  -9.307
   74    HB1  ALA  10           1HB      ALA  10  -9.013   0.195 -10.164
   75    HB2  ALA  10           2HB      ALA  10 -10.539   0.656 -10.919
   76    HB3  ALA  10           3HB      ALA  10  -9.160   1.754 -10.977
   77    H    SER  11           H        SER  11  -9.630  -0.407  -7.691
   78    HA   SER  11           HA       SER  11 -12.166  -1.626  -7.661
   79    HB2  SER  11           2HB      SER  11  -9.793  -1.969  -5.815
   80    HB3  SER  11           3HB      SER  11 -11.216  -3.011  -5.798
   81    HG   SER  11           HG       SER  11  -9.662  -2.566  -8.123
   82    H    PHE  12           H        PHE  12 -10.509   0.404  -5.269
   83    HA   PHE  12           HA       PHE  12 -12.630   0.308  -3.370
   84    HB2  PHE  12           2HB      PHE  12 -10.107   1.869  -3.680
   85    HB3  PHE  12           3HB      PHE  12 -11.331   2.486  -2.576
   86    HD1  PHE  12           HD2      PHE  12 -10.617  -1.076  -3.236
   87    HD2  PHE  12           HD1      PHE  12 -10.207   2.184  -0.531
   88    HE1  PHE  12           HE2      PHE  12  -9.822  -2.624  -1.497
   89    HE2  PHE  12           HE1      PHE  12  -9.410   0.642   1.213
   90    HZ   PHE  12           HZ       PHE  12  -9.218  -1.766   0.731
   91    H    ILE  13           H        ILE  13 -11.934   2.267  -6.145
   92    HA   ILE  13           HA       ILE  13 -13.710   4.411  -5.456
   93    HB   ILE  13           HB       ILE  13 -12.190   3.653  -7.919
   94   HG12  ILE  13          2HG1      ILE  13 -11.115   4.956  -6.108
   95   HG13  ILE  13          3HG1      ILE  13 -11.209   5.861  -7.616
   96   HG21  ILE  13          1HG2      ILE  13 -14.469   5.606  -7.767
   97   HG22  ILE  13          2HG2      ILE  13 -13.207   5.712  -8.993
   98   HG23  ILE  13          3HG2      ILE  13 -14.235   4.282  -8.908
   99   HD11  ILE  13          3HD1      ILE  13 -11.987   6.738  -5.129
  100   HD12  ILE  13          1HD1      ILE  13 -12.415   7.468  -6.676
  101   HD13  ILE  13          2HD1      ILE  13 -13.509   6.315  -5.913
  102    H    VAL  14           H        VAL  14 -13.901   1.520  -7.481
  103    HA   VAL  14           HA       VAL  14 -16.489   2.085  -8.525
  104    HB   VAL  14           HB       VAL  14 -15.040  -0.557  -8.310
  105   HG11  VAL  14          1HG1      VAL  14 -17.658   0.223  -9.436
  106   HG12  VAL  14          2HG1      VAL  14 -16.665  -0.856 -10.419
  107   HG13  VAL  14          3HG1      VAL  14 -17.118  -1.322  -8.778
  108   HG21  VAL  14          3HG2      VAL  14 -14.523   1.717  -9.907
  109   HG22  VAL  14          1HG2      VAL  14 -13.770   0.124  -9.999
  110   HG23  VAL  14          2HG2      VAL  14 -15.204   0.479 -10.963
  111    H    ARG  15           H        ARG  15 -15.345   0.785  -5.554
  112    HA   ARG  15           HA       ARG  15 -17.791  -0.594  -4.891
  113    HB2  ARG  15           2HB      ARG  15 -16.527  -1.572  -3.330
  114    HB3  ARG  15           3HB      ARG  15 -15.160  -0.662  -3.960
  115    HG2  ARG  15           2HG      ARG  15 -15.510   1.088  -2.358
  116    HG3  ARG  15           3HG      ARG  15 -17.007   0.334  -1.803
  117    HD2  ARG  15           2HD      ARG  15 -14.834  -0.001  -0.433
  118    HD3  ARG  15           3HD      ARG  15 -15.895  -1.380  -0.720
  119    HE   ARG  15           HE       ARG  15 -13.792  -1.059  -2.668
  120   HH11  ARG  15          1HH1      ARG  15 -14.729  -2.480   0.368
  121   HH12  ARG  15          2HH1      ARG  15 -13.540  -3.738   0.296
  122   HH21  ARG  15          1HH2      ARG  15 -12.222  -2.710  -2.775
  123   HH22  ARG  15          2HH2      ARG  15 -12.114  -3.867  -1.493
  124    H    CYS  16           H        CYS  16 -16.249   2.478  -4.100
  125    HA   CYS  16           HA       CYS  16 -18.382   3.230  -2.291
  126    HB2  CYS  16           2HB      CYS  16 -16.039   4.842  -3.325
  127    HB3  CYS  16           3HB      CYS  16 -17.127   5.326  -2.029
  128    HG   CYS  16           HG       CYS  16 -14.414   3.457  -1.893
  129    H    ALA  17           H        ALA  17 -17.342   3.929  -5.570
  130    HA   ALA  17           HA       ALA  17 -19.006   6.138  -6.070
  131    HB1  ALA  17           1HB      ALA  17 -18.044   4.075  -8.048
  132    HB2  ALA  17           2HB      ALA  17 -18.612   5.703  -8.417
  133    HB3  ALA  17           3HB      ALA  17 -17.118   5.476  -7.508
  134    H    PHE  18           H        PHE  18 -19.563   2.666  -6.328
  135    HA   PHE  18           HA       PHE  18 -22.128   2.916  -7.561
  136    HB2  PHE  18           2HB      PHE  18 -20.509   0.883  -7.545
  137    HB3  PHE  18           3HB      PHE  18 -21.255   0.505  -5.995
  138    HD1  PHE  18           HD1      PHE  18 -21.766   0.729  -9.608
  139    HD2  PHE  18           HD2      PHE  18 -23.544  -0.240  -5.865
  140    HE1  PHE  18           HE1      PHE  18 -23.620  -0.386 -10.781
  141    HE2  PHE  18           HE2      PHE  18 -25.399  -1.358  -7.031
  142    HZ   PHE  18           HZ       PHE  18 -25.439  -1.433  -9.492
  143    H    GLU  19           H        GLU  19 -20.970   2.536  -4.255
  144    HA   GLU  19           HA       GLU  19 -23.611   2.270  -3.149
  145    HB2  GLU  19           2HB      GLU  19 -21.938   1.197  -1.896
  146    HB3  GLU  19           3HB      GLU  19 -20.863   2.585  -1.976
  147    HG2  GLU  19           2HG      GLU  19 -21.834   3.617  -0.223
  148    HG3  GLU  19           3HG      GLU  19 -23.443   3.016  -0.618
  149    H    HIS  20           H        HIS  20 -21.424   4.865  -3.866
  150    HA   HIS  20           HA       HIS  20 -22.592   6.815  -2.152
  151    HB2  HIS  20           2HB      HIS  20 -20.303   7.010  -3.090
  152    HB3  HIS  20           3HB      HIS  20 -21.001   7.237  -4.691
  153    HD1  HIS  20           HD1      HIS  20 -21.865   9.549  -5.277
  154    HD2  HIS  20           HD2      HIS  20 -20.685   9.202  -1.308
  155    HE1  HIS  20           HE1      HIS  20 -21.857  11.894  -4.371
  156    H    SER  21           H        SER  21 -23.173   5.783  -5.462
  157    HA   SER  21           HA       SER  21 -25.083   7.898  -5.955
  158    HB2  SER  21           2HB      SER  21 -24.486   5.444  -7.624
  159    HB3  SER  21           3HB      SER  21 -25.358   6.884  -8.147
  160    HG   SER  21           HG       SER  21 -22.798   7.244  -7.111
  161    H    ARG  22           H        ARG  22 -25.112   4.496  -5.102
  162    HA   ARG  22           HA       ARG  22 -27.781   3.886  -5.596
  163    HB2  ARG  22           2HB      ARG  22 -25.761   2.426  -4.734
  164    HB3  ARG  22           3HB      ARG  22 -26.440   2.802  -3.156
  165    HG2  ARG  22           2HG      ARG  22 -28.613   1.887  -3.936
  166    HG3  ARG  22           3HG      ARG  22 -27.815   1.392  -5.430
  167    HD2  ARG  22           2HD      ARG  22 -27.696  -0.537  -4.172
  168    HD3  ARG  22           3HD      ARG  22 -26.139   0.215  -3.824
  169    HE   ARG  22           HE       ARG  22 -28.217   0.906  -1.956
  170   HH11  ARG  22          1HH1      ARG  22 -25.717  -1.380  -2.758
  171   HH12  ARG  22          2HH1      ARG  22 -25.523  -1.938  -1.129
  172   HH21  ARG  22          1HH2      ARG  22 -27.971   0.181   0.192
  173   HH22  ARG  22          2HH2      ARG  22 -26.807  -1.050   0.548
  174    H    ARG  23           H        ARG  23 -26.282   5.379  -2.760
  175    HA   ARG  23           HA       ARG  23 -28.505   5.416  -1.077
  176    HB2  ARG  23           2HB      ARG  23 -26.541   6.002  -0.005
  177    HB3  ARG  23           3HB      ARG  23 -26.028   7.071  -1.304
  178    HG2  ARG  23           2HG      ARG  23 -27.233   8.841  -0.516
  179    HG3  ARG  23           3HG      ARG  23 -28.446   7.814   0.253
  180    HD2  ARG  23           2HD      ARG  23 -27.295   7.690   2.180
  181    HD3  ARG  23           3HD      ARG  23 -25.743   7.546   1.357
  182    HE   ARG  23           HE       ARG  23 -26.907   9.925   2.410
  183   HH11  ARG  23          1HH1      ARG  23 -24.859   8.692  -0.121
  184   HH12  ARG  23          2HH1      ARG  23 -23.999  10.182  -0.330
  185   HH21  ARG  23          1HH2      ARG  23 -25.782  11.892   2.145
  186   HH22  ARG  23          2HH2      ARG  23 -24.524  12.001   0.961
  187    H    PHE  24           H        PHE  24 -27.701   7.391  -3.822
  188    HA   PHE  24           HA       PHE  24 -29.665   9.421  -3.224
  189    HB2  PHE  24           2HB      PHE  24 -27.506   9.820  -4.497
  190    HB3  PHE  24           3HB      PHE  24 -28.248   8.977  -5.852
  191    HD1  PHE  24           HD2      PHE  24 -30.469   9.903  -6.733
  192    HD2  PHE  24           HD1      PHE  24 -27.842  12.094  -4.199
  193    HE1  PHE  24           HE2      PHE  24 -31.523  12.004  -7.461
  194    HE2  PHE  24           HE1      PHE  24 -28.893  14.198  -4.923
  195    HZ   PHE  24           HZ       PHE  24 -30.735  14.155  -6.557
  196    H    THR  25           H        THR  25 -29.371   6.644  -5.380
  197    HA   THR  25           HA       THR  25 -31.995   7.113  -6.527
  198    HB   THR  25           HB       THR  25 -29.990   6.161  -7.809
  199    HG1  THR  25           HG1      THR  25 -31.418   4.830  -9.036
  200   HG21  THR  25          3HG2      THR  25 -29.686   4.406  -5.884
  201   HG22  THR  25          1HG2      THR  25 -29.363   3.955  -7.558
  202   HG23  THR  25          2HG2      THR  25 -30.888   3.496  -6.800
  Start of MODEL   20
    1    H1   GLN   1           H        GLN   1   4.408   0.078  -2.442
    2    HA   GLN   1           HA       GLN   1   2.255  -0.999  -2.226
    3    HB2  GLN   1           2HB      GLN   1   2.365  -0.124   0.285
    4    HB3  GLN   1           3HB      GLN   1   1.329   1.137  -0.369
    5    HG2  GLN   1           2HG      GLN   1  -0.323  -0.272   0.153
    6    HG3  GLN   1           3HG      GLN   1   0.119  -1.068  -1.356
    7   HE21  GLN   1          1HE2      GLN   1   1.525  -2.903  -1.248
    8   HE22  GLN   1          2HE2      GLN   1   1.561  -3.884   0.173
    9    H    ARG   2           H        ARG   2   3.577   1.681  -3.321
   10    HA   ARG   2           HA       ARG   2   1.280   3.226  -4.079
   11    HB2  ARG   2           2HB      ARG   2   4.000   3.376  -5.364
   12    HB3  ARG   2           3HB      ARG   2   2.792   4.646  -5.217
   13    HG2  ARG   2           2HG      ARG   2   3.392   5.165  -3.095
   14    HG3  ARG   2           3HG      ARG   2   3.855   3.508  -2.703
   15    HD2  ARG   2           2HD      ARG   2   5.832   3.842  -4.252
   16    HD3  ARG   2           3HD      ARG   2   5.415   5.556  -4.259
   17    HE   ARG   2           HE       ARG   2   6.749   4.132  -2.186
   18   HH11  ARG   2          1HH1      ARG   2   4.532   6.747  -2.793
   19   HH12  ARG   2          2HH1      ARG   2   4.939   7.602  -1.342
   20   HH21  ARG   2          1HH2      ARG   2   7.293   5.248  -0.272
   21   HH22  ARG   2          2HH2      ARG   2   6.510   6.749   0.091
   22    H    SER   3           H        SER   3   3.400   0.884  -5.672
   23    HA   SER   3           HA       SER   3   2.378   1.102  -8.263
   24    HB2  SER   3           2HB      SER   3   4.448  -0.169  -7.526
   25    HB3  SER   3           3HB      SER   3   3.369  -1.467  -7.017
   26    HG   SER   3           HG       SER   3   3.419  -0.389  -9.640
   27    H    ASN   4           H        ASN   4   1.303  -0.836  -5.514
   28    HA   ASN   4           HA       ASN   4  -0.783  -2.127  -7.031
   29    HB2  ASN   4           2HB      ASN   4  -0.227  -2.083  -4.056
   30    HB3  ASN   4           3HB      ASN   4  -1.437  -3.093  -4.841
   31   HD21  ASN   4          1HD2      ASN   4  -0.057  -4.700  -3.639
   32   HD22  ASN   4          2HD2      ASN   4   1.266  -5.390  -4.510
   33    H    PHE   5           H        PHE   5  -0.415   0.796  -5.300
   34    HA   PHE   5           HA       PHE   5  -3.074   1.203  -4.441
   35    HB2  PHE   5           2HB      PHE   5  -1.075   2.503  -3.662
   36    HB3  PHE   5           3HB      PHE   5  -1.068   3.327  -5.217
   37    HD1  PHE   5           HD1      PHE   5  -3.818   2.405  -2.874
   38    HD2  PHE   5           HD2      PHE   5  -1.733   5.504  -4.914
   39    HE1  PHE   5           HE1      PHE   5  -5.422   4.055  -2.001
   40    HE2  PHE   5           HE2      PHE   5  -3.332   7.158  -4.044
   41    HZ   PHE   5           HZ       PHE   5  -5.179   6.435  -2.584
   42    H    HIS   6           H        HIS   6  -1.390   1.934  -7.451
   43    HA   HIS   6           HA       HIS   6  -3.323   3.529  -8.672
   44    HB2  HIS   6           2HB      HIS   6  -1.066   1.850  -9.597
   45    HB3  HIS   6           3HB      HIS   6  -2.289   2.232 -10.805
   46    HD1  HIS   6           HD1      HIS   6   0.332   3.827  -8.656
   47    HD2  HIS   6           HD2      HIS   6  -2.343   4.887 -11.652
   48    HE1  HIS   6           HE1      HIS   6   1.009   6.139  -9.374
   49    HA   PRO   7           HA       PRO   7  -5.216  -0.499 -10.565
   50    HB2  PRO   7           2HB      PRO   7  -4.428  -2.861  -9.482
   51    HB3  PRO   7           3HB      PRO   7  -3.598  -2.106 -10.848
   52    HG2  PRO   7           2HG      PRO   7  -2.877  -2.078  -7.943
   53    HG3  PRO   7           3HG      PRO   7  -1.827  -2.301  -9.354
   54    HD2  PRO   7           2HD      PRO   7  -2.030   0.062  -8.048
   55    HD3  PRO   7           3HD      PRO   7  -1.728  -0.040  -9.794
   56    H    LEU   8           H        LEU   8  -4.528  -0.252  -7.154
   57    HA   LEU   8           HA       LEU   8  -6.894  -1.687  -6.338
   58    HB2  LEU   8           2HB      LEU   8  -4.867  -1.712  -4.972
   59    HB3  LEU   8           3HB      LEU   8  -4.989   0.033  -4.755
   60    HG   LEU   8           HG       LEU   8  -5.750  -1.528  -2.846
   61   HD11  LEU   8          1HD1      LEU   8  -6.376   1.039  -3.554
   62   HD12  LEU   8          2HD1      LEU   8  -6.788   0.270  -2.021
   63   HD13  LEU   8          3HD1      LEU   8  -7.966   0.309  -3.333
   64   HD21  LEU   8          3HD2      LEU   8  -8.408  -1.515  -4.153
   65   HD22  LEU   8          1HD2      LEU   8  -7.716  -2.651  -2.994
   66   HD23  LEU   8          2HD2      LEU   8  -7.248  -2.729  -4.693
   67    H    ALA   9           H        ALA   9  -6.029   1.573  -7.086
   68    HA   ALA   9           HA       ALA   9  -7.968   2.979  -5.636
   69    HB1  ALA   9           1HB      ALA   9  -6.669   3.602  -8.282
   70    HB2  ALA   9           2HB      ALA   9  -7.690   4.732  -7.391
   71    HB3  ALA   9           3HB      ALA   9  -6.177   4.165  -6.685
   72    H    ALA  10           H        ALA  10  -8.117   1.443  -8.820
   73    HA   ALA  10           HA       ALA  10 -10.670   2.370  -9.552
   74    HB1  ALA  10           1HB      ALA  10 -10.666   0.374 -11.090
   75    HB2  ALA  10           2HB      ALA  10  -9.285   1.460 -11.245
   76    HB3  ALA  10           3HB      ALA  10  -9.112  -0.067 -10.381
   77    H    SER  11           H        SER  11  -9.634  -0.571  -7.863
   78    HA   SER  11           HA       SER  11 -12.173  -1.773  -7.686
   79    HB2  SER  11           2HB      SER  11  -9.734  -2.058  -5.918
   80    HB3  SER  11           3HB      SER  11 -11.158  -3.091  -5.812
   81    HG   SER  11           HG       SER  11  -9.147  -3.023  -7.715
   82    H    PHE  12           H        PHE  12 -10.415   0.336  -5.438
   83    HA   PHE  12           HA       PHE  12 -12.460   0.327  -3.457
   84    HB2  PHE  12           2HB      PHE  12  -9.944   1.858  -3.926
   85    HB3  PHE  12           3HB      PHE  12 -11.122   2.529  -2.802
   86    HD1  PHE  12           HD2      PHE  12 -10.486  -1.066  -3.330
   87    HD2  PHE  12           HD1      PHE  12  -9.890   2.307  -0.803
   88    HE1  PHE  12           HE2      PHE  12  -9.634  -2.547  -1.560
   89    HE2  PHE  12           HE1      PHE  12  -9.036   0.831   0.971
   90    HZ   PHE  12           HZ       PHE  12  -8.908  -1.599   0.595
   91    H    ILE  13           H        ILE  13 -11.861   2.177  -6.329
   92    HA   ILE  13           HA       ILE  13 -13.597   4.357  -5.659
   93    HB   ILE  13           HB       ILE  13 -12.187   3.486  -8.149
   94   HG12  ILE  13          2HG1      ILE  13 -11.031   4.859  -6.443
   95   HG13  ILE  13          3HG1      ILE  13 -11.185   5.699  -7.982
   96   HG21  ILE  13          1HG2      ILE  13 -14.449   5.457  -7.987
   97   HG22  ILE  13          2HG2      ILE  13 -13.239   5.503  -9.268
   98   HG23  ILE  13          3HG2      ILE  13 -14.268   4.084  -9.079
   99   HD11  ILE  13          3HD1      ILE  13 -11.854   6.686  -5.505
  100   HD12  ILE  13          1HD1      ILE  13 -12.344   7.352  -7.063
  101   HD13  ILE  13          2HD1      ILE  13 -13.409   6.238  -6.206
  102    H    VAL  14           H        VAL  14 -13.892   1.389  -7.557
  103    HA   VAL  14           HA       VAL  14 -16.522   1.933  -8.506
  104    HB   VAL  14           HB       VAL  14 -15.082  -0.713  -8.255
  105   HG11  VAL  14          1HG1      VAL  14 -17.082  -1.583  -8.737
  106   HG12  VAL  14          2HG1      VAL  14 -17.769  -0.006  -9.127
  107   HG13  VAL  14          3HG1      VAL  14 -16.860  -0.899 -10.347
  108   HG21  VAL  14          3HG2      VAL  14 -15.374   0.308 -10.930
  109   HG22  VAL  14          1HG2      VAL  14 -14.539   1.479  -9.908
  110   HG23  VAL  14          2HG2      VAL  14 -13.910  -0.161 -10.064
  111    H    ARG  15           H        ARG  15 -15.253   0.746  -5.540
  112    HA   ARG  15           HA       ARG  15 -17.667  -0.602  -4.717
  113    HB2  ARG  15           2HB      ARG  15 -16.343  -1.508  -3.160
  114    HB3  ARG  15           3HB      ARG  15 -15.002  -0.644  -3.900
  115    HG2  ARG  15           2HG      ARG  15 -15.366   1.234  -2.388
  116    HG3  ARG  15           3HG      ARG  15 -16.725   0.381  -1.653
  117    HD2  ARG  15           2HD      ARG  15 -15.243  -1.384  -0.898
  118    HD3  ARG  15           3HD      ARG  15 -13.879  -0.615  -1.707
  119    HE   ARG  15           HE       ARG  15 -13.718   0.872   0.036
  120   HH11  ARG  15          1HH1      ARG  15 -16.739  -0.845   0.245
  121   HH12  ARG  15          2HH1      ARG  15 -17.123  -0.241   1.822
  122   HH21  ARG  15          1HH2      ARG  15 -14.212   1.674   2.113
  123   HH22  ARG  15          2HH2      ARG  15 -15.685   1.193   2.884
  124    H    CYS  16           H        CYS  16 -16.099   2.501  -4.121
  125    HA   CYS  16           HA       CYS  16 -18.159   3.326  -2.259
  126    HB2  CYS  16           2HB      CYS  16 -15.838   4.866  -3.442
  127    HB3  CYS  16           3HB      CYS  16 -16.895   5.446  -2.160
  128    HG   CYS  16           HG       CYS  16 -14.251   3.436  -1.984
  129    H    ALA  17           H        ALA  17 -17.250   3.887  -5.602
  130    HA   ALA  17           HA       ALA  17 -18.924   6.081  -6.131
  131    HB1  ALA  17           1HB      ALA  17 -17.103   5.340  -7.616
  132    HB2  ALA  17           2HB      ALA  17 -18.060   3.923  -8.053
  133    HB3  ALA  17           3HB      ALA  17 -18.634   5.538  -8.470
  134    H    PHE  18           H        PHE  18 -19.511   2.603  -6.217
  135    HA   PHE  18           HA       PHE  18 -22.131   2.828  -7.338
  136    HB2  PHE  18           2HB      PHE  18 -20.521   0.619  -6.120
  137    HB3  PHE  18           3HB      PHE  18 -22.252   0.393  -6.348
  138    HD1  PHE  18           HD2      PHE  18 -19.607   2.006  -8.426
  139    HD2  PHE  18           HD1      PHE  18 -22.622  -0.985  -8.143
  140    HE1  PHE  18           HE2      PHE  18 -19.212   1.390 -10.775
  141    HE2  PHE  18           HE1      PHE  18 -22.231  -1.606 -10.491
  142    HZ   PHE  18           HZ       PHE  18 -20.525  -0.418 -11.811
  143    H    GLU  19           H        GLU  19 -20.817   2.533  -4.079
  144    HA   GLU  19           HA       GLU  19 -23.394   2.316  -2.834
  145    HB2  GLU  19           2HB      GLU  19 -21.656   1.302  -1.624
  146    HB3  GLU  19           3HB      GLU  19 -20.592   2.688  -1.816
  147    HG2  GLU  19           2HG      GLU  19 -21.475   3.787  -0.057
  148    HG3  GLU  19           3HG      GLU  19 -23.101   3.169  -0.346
  149    H    HIS  20           H        HIS  20 -21.258   4.893  -3.752
  150    HA   HIS  20           HA       HIS  20 -22.353   6.902  -2.062
  151    HB2  HIS  20           2HB      HIS  20 -20.116   7.071  -3.122
  152    HB3  HIS  20           3HB      HIS  20 -20.896   7.231  -4.693
  153    HD1  HIS  20           HD1      HIS  20 -20.715   9.586  -5.399
  154    HD2  HIS  20           HD2      HIS  20 -21.516   9.258  -1.335
  155    HE1  HIS  20           HE1      HIS  20 -20.955  11.948  -4.568
  156    H    SER  21           H        SER  21 -23.093   5.742  -5.297
  157    HA   SER  21           HA       SER  21 -25.041   7.826  -5.770
  158    HB2  SER  21           2HB      SER  21 -24.509   5.316  -7.376
  159    HB3  SER  21           3HB      SER  21 -25.418   6.731  -7.907
  160    HG   SER  21           HG       SER  21 -22.784   7.079  -7.026
  161    H    ARG  22           H        ARG  22 -25.000   4.459  -4.790
  162    HA   ARG  22           HA       ARG  22 -27.684   3.812  -5.128
  163    HB2  ARG  22           2HB      ARG  22 -25.609   2.403  -4.307
  164    HB3  ARG  22           3HB      ARG  22 -26.219   2.832  -2.715
  165    HG2  ARG  22           2HG      ARG  22 -28.414   1.867  -3.354
  166    HG3  ARG  22           3HG      ARG  22 -27.686   1.329  -4.869
  167    HD2  ARG  22           2HD      ARG  22 -26.001   0.510  -2.733
  168    HD3  ARG  22           3HD      ARG  22 -27.656   0.053  -2.332
  169    HE   ARG  22           HE       ARG  22 -27.276  -0.725  -4.945
  170   HH11  ARG  22          1HH1      ARG  22 -25.815  -1.415  -1.861
  171   HH12  ARG  22          2HH1      ARG  22 -25.351  -3.027  -2.295
  172   HH21  ARG  22          1HH2      ARG  22 -26.669  -2.845  -5.528
  173   HH22  ARG  22          2HH2      ARG  22 -25.836  -3.839  -4.381
  174    H    ARG  23           H        ARG  23 -26.062   5.425  -2.428
  175    HA   ARG  23           HA       ARG  23 -28.200   5.511  -0.640
  176    HB2  ARG  23           2HB      ARG  23 -26.195   6.156   0.313
  177    HB3  ARG  23           3HB      ARG  23 -25.752   7.171  -1.053
  178    HG2  ARG  23           2HG      ARG  23 -26.931   8.966  -0.284
  179    HG3  ARG  23           3HG      ARG  23 -28.098   7.967   0.584
  180    HD2  ARG  23           2HD      ARG  23 -25.767   7.388   1.886
  181    HD3  ARG  23           3HD      ARG  23 -25.542   9.087   1.470
  182    HE   ARG  23           HE       ARG  23 -27.406   7.996   3.375
  183   HH11  ARG  23          1HH1      ARG  23 -26.647  10.696   1.312
  184   HH12  ARG  23          2HH1      ARG  23 -27.573  11.831   2.237
  185   HH21  ARG  23          1HH2      ARG  23 -28.629   9.480   4.601
  186   HH22  ARG  23          2HH2      ARG  23 -28.699  11.138   4.108
  187    H    PHE  24           H        PHE  24 -27.547   7.388  -3.493
  188    HA   PHE  24           HA       PHE  24 -29.505   9.419  -2.878
  189    HB2  PHE  24           2HB      PHE  24 -27.410   9.794  -4.261
  190    HB3  PHE  24           3HB      PHE  24 -28.203   8.897  -5.551
  191    HD1  PHE  24           HD1      PHE  24 -28.652  11.846  -3.335
  192    HD2  PHE  24           HD2      PHE  24 -29.579   9.996  -7.054
  193    HE1  PHE  24           HE1      PHE  24 -29.760  13.912  -4.083
  194    HE2  PHE  24           HE2      PHE  24 -30.688  12.059  -7.808
  195    HZ   PHE  24           HZ       PHE  24 -30.779  14.021  -6.322
  196    H    THR  25           H        THR  25 -29.274   6.570  -4.947
  197    HA   THR  25           HA       THR  25 -31.950   6.971  -5.995
  198    HB   THR  25           HB       THR  25 -29.997   5.988  -7.326
  199    HG1  THR  25           HG1      THR  25 -31.599   4.252  -8.134
  200   HG21  THR  25          3HG2      THR  25 -29.146   3.964  -6.841
  201   HG22  THR  25          1HG2      THR  25 -30.726   3.290  -6.447
  202   HG23  THR  25          2HG2      THR  25 -29.840   4.222  -5.241