NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position type subsubtype
28547 3cys cing 1-original 2 chemical shift format 3


SHIFTS  MET    1   HA   4.15         QB   2.09         QG   2.57        
SHIFTS  VAL    2   HA   4.19         HB   2.09         QQG  0.97        
SHIFTS  ASN    3   HN   8.68         HA   5.17        2HB   3.65        
SHIFTS  ASN    3  3HB   2.80                                            
SHIFTS  PRO    4   HA   4.79        2HB   2.40        3HB   1.75        
SHIFTS  THR    5   HN   8.78         HA   5.75         HB   4.09        
SHIFTS  THR    5   QG2  1.24                                            
SHIFTS  VAL    6   HN   8.74         HA   5.36         HB   2.34        
SHIFTS  VAL    6   QQG  1.10                                            
SHIFTS  PHE    7   HN   8.97         HA   5.94        2HB   2.88        
SHIFTS  PHE    7  3HB   2.66                                            
SHIFTS  PHE    8   HN   9.56         HA   5.34         QB   3.26        
SHIFTS  ASP    9   HN   9.28         HA   5.57        2HB   2.88        
SHIFTS  ASP    9  3HB   2.55                                            
SHIFTS  ILE   10   HN   9.06         HA   5.19         HB   2.09        
SHIFTS  ILE   10   QG2  1.00        2HG1  1.89        3HG1  1.69        
SHIFTS  ILE   10   QD1  1.03                                            
SHIFTS  ALA   11   HN   9.62         HA   5.20         QB   1.09        
SHIFTS  VAL   12   HN   8.96         HA   4.58         HB   1.79        
SHIFTS  VAL   12   QG1  0.37         QG2  0.68                          
SHIFTS  ASP   13   HN   9.87         HA   4.35        2HB   3.15        
SHIFTS  ASP   13  3HB   2.53                                            
SHIFTS  GLY   14   HN   8.57        1HA   4.24        2HA   3.46        
SHIFTS  GLU   15   HN   8.06         HA   4.87        2HB   2.14        
SHIFTS  GLU   15  3HB   2.02        2HG   2.32        3HG   2.22        
SHIFTS  PRO   16   HA   4.22        2HB   2.35        3HB   1.91        
SHIFTS  LEU   17   HN   9.19         HA   4.72        2HB   1.65        
SHIFTS  LEU   17  3HB   1.46         QD1  1.02         QD2  0.87        
SHIFTS  GLY   18   HN   7.26        1HA   4.29        2HA   3.97        
SHIFTS  ARG   19   HN   8.37         HA   5.66        2HB   2.01        
SHIFTS  ARG   19  3HB   1.65                                            
SHIFTS  VAL   20   HN   9.39         HA   4.63         HB   1.77        
SHIFTS  VAL   20   QG1  0.55         QG2  0.88                          
SHIFTS  SER   21   HN   8.79         HA   5.56        2HB   3.76        
SHIFTS  SER   21  3HB   3.59                                            
SHIFTS  PHE   22   HN   9.53         HA   5.26        2HB   2.43        
SHIFTS  PHE   22  3HB   2.33                                            
SHIFTS  GLU   23   HN   8.73         HA   4.76        2HB   1.83        
SHIFTS  GLU   23  3HB   1.69                                            
SHIFTS  LEU   24   HN   8.19         HA   4.72        2HB   1.93        
SHIFTS  LEU   24  3HB   1.27         HG   1.72         QD1  1.15        
SHIFTS  LEU   24   QD2  0.50                                            
SHIFTS  PHE   25   HN   8.90         HA   5.14        2HB   3.28        
SHIFTS  PHE   25  3HB   2.70                                            
SHIFTS  ALA   26   HN   8.47         HA   3.81         QB   1.54        
SHIFTS  ASP   27   HN   9.07         HA   4.27        2HB   2.87        
SHIFTS  ASP   27  3HB   2.74                                            
SHIFTS  LYS   28   HN   7.55         HA   4.60         QB   1.81        
SHIFTS  VAL   29   HN   8.38         HA   4.47         HB   2.62        
SHIFTS  VAL   29   QG1  1.03         QG2  1.33                          
SHIFTS  PRO   30   HA   4.43        2HB   2.65        3HB   2.01        
SHIFTS  LYS   31   HN  10.70         HA   4.05        2HB   1.75        
SHIFTS  LYS   31  3HB   1.58                                            
SHIFTS  THR   32   HN  10.29         HA   4.02         HB   4.18        
SHIFTS  THR   32   QG2  0.93                                            
SHIFTS  ALA   33   HN   9.25         HA   4.08         QB   1.48        
SHIFTS  GLU   34   HN   8.05         HA   4.55        2HB   2.29        
SHIFTS  GLU   34  3HB   1.80                                            
SHIFTS  ASN   35   HN   7.16         HA   4.10        2HB   2.96        
SHIFTS  ASN   35  3HB   2.44                                            
SHIFTS  PHE   36   HN   7.04         HA   4.18        2HB   3.13        
SHIFTS  PHE   36  3HB   3.00                                            
SHIFTS  ARG   37   HN   8.96         HA   3.68                          
SHIFTS  ALA   38   HN   8.70         HA   4.10         QB   1.29        
SHIFTS  LEU   39   HN   8.23         HA   3.80        2HB   1.46        
SHIFTS  LEU   39  3HB  -0.21         HG   1.82         QD1  0.93        
SHIFTS  LEU   39   QD2  0.60                                            
SHIFTS  SER   40   HN   7.92         HA   4.50        2HB   4.26        
SHIFTS  SER   40  3HB   3.57                                            
SHIFTS  THR   41   HN   8.01         HA   4.32         HB   4.50        
SHIFTS  THR   41   QG2  1.36                                            
SHIFTS  GLY   42   HN   7.60        1HA   3.92        2HA   3.55        
SHIFTS  GLU   43   HN   8.03         HA   4.14        2HB   2.24        
SHIFTS  GLU   43  3HB   2.08                                            
SHIFTS  LYS   44   HN   9.11         HA   4.32        2HB   1.67        
SHIFTS  LYS   44  3HB   0.97                                            
SHIFTS  GLY   45   HN   7.95        1HA   4.33        2HA   3.58        
SHIFTS  PHE   46   HN   6.44         HA   4.66        2HB   3.16        
SHIFTS  PHE   46  3HB   2.75                                            
SHIFTS  GLY   47   HN   7.71        1HA   4.39        2HA   2.59        
SHIFTS  TYR   48   HN   6.90         HA   4.22        2HB   2.87        
SHIFTS  TYR   48  3HB   2.67                                            
SHIFTS  LYS   49   HN   8.49         HA   3.62        2HB   2.02        
SHIFTS  LYS   49  3HB   1.61                                            
SHIFTS  GLY   50   HN   9.53        1HA   4.43        2HA   3.72        
SHIFTS  SER   51   HN   8.43         HA   4.69        2HB   4.36        
SHIFTS  SER   51  3HB   4.22                                            
SHIFTS  CYS   52   HN   9.88         HA   5.93                          
SHIFTS  PHE   53   HN   8.70         HA   4.91                          
SHIFTS  HIS   54   HN   7.54         HA   4.78                          
SHIFTS  ARG   55   HN   6.91         HA   5.12         QB   1.27        
SHIFTS  ILE   56   HN   9.13         HA   4.65         HB   1.62        
SHIFTS  ILE   56   QG2  1.07         QD1  0.87                          
SHIFTS  ILE   57   HN   8.50         HA   5.32         HB   2.05        
SHIFTS  ILE   57   QG2  1.15        2HG1  1.54        3HG1  1.33        
SHIFTS  ILE   57   QD1  1.04                                            
SHIFTS  PRO   58   HA   4.43        2HB   2.25        3HB   2.04        
SHIFTS  GLY   59   HN   9.77        1HA   4.09        2HA   3.87        
SHIFTS  PHE   60   HN   8.11         HA   5.25        2HB   3.27        
SHIFTS  PHE   60  3HB   3.09                                            
SHIFTS  MET   61   HN   7.88         HA   5.18        2HB   2.39        
SHIFTS  MET   61  3HB   1.62                                            
SHIFTS  CYS   62   HN   8.34         HA   4.84        2HB   3.00        
SHIFTS  CYS   62  3HB   2.50                                            
SHIFTS  GLN   63   HN   9.35         HA   5.20                          
SHIFTS  GLY   64   HN   7.49        1HA   4.69        2HA   2.63        
SHIFTS  GLY   65   HN   9.04                                            
SHIFTS  ASP   66   HN   9.96         HA   4.29        2HB   2.96        
SHIFTS  ASP   66  3HB   1.75                                            
SHIFTS  PHE   67   HN   6.72         HA   4.65        2HB   3.95        
SHIFTS  PHE   67  3HB   2.63                                            
SHIFTS  THR   68   HN   7.30         HA   4.70         HB   4.12        
SHIFTS  THR   68   QG2  0.72                                            
SHIFTS  ARG   69   HN   8.70         HA   4.41        2HB   1.89        
SHIFTS  ARG   69  3HB   1.62                                            
SHIFTS  HIS   70   HN   6.64         HA   4.41         QB   3.24        
SHIFTS  ASN   71   HN   7.49         HA   4.63        2HB   3.19        
SHIFTS  ASN   71  3HB   2.71                                            
SHIFTS  GLY   72   HN   9.67        1HA   4.50        2HA   3.39        
SHIFTS  THR   73   HN   7.88         HA   4.18         HB   4.28        
SHIFTS  THR   73   QG2  1.10                                            
SHIFTS  GLY   74   HN   8.77        1HA   4.48        2HA   3.53        
SHIFTS  GLY   75   HN   8.07        1HA   4.61        2HA   2.62        
SHIFTS  LYS   76   HN   6.96         HA   4.65        2HB   1.91        
SHIFTS  LYS   76  3HB   1.60                                            
SHIFTS  SER   77   HN   7.73         HA   5.28         QB   4.29        
SHIFTS  ILE   78   HN   8.57         HA   4.22         HB   1.72        
SHIFTS  ILE   78   QG2  0.75        2HG1  0.68        3HG1 -0.41        
SHIFTS  ILE   78   QD1  0.51                                            
SHIFTS  TYR   79   HN   8.07         HA   4.71        2HB   3.47        
SHIFTS  TYR   79  3HB   2.36                                            
SHIFTS  GLY   80   HN   7.11        1HA   4.68        2HA   3.84        
SHIFTS  GLU   81   HN   9.05         HA   3.97         QB   2.11        
SHIFTS  GLU   81  2HG   2.40        3HG   2.29                          
SHIFTS  LYS   82   HN   7.81         HA   5.61        2HB   1.73        
SHIFTS  LYS   82  3HB   1.59         QG   1.29                          
SHIFTS  PHE   83   HN   9.18         HA   4.96         QB   3.06        
SHIFTS  GLU   84   HN   9.29         HA   3.83        2HB   2.07        
SHIFTS  GLU   84  3HB   1.87                                            
SHIFTS  ASP   85   HN   8.64         HA   4.27        2HB   2.45        
SHIFTS  ASP   85  3HB   1.99                                            
SHIFTS  GLU   86   HN   9.52         HA   3.84        2HB   2.15        
SHIFTS  GLU   86  3HB   1.86         QG   2.39                          
SHIFTS  ASN   87   HN   7.06         HA   4.15        2HB   3.47        
SHIFTS  ASN   87  3HB   2.76                                            
SHIFTS  PHE   88   HN   8.32         HA   5.99        2HB   3.55        
SHIFTS  PHE   88  3HB   2.57                                            
SHIFTS  ILE   89   HN   8.31         HA   3.69         HB   1.59        
SHIFTS  ILE   89   QG2  0.88        2HG1  1.51        3HG1  1.18        
SHIFTS  ILE   89   QD1  0.94                                            
SHIFTS  LEU   90   HN   7.78         HA   4.50        2HB   1.85        
SHIFTS  LEU   90  3HB   1.39         HG   1.49         QD1  0.79        
SHIFTS  LEU   90   QD2  0.68                                            
SHIFTS  LYS   91   HN   8.07         HA   4.63        2HB   2.30        
SHIFTS  LYS   91  3HB   1.56                                            
SHIFTS  HIS   92   HN  10.60         HA   4.36        2HB   3.18        
SHIFTS  HIS   92  3HB   2.93                                            
SHIFTS  THR   93   HN   7.28         HA   4.03         HB   4.47        
SHIFTS  THR   93   QG2  1.24                                            
SHIFTS  GLY   94   HN   7.55        1HA   4.43        2HA   3.63        
SHIFTS  PRO   95   HA   3.79        2HB   2.07        3HB   1.88        
SHIFTS  GLY   96   HN   9.26        1HA   4.62        2HA   3.38        
SHIFTS  ILE   97   HN   6.79         HA   4.09         HB   2.24        
SHIFTS  ILE   97   QG2  0.96        2HG1  1.83        3HG1  1.67        
SHIFTS  ILE   97   QD1  0.98                                            
SHIFTS  LEU   98   HN   7.83         HA   4.86        2HB   0.27        
SHIFTS  LEU   98  3HB   0.16         HG   0.17         QD1 -0.04        
SHIFTS  LEU   98   QD2 -0.86                                            
SHIFTS  SER   99   HN   7.95         HA   5.23        2HB   2.83        
SHIFTS  SER   99  3HB   1.84                                            
SHIFTS  MET  100   HN   8.30         HA   5.53        2HB   2.72        
SHIFTS  MET  100  3HB   2.41                                            
SHIFTS  ALA  101   HN   8.25         HA   4.74         QB   1.22        
SHIFTS  ASN  102   HN   7.69         HA   4.74        2HB   3.33        
SHIFTS  ASN  102  3HB   2.99                                            
SHIFTS  ALA  103   HN   9.28         HA   4.67         QB   1.33        
SHIFTS  GLY  104   HN   8.24        1HA   4.71        2HA   3.75        
SHIFTS  PRO  105   HA   4.37        2HB   2.37        3HB   1.84        
SHIFTS  ASN  106   HN   8.90         HA   4.05        2HB   3.12        
SHIFTS  ASN  106  3HB   2.71                                            
SHIFTS  THR  107   HN  10.30         HA   4.49         HB   4.48        
SHIFTS  THR  107   QG2  0.94                                            
SHIFTS  ASN  108   HN   7.44         HA   4.27        2HB   1.64        
SHIFTS  ASN  108  3HB   0.96                                            
SHIFTS  GLY  109   HN   9.16        1HA   4.65        2HA   3.63        
SHIFTS  SER  110   HN   8.78         HA   4.76        2HB   4.64        
SHIFTS  SER  110  3HB   4.47                                            
SHIFTS  GLN  111   HN   8.46                                            
SHIFTS  PHE  112   HN   8.16         HA   6.07        2HB   3.41        
SHIFTS  PHE  112  3HB   3.32                                            
SHIFTS  PHE  113   HN   9.85         HA   5.89        2HB   2.84        
SHIFTS  PHE  113  3HB   2.59                                            
SHIFTS  ILE  114   HN   9.02         HA   4.84         HB   1.77        
SHIFTS  ILE  114   QG2  0.88        2HG1  2.06        3HG1  1.07        
SHIFTS  ILE  114   QD1  1.24                                            
SHIFTS  CYS  115   HN   9.52         HA   4.62        2HB   3.72        
SHIFTS  CYS  115  3HB   3.05                                            
SHIFTS  THR  116   HN   9.04         HA   4.43         HB   4.48        
SHIFTS  THR  116   QG2  0.86                                            
SHIFTS  ALA  117   HN   7.62         HA   4.44         QB   1.53        
SHIFTS  LYS  118   HN   8.72         HA   3.85        2HB   2.04        
SHIFTS  LYS  118  3HB   1.69                                            
SHIFTS  THR  119   HN   7.38         HA   3.58         HB   2.93        
SHIFTS  THR  119   QG2  1.10                                            
SHIFTS  GLU  120   HN   9.07         HA   4.20        2HB   2.27        
SHIFTS  GLU  120  3HB   2.16        2HG   2.58        3HG   2.43        
SHIFTS  TRP  121   HN   7.33         HA   4.74         QB   3.42        
SHIFTS  LEU  122   HN   7.07         HA   4.36        2HB   1.39        
SHIFTS  LEU  122  3HB   0.34         HG   0.43         QD1  0.53        
SHIFTS  LEU  122   QD2  0.95                                            
SHIFTS  ASP  123   HN   7.59         HA   5.20        2HB   2.95        
SHIFTS  ASP  123  3HB   2.73                                            
SHIFTS  GLY  124   HN   9.59        1HA   3.94        2HA   2.97        
SHIFTS  LYS  125   HN   7.59         HA   4.11        2HB   1.87        
SHIFTS  LYS  125  3HB   1.73         QG   1.30                          
SHIFTS  HIS  126   HN   7.45         HA   4.85        2HB   4.13        
SHIFTS  HIS  126  3HB   3.31                                            
SHIFTS  VAL  127   HN   8.27         HA   4.30         HB   2.04        
SHIFTS  VAL  127   QG1  1.16         QG2  1.06                          
SHIFTS  VAL  128   HN   9.39         HA   4.02         HB   1.70        
SHIFTS  VAL  128   QG1  0.92         QG2  0.06                          
SHIFTS  PHE  129   HN   8.12         HA   5.26        2HB   3.13        
SHIFTS  PHE  129  3HB   2.55                                            
SHIFTS  GLY  130   HN   7.37         QA   3.11                          
SHIFTS  LYS  131   HN   8.33         HA   5.22         QB   1.83        
SHIFTS  VAL  132   HN   9.02         HA   3.91         HB   1.93        
SHIFTS  VAL  132   QG1  0.62         QG2  1.06                          
SHIFTS  LYS  133   HN   9.47         HA   4.43        2HB   1.74        
SHIFTS  LYS  133  3HB   1.67        2HG   1.47        3HG   1.30        
SHIFTS  GLU  134   HN   7.55         HA   4.59         QB   2.20        
SHIFTS  GLU  134  2HG   1.98        3HG   1.88                          
SHIFTS  GLY  135   HN   8.69        1HA   4.78        2HA   4.02        
SHIFTS  MET  136   HN   8.87         HA   4.48                          
SHIFTS  ASN  137   HN   8.93         HA   4.48         QB   2.83        
SHIFTS  ILE  138   HN   7.66         HA   3.79         HB   2.49        
SHIFTS  ILE  138   QG2  0.67        2HG1  1.54        3HG1  1.31        
SHIFTS  ILE  138   QD1  0.69                                            
SHIFTS  VAL  139   HN   7.28         HA   3.87         HB   2.49        
SHIFTS  VAL  139   QG1  0.83         QG2  1.06                          
SHIFTS  GLU  140   HN   8.30         HA   4.05        2HB   2.11        
SHIFTS  GLU  140  3HB   2.02                                            
SHIFTS  ALA  141   HN   7.53         HA   4.11         QB   1.62        
SHIFTS  MET  142   HN   8.31         HA   3.98        2HB   2.52        
SHIFTS  MET  142  3HB   1.95                                            
SHIFTS  GLU  143   HN   7.88         HA   3.78        2HB   2.14        
SHIFTS  GLU  143  3HB   2.03        2HG   2.31        3HG   2.31        
SHIFTS  ARG  144   HN   7.06         HA   3.96                          
SHIFTS  PHE  145   HN   7.62         HA   4.83        2HB   3.57        
SHIFTS  PHE  145  3HB   2.96                                            
SHIFTS  GLY  146   HN   7.58        1HA   4.63        2HA   3.64        
SHIFTS  SER  147   HN   8.21         HA   4.80        2HB   4.20        
SHIFTS  SER  147  3HB   4.08                                            
SHIFTS  ARG  148   HN   8.92         HA   4.22         QB   1.96        
SHIFTS  ARG  148   QG   1.77                                            
SHIFTS  ASN  149   HN   7.86         HA   4.90        2HB   3.22        
SHIFTS  ASN  149  3HB   2.84                                            
SHIFTS  GLY  150   HN   8.08        1HA   4.20        2HA   3.99        
SHIFTS  LYS  151   HN   7.53         HA   4.46         QB   1.87        
SHIFTS  THR  152   HN   8.86         HA   5.58         HB   4.69        
SHIFTS  THR  152   QG2  1.38                                            
SHIFTS  SER  153   HN   9.47         HA   4.49        2HB   4.19        
SHIFTS  SER  153  3HB   4.06                                            
SHIFTS  LYS  154   HN   7.54         HA   4.57        2HB   1.45        
SHIFTS  LYS  154  3HB   0.86                                            
SHIFTS  LYS  155   HN   8.83         HA   4.33        2HB   1.91        
SHIFTS  LYS  155  3HB   1.82                                            
SHIFTS  ILE  156   HN   9.61         HA   5.11         HB   2.43        
SHIFTS  ILE  156   QG2  0.95        2HG1  1.58        3HG1  1.47        
SHIFTS  ILE  156   QD1  0.68                                            
SHIFTS  THR  157   HN   9.24         HA   5.32         HB   3.90        
SHIFTS  THR  157   QG2  1.07                                            
SHIFTS  ILE  158   HN   8.58         HA   4.27         HB   1.73        
SHIFTS  ILE  158   QG2  0.33        2HG1  1.46        3HG1  0.39        
SHIFTS  ILE  158   QD1 -0.04                                            
SHIFTS  ALA  159   HN   8.89         HA   4.15         QB   1.33        
SHIFTS  ASP  160   HN   8.09         HA   4.93        2HB   3.00        
SHIFTS  ASP  160  3HB   2.88                                            
SHIFTS  CYS  161   HN   8.61         HA   4.57        2HB   3.23        
SHIFTS  CYS  161  3HB   3.13                                            
SHIFTS  GLY  162   HN   6.87         QA   3.49                          
SHIFTS  GLN  163   HN   9.08         HA   5.10        2HB   2.00        
SHIFTS  GLN  163  3HB   1.78                                            
SHIFTS  LEU  164   HN   8.62         HA   4.65        2HB   1.63        
SHIFTS  LEU  164  3HB   1.66         HG   1.65         QD1  0.87        
SHIFTS  LEU  164   QD2  0.78                                            
SHIFTS  GLU  165   HN   8.14         HA   4.20        2HB   2.12        
SHIFTS  GLU  165  3HB   1.96         QG   2.22  
REMARK   4   13C CHEMICAL SHIFTS 
SHIFTS  MET    1   CA  55.09         CB  34.14         CG  31.17        
SHIFTS  VAL    2   CA  61.48         QG  33.15                          
SHIFTS  ASN    3   CA  50.98         CB  37.88                          
SHIFTS  PRO    4   CA  62.73                                            
SHIFTS  THR    5   CA  60.42         CB  71.02         CG  22.11        
SHIFTS  VAL    6   CA  58.47         CB  36.10         QG  21.67        
SHIFTS  PHE    7   CA  55.35         CB  42.97                          
SHIFTS  PHE    8   CA  53.48                                            
SHIFTS  ASP    9   CA  54.73         CB  41.03                          
SHIFTS  ILE   10   CA  58.06         CB  37.49         CG1 26.65        
SHIFTS  ILE   10   CG2 17.84         CD  11.25                          
SHIFTS  ALA   11   CA  50.64         CB  22.29                          
SHIFTS  VAL   12   CA  59.80         CB  33.02         CG1 21.04        
SHIFTS  VAL   12   CG2 21.54                                            
SHIFTS  ASP   13   CA  55.60         CB  39.78                          
SHIFTS  GLY   14   CA  44.75                                            
SHIFTS  GLU   15   CA  52.87         CB  31.32         CG  35.39        
SHIFTS  PRO   16   CA  64.16         CB  32.27                          
SHIFTS  LEU   17   CA  55.28         CB  44.12         CD1 22.55        
SHIFTS  LEU   17   CD2 26.03                                            
SHIFTS  GLY   18   CA  44.87                                            
SHIFTS  ARG   19   CA  54.93                                            
SHIFTS  VAL   20   CA  59.95         CB  34.76         CG1 22.29        
SHIFTS  VAL   20   CG2 21.90                                            
SHIFTS  SER   21   CA  54.73                                            
SHIFTS  PHE   22   CA  55.35                                            
SHIFTS  GLU   23   CA  54.98                                            
SHIFTS  LEU   24   CA  51.46         CB  43.07         CG  26.74        
SHIFTS  LEU   24   CD1 26.65         CD2 22.79                          
SHIFTS  PHE   25   CA  54.29         CB  36.01                          
SHIFTS  ALA   26   CA  54.18         CB  18.63                          
SHIFTS  ASP   27   CA  54.73         CB  38.57                          
SHIFTS  LYS   28   CA  56.22         CB  36.01                          
SHIFTS  VAL   29   CA  57.80         CB  31.87         CG1 25.26        
SHIFTS  VAL   29   CG2 20.68                                            
SHIFTS  PRO   30   CA  66.19                                            
SHIFTS  LYS   31   CA  60.35                                            
SHIFTS  THR   32   CA  67.36         CB  68.59         CG  21.97        
SHIFTS  ALA   33   CA  55.80         CB  17.84                          
SHIFTS  GLU   34   CA  57.82                                            
SHIFTS  ASN   35   CA  56.60                                            
SHIFTS  PHE   36   CA  61.53                                            
SHIFTS  ARG   37   CA  60.41                                            
SHIFTS  ALA   38   CA  54.05         CB  18.29                          
SHIFTS  LEU   39   CA  57.16         CB  41.00         CG  26.05        
SHIFTS  LEU   39   CD1 26.63         CD2 23.97                          
SHIFTS  SER   40   CA  62.48                                            
SHIFTS  THR   41   CA  62.29         CB  69.13         CG  22.29        
SHIFTS  GLY   42   CA  45.55                                            
SHIFTS  GLU   43   CA  58.37                                            
SHIFTS  LYS   44   CA  53.86         CB  30.19                          
SHIFTS  GLY   45   CA  44.12                                            
SHIFTS  PHE   46   CA  53.48                                            
SHIFTS  GLY   47   CA  45.39                                            
SHIFTS  TYR   48   CA  57.32                                            
SHIFTS  LYS   49   CA  61.04                                            
SHIFTS  GLY   50   CA  44.87                                            
SHIFTS  SER   51   CA  58.06                                            
SHIFTS  CYS   52   CA  54.73                                            
SHIFTS  PHE   53   CA  57.93                                            
SHIFTS  HIS   54   CA  56.60                                            
SHIFTS  ARG   55   CA  54.79         CB  32.83                          
SHIFTS  ILE   56   CA  61.45         CB  41.68         CG2 17.22        
SHIFTS  ILE   56   CD  13.83                                            
SHIFTS  ILE   57   CA  56.96         CB  40.24         CG1 27.27        
SHIFTS  ILE   57   CG2 16.30         CD  12.85                          
SHIFTS  PRO   58   CA  62.73                                            
SHIFTS  GLY   59   CA  44.88                                            
SHIFTS  PHE   60   CA  55.97                                            
SHIFTS  MET   61   CA  54.10                                            
SHIFTS  CYS   62   CA  57.51                                            
SHIFTS  GLN   63   CA  54.10                                            
SHIFTS  ASP   66   CA  51.45         CB  38.50                          
SHIFTS  PHE   67   CA  55.35                                            
SHIFTS  THR   68   CA  61.73         CB  68.76         CG  22.86        
SHIFTS  ARG   69   CA  54.93                                            
SHIFTS  HIS   70   CA  56.60                                            
SHIFTS  ASN   71   CA  52.21         CB  38.50                          
SHIFTS  GLY   72   CA  44.84                                            
SHIFTS  THR   73   CA  61.44         CB  69.77         CG  21.31        
SHIFTS  GLY   74   CA  44.75                                            
SHIFTS  LYS   76   CA  55.83         CB  34.60                          
SHIFTS  SER   77   CA  56.60                                            
SHIFTS  ILE   78   CA  63.56         CB  37.22         CG1 22.79        
SHIFTS  ILE   78   CG2 17.48         CD  13.83                          
SHIFTS  TYR   79   CA  56.07                                            
SHIFTS  GLY   80   CA  43.62                                            
SHIFTS  GLU   81   CA  60.42         CB  30.19         CG  36.63        
SHIFTS  LYS   82   CA  53.46         CB  36.63         CG  23.97        
SHIFTS  PHE   83   CA  55.82         CB  41.03                          
SHIFTS  GLU   84   CA  56.25         CB  29.15         CG  35.12        
SHIFTS  ASP   85   CA  54.06         CB  40.83                          
SHIFTS  GLU   86   CA  60.34                                            
SHIFTS  ASN   87   CA  52.23         CB  39.06                          
SHIFTS  PHE   88   CA  55.34         CB  38.50                          
SHIFTS  ILE   89   CA  64.84         CB  38.50         CG1 29.15        
SHIFTS  ILE   89   CG2 16.30         CD  13.47                          
SHIFTS  LEU   90   CA  53.47         CB  41.62         CG  26.74        
SHIFTS  LEU   90   CD1 26.65         CD2 22.29                          
SHIFTS  LYS   91   CA  53.85                                            
SHIFTS  HIS   92   CA  56.33         CB  26.03                          
SHIFTS  THR   93   CA  62.91         CB  69.15         CG  22.91        
SHIFTS  GLY   94   CA  45.36                                            
SHIFTS  PRO   95   CA  62.54                                            
SHIFTS  GLY   96   CA  44.86                                            
SHIFTS  ILE   97   CA  59.17         CB  36.84         CG2 20.42        
SHIFTS  ILE   97   CD   8.74                                            
SHIFTS  LEU   98   CA  52.56         CB  43.99         CG  25.76        
SHIFTS  LEU   98   CD1 23.28         CD2 25.42                          
SHIFTS  SER   99   CA  54.41                                            
SHIFTS  MET  100   CA  53.75                                            
SHIFTS  ALA  101   CA  51.46         CB  20.42                          
SHIFTS  ASN  102   CA  53.36                                            
SHIFTS  ALA  103   CA  49.73         CB  18.68                          
SHIFTS  GLY  104   CA  42.87                                            
SHIFTS  PRO  105   CA  63.53                                            
SHIFTS  ASN  106   CA  54.01                                            
SHIFTS  THR  107   CA  59.79         CB  69.13         CG  20.93        
SHIFTS  ASN  108   CA  55.34                                            
SHIFTS  GLY  109   CA  45.36                                            
SHIFTS  SER  110   CA  57.39                                            
SHIFTS  PHE  112   CA  55.31                                            
SHIFTS  PHE  113   CA  54.96         CB  42.87                          
SHIFTS  ILE  114   CA  59.08         CB  40.84         CG1 27.28        
SHIFTS  ILE  114   CG2 17.81         CD  14.72                          
SHIFTS  CYS  115   CA  61.44                                            
SHIFTS  THR  116   CA  60.54         CB  66.65         CG  23.00        
SHIFTS  ALA  117   CA  50.54         CB  22.67                          
SHIFTS  LYS  118   CA  57.47         CB  32.89                          
SHIFTS  THR  119   CA  56.89         CB  68.52         CG  20.85        
SHIFTS  GLU  120   CA  58.86                                            
SHIFTS  TRP  121   CA  59.79         CB  26.66                          
SHIFTS  LEU  122   CA  54.10         CB  38.50         CG  26.38        
SHIFTS  LEU  122   CD1 26.65         CD2 22.82                          
SHIFTS  ASP  123   CA  55.34         CB  39.13                          
SHIFTS  GLY  124   CA  44.78                                            
SHIFTS  LYS  125   CA  55.86                                            
SHIFTS  HIS  126   CA  54.90                                            
SHIFTS  VAL  127   CA  63.73         CB  32.89         CG1 20.92        
SHIFTS  VAL  127   CG2 20.81                                            
SHIFTS  VAL  128   CA  62.91         CB  31.17         CG1 21.85        
SHIFTS  VAL  128   CG2 19.58                                            
SHIFTS  PHE  129   CA  56.01         CB  42.25                          
SHIFTS  GLY  130   CA  45.99                                            
SHIFTS  LYS  131   CA  54.35         CB  35.39                          
SHIFTS  VAL  132   CA  64.16         CB  32.27         CG1 21.04        
SHIFTS  VAL  132   CG2 23.07                                            
SHIFTS  LYS  133   CA  56.68         CB  33.64                          
SHIFTS  GLU  134   CA  54.84         CB  36.62         CG  32.69        
SHIFTS  GLY  135   CA  45.99                                            
SHIFTS  MET  136   CA  56.61                                            
SHIFTS  ASN  137   CA  55.87         CB  35.39                          
SHIFTS  ILE  138   CA  61.35         CB  34.14         CG1 26.65        
SHIFTS  ILE  138   CG2 17.22         CD   8.47                          
SHIFTS  VAL  139   CA  66.10         CB  31.02         CG1 21.95        
SHIFTS  VAL  139   CG2 22.80                                            
SHIFTS  GLU  140   CA  59.17                                            
SHIFTS  ALA  141   CA  54.70         CB  17.84                          
SHIFTS  MET  142   CA  59.68                                            
SHIFTS  GLU  143   CA  59.03         CB  29.69         CG  37.26        
SHIFTS  ARG  144   CA  56.96                                            
SHIFTS  PHE  145   CA  57.80                                            
SHIFTS  GLY  146   CA  43.49                                            
SHIFTS  SER  147   CA  58.06                                            
SHIFTS  ARG  148   CA  59.17         CB  29.77         CG  26.85        
SHIFTS  ASN  149   CA  52.23         CB  37.88                          
SHIFTS  GLY  150   CA  44.74                                            
SHIFTS  LYS  151   CA  56.84         CB  32.03                          
SHIFTS  THR  152   CA  59.79         CB  71.04         CG  22.29        
SHIFTS  SER  153   CA  58.46                                            
SHIFTS  LYS  154   CA  54.10         CB  38.50                          
SHIFTS  LYS  155   CA  55.97         CB  32.27                          
SHIFTS  ILE  156   CA  59.18         CB  36.57         CG1 26.61        
SHIFTS  ILE  156   CG2 19.00         CD  12.85                          
SHIFTS  THR  157   CA  59.17         CB  72.89         CG  22.22        
SHIFTS  ILE  158   CA  60.86         CB  36.60         CG1 27.90        
SHIFTS  ILE  158   CG2 17.78         CD  13.34                          
SHIFTS  ALA  159   CA  54.03         CB  19.17                          
SHIFTS  ASP  160   CA  52.37         CB  43.50                          
SHIFTS  CYS  161   CA  54.72                                            
SHIFTS  GLY  162   CA  44.84                                            
SHIFTS  GLN  163   CA  54.78                                            
SHIFTS  LEU  164   CA  54.72         CB  43.01         CG  43.49        
SHIFTS  LEU  164   CD1 25.28         CD2 22.91                          
SHIFTS  GLU  165   CA  57.30         CB  31.67                          
REMARK   5   15N CHEMICAL SHIFTS 
SHIFTS  ASN    3   N  126.60                                            
SHIFTS  THR    5   N  115.10                                            
SHIFTS  VAL    6   N  120.70                                            
SHIFTS  PHE    7   N  119.30                                            
SHIFTS  PHE    8   N  117.00                                            
SHIFTS  ASP    9   N  124.10                                            
SHIFTS  ILE   10   N  124.30                                            
SHIFTS  ALA   11   N  132.40                                            
SHIFTS  VAL   12   N  118.30                                            
SHIFTS  ASP   13   N  130.90                                            
SHIFTS  GLY   14   N  101.70                                            
SHIFTS  GLU   15   N  123.20                                            
SHIFTS  LEU   17   N  126.00                                            
SHIFTS  GLY   18   N  102.30                                            
SHIFTS  ARG   19   N  121.20                                            
SHIFTS  VAL   20   N  126.80                                            
SHIFTS  SER   21   N  120.30                                            
SHIFTS  PHE   22   N  119.00                                            
SHIFTS  GLU   23   N  123.10                                            
SHIFTS  LEU   24   N  122.50                                            
SHIFTS  PHE   25   N  124.70                                            
SHIFTS  ALA   26   N  129.00                                            
SHIFTS  ASP   27   N  114.20                                            
SHIFTS  LYS   28   N  118.00                                            
SHIFTS  VAL   29   N  114.70                                            
SHIFTS  LYS   31   N  123.90                                            
SHIFTS  THR   32   N  124.00                                            
SHIFTS  ALA   33   N  125.50                                            
SHIFTS  GLU   34   N  117.30                                            
SHIFTS  ASN   35   N  115.60                                            
SHIFTS  PHE   36   N  117.90                                            
SHIFTS  ARG   37   N  121.00                                            
SHIFTS  ALA   38   N  119.10                                            
SHIFTS  LEU   39   N  120.80                                            
SHIFTS  SER   40   N  119.20                                            
SHIFTS  THR   41   N  108.50                                            
SHIFTS  GLY   42   N  108.30                                            
SHIFTS  GLU   43   N  118.60                                            
SHIFTS  LYS   44   N  118.30                                            
SHIFTS  GLY   45   N  105.50                                            
SHIFTS  PHE   46   N  113.70                                            
SHIFTS  GLY   47   N  104.50                                            
SHIFTS  TYR   48   N  113.90                                            
SHIFTS  LYS   49   N  124.90                                            
SHIFTS  GLY   50   N  117.90                                            
SHIFTS  SER   51   N  116.60                                            
SHIFTS  CYS   52   N  115.00                                            
SHIFTS  PHE   53   N  123.00                                            
SHIFTS  HIS   54   N  119.70                                            
SHIFTS  ARG   55   N  124.20                                            
SHIFTS  ILE   56   N  127.10                                            
SHIFTS  ILE   57   N  127.20                                            
SHIFTS  GLY   59   N  113.90                                            
SHIFTS  PHE   60   N  119.10                                            
SHIFTS  MET   61   N  110.40                                            
SHIFTS  CYS   62   N  113.10                                            
SHIFTS  GLN   63   N  127.50                                            
SHIFTS  GLY   64   N  110.80                                            
SHIFTS  GLY   65   N  105.00                                            
SHIFTS  ASP   66   N  124.10                                            
SHIFTS  PHE   67   N  116.20                                            
SHIFTS  THR   68   N  108.90                                            
SHIFTS  ARG   69   N  122.00                                            
SHIFTS  HIS   70   N  111.00                                            
SHIFTS  ASN   71   N  112.30                                            
SHIFTS  GLY   72   N  111.10                                            
SHIFTS  THR   73   N  109.90                                            
SHIFTS  GLY   74   N  113.90                                            
SHIFTS  GLY   75   N  108.80                                            
SHIFTS  LYS   76   N  115.50                                            
SHIFTS  SER   77   N  114.50                                            
SHIFTS  ILE   78   N  111.10                                            
SHIFTS  TYR   79   N  120.90                                            
SHIFTS  GLY   80   N  106.20                                            
SHIFTS  GLU   81   N  123.60                                            
SHIFTS  LYS   82   N  111.80                                            
SHIFTS  PHE   83   N  116.30                                            
SHIFTS  GLU   84   N  119.30                                            
SHIFTS  ASP   85   N  118.80                                            
SHIFTS  GLU   86   N  131.70                                            
SHIFTS  ASN   87   N  106.90                                            
SHIFTS  PHE   88   N  112.80                                            
SHIFTS  ILE   89   N  119.90                                            
SHIFTS  LEU   90   N  117.10                                            
SHIFTS  LYS   91   N  118.90                                            
SHIFTS  HIS   92   N  122.30                                            
SHIFTS  THR   93   N  110.40                                            
SHIFTS  GLY   94   N  107.30                                            
SHIFTS  GLY   96   N  110.70                                            
SHIFTS  ILE   97   N  121.30                                            
SHIFTS  LEU   98   N  129.90                                            
SHIFTS  SER   99   N  119.40                                            
SHIFTS  MET  100   N  123.20                                            
SHIFTS  ALA  101   N  126.90                                            
SHIFTS  ASN  102   N  113.60                                            
SHIFTS  ALA  103   N  121.20                                            
SHIFTS  GLY  104   N  107.70                                            
SHIFTS  ASN  106   N  119.00                                            
SHIFTS  THR  107   N  110.20                                            
SHIFTS  ASN  108   N  120.70                                            
SHIFTS  GLY  109   N  110.80                                            
SHIFTS  SER  110   N  117.00                                            
SHIFTS  GLN  111   N  124.70                                            
SHIFTS  PHE  112   N  118.20                                            
SHIFTS  PHE  113   N  115.00                                            
SHIFTS  ILE  114   N  118.00                                            
SHIFTS  CYS  115   N  124.80                                            
SHIFTS  THR  116   N  115.80                                            
SHIFTS  ALA  117   N  122.00                                            
SHIFTS  LYS  118   N  120.00                                            
SHIFTS  THR  119   N  118.20                                            
SHIFTS  GLU  120   N  124.70                                            
SHIFTS  TRP  121   N  118.30                                            
SHIFTS  LEU  122   N  120.70                                            
SHIFTS  ASP  123   N  122.30                                            
SHIFTS  GLY  124   N  111.10                                            
SHIFTS  LYS  125   N  114.70                                            
SHIFTS  HIS  126   N  120.30                                            
SHIFTS  VAL  127   N  124.80                                            
SHIFTS  VAL  128   N  132.90                                            
SHIFTS  PHE  129   N  117.80                                            
SHIFTS  GLY  130   N  110.80                                            
SHIFTS  LYS  131   N  115.00                                            
SHIFTS  VAL  132   N  124.00                                            
SHIFTS  LYS  133   N  131.70                                            
SHIFTS  GLU  134   N  118.40                                            
SHIFTS  GLY  135   N  107.90                                            
SHIFTS  MET  136   N  122.60                                            
SHIFTS  ASN  137   N  114.40                                            
SHIFTS  ILE  138   N  124.20                                            
SHIFTS  VAL  139   N  122.00                                            
SHIFTS  GLU  140   N  117.20                                            
SHIFTS  ALA  141   N  121.10                                            
SHIFTS  MET  142   N  117.60                                            
SHIFTS  GLU  143   N  116.40                                            
SHIFTS  ARG  144   N  114.90                                            
SHIFTS  PHE  145   N  115.20                                            
SHIFTS  GLY  146   N  104.90                                            
SHIFTS  SER  147   N  109.90                                            
SHIFTS  ARG  148   N  120.30                                            
SHIFTS  ASN  149   N  111.40                                            
SHIFTS  GLY  150   N  110.70                                            
SHIFTS  LYS  151   N  119.80                                            
SHIFTS  THR  152   N  116.80                                            
SHIFTS  SER  153   N  117.30                                            
SHIFTS  LYS  154   N  119.20                                            
SHIFTS  LYS  155   N  121.80                                            
SHIFTS  ILE  156   N  134.10                                            
SHIFTS  THR  157   N  117.20                                            
SHIFTS  ILE  158   N  121.80                                            
SHIFTS  ALA  159   N  132.50                                            
SHIFTS  ASP  160   N  111.50                                            
SHIFTS  CYS  161   N  116.10                                            
SHIFTS  GLY  162   N  104.00                                            
SHIFTS  GLN  163   N  121.00                                            
SHIFTS  LEU  164   N  125.90                                            
SHIFTS  GLU  165   N  125.90                   


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