*HEADER    TRANSCRIPTION                           01-SEP-07   2JUP              
*TITLE     FBP28WW2 DOMAIN IN COMPLEX WITH THE PPLIPPPP PEPTIDE                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TRANSCRIPTION ELONGATION REGULATOR 1;                      
*COMPND   3 CHAIN: W;                                                            
*COMPND   4 FRAGMENT: WW 2 DOMAIN, SEQUENCE DATABASE RESIDUES 430-466;           
*COMPND   5 SYNONYM: TATA BOX-BINDING PROTEIN- ASSOCIATED FACTOR 2S,             
*COMPND   6 TRANSCRIPTION FACTOR CA150, P144, FORMIN- BINDING PROTEIN            
*COMPND   7 28, FBP 28;                                                          
*COMPND   8 ENGINEERED: YES;                                                     
*COMPND   9 MOL_ID: 2;                                                           
*COMPND  10 MOLECULE: FORMIN-1;                                                  
*COMPND  11 CHAIN: P;                                                            
*COMPND  12 FRAGMENT: SEQUENCE DATABASE RESIDUES, 881-888;                       
*COMPND  13 SYNONYM: LIMB DEFORMITY PROTEIN;                                     
*COMPND  14 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   3 ORGANISM_COMMON: MOUSE;                                              
*SOURCE   4 GENE: TCERG1, TAF2S;                                                 
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PETM30;                                    
*SOURCE   8 MOL_ID: 2;                                                           
*SOURCE   9 SYNTHETIC: YES;                                                      
*SOURCE  10 OTHER_DETAILS: THE AUTHORS STATE THAT THE PEPTIDE WAS                
*SOURCE  11 CHEMICALLY SYNTHESIZED AND THE SEQUENCE CORRESPONDS TO THE           
*SOURCE  12 MOUSE FORMIN PROTEIN.                                                
*KEYWDS    FBP28WW DOMAIN, PPLIPPPP PEPTIDE, NMR, ALTERNATIVE SPLICING,          
*KEYWDS   2 COILED COIL, NUCLEUS, POLYMORPHISM, REPRESSOR,                       
*KEYWDS   3 TRANSCRIPTION, TRANSCRIPTION REGULATION, ACTIN-BINDING,              
*KEYWDS   4 CELL JUNCTION, CYTOPLASM, MEMBRANE, PHOSPHORYLATION                  
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    X.RAMIREZ-ESPAIN, L.RUIZ, P.MARTIN-MALPARTIDA, H.OSCHKINAT,           
*AUTHOR   2 M.J.MACIAS                                                           
*REVDAT   1   06-NOV-07 2JUP    0                                                


# Number of dimensions 2
#INAME 1 H
#INAME 2 H
   2   5.299   7.908 1 U          6.980e+02  0.00e+00 m   0  162  160 0
   3   5.299   9.118 1 U          4.493e+03  0.00e+00 m   0  162  185 0
   4   5.299   8.674 1 U          8.730e+02  0.00e+00 m   0  162  264 0
   7   4.650   9.118 1 U          8.500e+02  0.00e+00 m   0  187  185 0
   8   1.392   9.118 1 U          2.831e+03  0.00e+00 m   0  190  185 0
   9   5.299   5.299 1 U          3.874e+03  0.00e+00 m   0  162  162 0
  11   5.544   9.216 1 U          4.260e+02  0.00e+00 m   0  312  310 0
  12   5.814   8.217 1 U          5.310e+02  0.00e+00 m   0  439  437 0
  13   5.814   9.306 1 U          2.388e+03  0.00e+00 m   0  439  447 0
  14   5.814   7.972 1 U          5.240e+02  0.00e+00 m   0  439  333 0
  15   5.544   7.972 1 U          1.900e+03  0.00e+00 m   0  312  333 0
  16   5.045   9.216 1 U          2.360e+03  0.00e+00 m   0  289  310 0
  17   5.045   8.758 1 U          5.840e+02  0.00e+00 m   0  289  287 0
  18   5.045   8.372 1 U          5.140e+02  0.00e+00 m   0  289  137 0
  19   4.235   7.908 1 U          2.827e+03  0.00e+00 m   0  139  160 0
  20   4.235   8.372 1 U          8.630e+02  0.00e+00 m   0  139  137 0
  21   5.814   5.814 1 U          8.385e+03  0.00e+00 m   0  439  439 0
  22   5.544   5.814 1 U          1.123e+03  0.00e+00 m   0  312  439 0
  23   5.544   5.544 1 U          3.635e+03  0.00e+00 m   0  312  312 0
  24   4.844   5.299 1 U          9.620e+02  0.00e+00 m   0  253  162 0
  25   4.643   8.674 1 U          4.710e+02  0.00e+00 m   0  266  264 0
  26   4.643   8.758 1 U          1.514e+03  0.00e+00 m   0  266  287 0
  27   4.844   8.674 1 U          4.851e+03  0.00e+00 m   0  253  264 0
  28   4.923   8.521 1 U          7.380e+02  0.00e+00 m   0  462  460 0
  29   5.172   8.032 1 U          5.500e+02  0.00e+00 m   0   87   85 0
  30   5.172   9.212 1 U          2.534e+03  0.00e+00 m   0   87  109 0
  31   4.318   9.212 1 U          6.240e+02  0.00e+00 m   0  111  109 0
  32   3.691   9.212 1 U          1.175e+03  0.00e+00 m   0  113  109 0
  33   4.145   9.212 1 U          3.570e+02  0.00e+00 m   0  335  109 0
  34   3.691   8.278 1 U          2.790e+02  0.00e+00 m   0  113  122 0
  35   4.318   8.278 1 U          4.754e+03  0.00e+00 m   0  111  122 0
  36   4.267   8.278 1 U          7.250e+02  0.00e+00 m   0  124  122 0
  37   4.267   8.372 1 U          3.953e+03  0.00e+00 m   0  124  137 0
  38   4.267   9.216 1 U          4.350e+02  0.00e+00 m   0  124  310 0
  39   4.082   9.306 1 U          3.800e+02  0.00e+00 m   0  451  447 0
  40   4.623   9.306 1 U          5.360e+02  0.00e+00 m   0  449  447 0
  41   3.454   9.306 1 U          7.160e+02  0.00e+00 m   0  441  447 0
  42   5.172   8.272 1 U          5.600e+02  0.00e+00 m   0   87  347 0
  43   4.145   8.272 1 U          2.747e+03  0.00e+00 m   0  335  347 0
  44   4.145   7.972 1 U          3.540e+02  0.00e+00 m   0  335  333 0
  45   3.915   8.272 1 U          9.910e+02  0.00e+00 m   0  349  347 0
  46   3.915   8.398 1 U          3.990e+02  0.00e+00 m   0  349  361 0
  47   4.087   8.398 1 U          9.580e+02  0.00e+00 m   0  363  361 0
  48   4.087   7.750 1 U          2.870e+02  0.00e+00 m   0  363  387 0
  49   3.760   7.750 1 U          7.210e+02  0.00e+00 m   0  389  387 0
  50   3.566   7.750 1 U          3.080e+02  0.00e+00 m   0    0  387 0
  51   3.568   7.615 1 U          3.851e+03  0.00e+00 m   0  402  400 0
  52   3.760   7.615 1 U          3.070e+02  0.00e+00 m   0  389  400 0
  53   3.736   7.427 1 U          1.608e+03  0.00e+00 m   0  597  595 0
  54   4.192   7.427 1 U          2.025e+03  0.00e+00 m   0  575  595 0
  55   4.192   7.341 1 U          1.227e+03  0.00e+00 m   0  575  573 0
  56   4.092   6.910 1 U          1.180e+03  0.00e+00 m   0  424  422 0
  57   3.568   6.910 1 U          8.140e+02  0.00e+00 m   0  402  422 0
  58   3.454   5.814 1 U          1.263e+03  0.00e+00 m   0  441  439 0
  59   3.454   8.217 1 U          7.940e+02  0.00e+00 m   0  441  437 0
  60   3.451   8.521 1 U          7.670e+02  0.00e+00 m   0  464  460 0
  61   4.623   8.521 1 U          3.132e+03  0.00e+00 m   0  449  460 0
  62   4.350   7.782 1 U          9.200e+02  0.00e+00 m   0  228  226 0
  63   4.350   8.588 1 U          4.919e+03  0.00e+00 m   0  228  251 0
  64   4.844   8.588 1 U          9.160e+02  0.00e+00 m   0  253  251 0
  65   4.284   8.640 1 U          4.232e+03  0.00e+00 m   0   62   70 0
  66   3.985   8.640 1 U          1.016e+03  0.00e+00 m   0   72   70 0
  67   3.985   8.032 1 U          1.281e+03  0.00e+00 m   0   72   85 0
  68   3.789   8.640 1 U          5.090e+02  0.00e+00 m   0   64   70 0
  69   3.688   8.640 1 U          3.640e+02  0.00e+00 m   0   65   70 0
  70   3.688   8.233 1 U          1.778e+03  0.00e+00 m   0   65   60 0
  71   3.789   8.233 1 U          1.514e+03  0.00e+00 m   0   64   60 0
  72   4.284   8.233 1 U          1.347e+03  0.00e+00 m   0   62   60 0
  73   3.879   8.233 1 U          5.110e+03  0.00e+00 m   0   44   60 0
  74   3.879   8.029 1 U          1.231e+03  0.00e+00 m   0   44   42 0
  75   4.121   8.029 1 U          3.161e+03  0.00e+00 m   0   34   42 0
  76   4.121   8.165 1 U         -1.420e+02  0.00e+00 m   0   34   32 0
  77   3.741   8.588 1 U          2.510e+03  0.00e+00 m   0  255  251 0
  78   3.688   8.032 1 U          4.530e+02  0.00e+00 m   0   65   85 0
  81   4.456   9.118 1 U          1.532e+03  0.00e+00 m   0  189  185 0
  82   4.456   9.109 1 U          3.024e+03  0.00e+00 m   0  189  198 0
  83   3.971   9.109 1 U          1.341e+03  0.00e+00 m   0  200  198 0
  84   4.092   8.217 1 U          4.641e+03  0.00e+00 m   0  424  437 0
  85   4.119   8.148 1 U          1.478e+03  0.00e+00 m   0  486  484 0
  86   3.451   8.148 1 U          2.260e+02  0.00e+00 m   0  464  484 0
  87   4.470   7.883 1 U          1.405e+03  0.00e+00 m   0  210  208 0
  88   4.650   9.109 1 U          1.883e+03  0.00e+00 m   0  187  198 0
  89   4.844   9.118 1 U          6.090e+02  0.00e+00 m   0  253  185 0
  90   3.971   7.883 1 U          6.920e+02  0.00e+00 m   0  200  208 0
  91   4.470   7.803 1 U          1.056e+03  0.00e+00 m   0  210  219 0
  92   3.975   7.803 1 U          2.059e+03  0.00e+00 m   0  221  219 0
  93   3.416   7.803 1 U          2.618e+03  0.00e+00 m   0  222  219 0
  94   3.907   8.866 1 U          1.608e+03  0.00e+00 m   0  560  558 0
  95   3.556   8.866 1 U          1.251e+03  0.00e+00 m   0  542  558 0
  96   3.705   8.866 1 U          3.120e+02  0.00e+00 m   0  526  558 0
  97   3.556   8.350 1 U          2.172e+03  0.00e+00 m   0  542  540 0
  98   3.705   8.350 1 U          6.500e+03  0.00e+00 m   0  526  540 0
  99   4.643   8.028 1 U          6.640e+02  0.00e+00 m   0  266  474 0
 100   3.907   7.341 1 U          7.840e+02  0.00e+00 m   0  560  573 0
 101   1.163   8.165 1 U          3.743e+03  0.00e+00 m   0   35   32 0
 102   1.163   8.029 1 U          1.840e+03  0.00e+00 m   0   35   42 0
 103   0.719   8.029 1 U          3.209e+03  0.00e+00 m   0   47   42 0
 104   0.719   8.233 1 U          1.542e+03  0.00e+00 m   0   47   60 0
 105   1.806   8.640 1 U          1.520e+03  0.00e+00 m   0   78   70 0
 106   1.675   8.640 1 U          1.016e+03  0.00e+00 m   0   74   70 0
 107   1.610   8.640 1 U          1.287e+03  0.00e+00 m   0   75   70 0
 108   1.610   8.032 1 U          5.120e+02  0.00e+00 m   0   75   85 0
 109   1.675   8.032 1 U          4.020e+02  0.00e+00 m   0   74   85 0
 110   1.845   8.029 1 U          2.127e+03  0.00e+00 m   0   46   42 0
 111   1.845   8.233 1 U          8.790e+02  0.00e+00 m   0   46   60 0
 112   3.879   3.879 1 U          3.027e+04  0.00e+00 m   0   44   44 0
 113   3.879   1.845 1 U          1.558e+03  0.00e+00 m   0   44   46 0
 114   3.879   0.719 1 U          2.924e+03  0.00e+00 m   0   44   47 0
 115   1.845   0.719 1 U          7.339e+03  0.00e+00 m   0   46   47 0
 116   0.719   0.719 1 U          5.337e+05  0.00e+00 m   0   47   47 0
 117   4.284   4.284 1 U          3.404e+04  0.00e+00 m   0   62   62 0
 118   4.284   3.789 1 U          1.087e+03  0.00e+00 m   0   62   64 0
 119   4.284   3.688 1 U          9.230e+02  0.00e+00 m   0   62   65 0
 120   3.789   3.789 1 U          1.647e+04  0.00e+00 m   0   64   64 0
 121   3.789   3.688 1 U          5.865e+03  0.00e+00 m   0   64   65 0
 122   3.688   3.688 1 U          3.799e+04  0.00e+00 m   0   65   65 0
 123   3.985   3.985 1 U          7.017e+04  0.00e+00 m   0   72   72 0
 124   3.985   1.806 1 U          9.130e+02  0.00e+00 m   0   72   78 0
 125   3.985   1.675 1 U          1.273e+03  0.00e+00 m   0   72   74 0
 126   3.985   1.610 1 U          9.280e+02  0.00e+00 m   0   72   75 0
 127   1.806   1.806 1 U          3.214e+05  0.00e+00 m   0   78   78 0
 128   1.806   1.610 1 U         -1.668e+03  0.00e+00 m   0   78   75 0
 129   1.806   1.675 1 U         -9.350e+02  0.00e+00 m   0   78   74 0
 130   5.172   2.886 1 U          3.920e+02  0.00e+00 m   0   87   89 0
 131   5.172   2.730 1 U          7.380e+02  0.00e+00 m   0   87   90 0
 132   2.886   8.032 1 U          1.411e+03  0.00e+00 m   0   89   85 0
 133   2.730   8.032 1 U          8.210e+02  0.00e+00 m   0   90   85 0
 134   2.886   2.886 1 U          8.226e+03  0.00e+00 m   0   89   89 0
 135   2.886   2.730 1 U          3.669e+03  0.00e+00 m   0   89   90 0
 136   2.730   2.730 1 U          2.886e+04  0.00e+00 m   0   90   90 0
 137   2.886   9.212 1 U          3.970e+02  0.00e+00 m   0   89  109 0
 138   2.730   9.212 1 U          1.351e+03  0.00e+00 m   0   90  109 0
 139   0.687   9.212 1 U          6.480e+02  0.00e+00 m   0  114  109 0
 140   0.687   8.278 1 U          2.326e+03  0.00e+00 m   0  114  122 0
 141   4.318   4.318 1 U          8.805e+03  0.00e+00 m   0  111  111 0
 142   4.318   3.691 1 U          7.580e+02  0.00e+00 m   0  111  113 0
 143   4.318   0.687 1 U          2.190e+03  0.00e+00 m   0  111  114 0
 144   3.691   0.687 1 U          2.198e+03  0.00e+00 m   0  113  114 0
 145   0.687   0.687 1 U          1.079e+06  0.00e+00 m   0  114  114 0
 147   1.573   8.278 1 U          2.022e+03  0.00e+00 m   0  126  122 0
 148   1.645   8.278 1 U          8.290e+02  0.00e+00 m   0  130  122 0
 149   4.267   4.267 1 U          1.186e+04  0.00e+00 m   0  124  124 0
 150   1.645   1.573 1 U          1.208e+03  0.00e+00 m   0  130  126 0
 151   4.267   1.573 1 U          8.760e+02  0.00e+00 m   0  124  126 0
 152   1.573   8.372 1 U          5.340e+02  0.00e+00 m   0  126  137 0
 153   2.236   8.372 1 U          4.830e+02  0.00e+00 m   0  141  137 0
 154   0.696   8.372 1 U          1.311e+03  0.00e+00 m   0  142  137 0
 155   4.235   4.235 1 U          2.237e+04  0.00e+00 m   0  139  139 0
 156   4.235   2.236 1 U          9.230e+02  0.00e+00 m   0  139  141 0
 157   4.235   0.696 1 U          4.860e+02  0.00e+00 m   0  139  142 0
 159   2.236   2.236 1 U          1.181e+04  0.00e+00 m   0  141  141 0
 160   2.236   0.696 1 U          2.408e+03  0.00e+00 m   0  141  142 0
 161   0.696   0.696 1 U          4.668e+05  0.00e+00 m   0  142  142 0
 162   2.236   7.908 1 U          1.313e+03  0.00e+00 m   0  141  160 0
 163   0.696   7.908 1 U          5.030e+02  0.00e+00 m   0  142  160 0
 164   6.398   6.398 1 U          1.053e+05  0.00e+00 m   0  156  156 0
 165   6.398   6.571 1 U          1.057e+04  0.00e+00 m   0  156  157 0
 166   4.235   6.571 1 U          1.982e+03  0.00e+00 m   0  139  157 0
 167   2.236   6.571 1 U          2.269e+03  0.00e+00 m   0  141  157 0
 168   0.696   6.571 1 U          2.606e+03  0.00e+00 m   0  142  157 0
 169   4.235   6.398 1 U          3.000e+02  0.00e+00 m   0  139  156 0
 170   2.236   6.398 1 U          5.640e+02  0.00e+00 m   0  141  156 0
 171   0.696   6.398 1 U          1.817e+03  0.00e+00 m   0  142  156 0
 173   0.687   6.398 1 U          2.550e+03  0.00e+00 m   0  114  156 0
 174   6.571   6.571 1 U          5.418e+04  0.00e+00 m   0  157  157 0
 175   1.133   7.908 1 U          5.370e+02  0.00e+00 m   0  168  160 0
 176   1.473   7.908 1 U          6.550e+02  0.00e+00 m   0  164  160 0
 177   1.399   7.908 1 U          1.341e+03  0.00e+00 m   0  165  160 0
 178   1.133   9.118 1 U          4.500e+02  0.00e+00 m   0  168  185 0
 179   1.473   9.118 1 U          8.730e+02  0.00e+00 m   0  164  185 0
 180   1.399   9.118 1 U          3.462e+03  0.00e+00 m   0  165  185 0
 181   5.299   1.133 1 U          4.320e+02  0.00e+00 m   0  162  168 0
 182   5.299   1.473 1 U          7.740e+02  0.00e+00 m   0  162  164 0
 183   5.299   1.399 1 U          1.153e+03  0.00e+00 m   0  162  165 0
 184   1.133   1.133 1 U          1.052e+05  0.00e+00 m   0  168  168 0
 185   1.133   1.473 1 U          8.900e+02  0.00e+00 m   0  168  164 0
 186   1.133   1.399 1 U          2.374e+03  0.00e+00 m   0  168  165 0
 187   1.473   1.473 1 U          5.754e+04  0.00e+00 m   0  164  164 0
 188   1.473   1.399 1 U          2.261e+03  0.00e+00 m   0  164  165 0
 191   2.647   2.647 1 U          1.004e+05  0.00e+00 m   0  172  172 0
 192   2.647   1.133 1 U          7.740e+02  0.00e+00 m   0  172  168 0
 194   2.647   1.399 1 U          4.710e+02  0.00e+00 m   0  172  165 0
 195   1.284   9.109 1 U          4.754e+03  0.00e+00 m   0  201  198 0
 196   4.456   4.456 1 U          2.147e+04  0.00e+00 m   0  189  189 0
 197   4.456   1.392 1 U          1.204e+03  0.00e+00 m   0  189  190 0
 198   4.650   1.392 1 U          1.486e+03  0.00e+00 m   0  187  190 0
 199   3.971   3.971 1 U          3.604e+04  0.00e+00 m   0  200  200 0
 200   3.971   1.284 1 U          6.411e+03  0.00e+00 m   0  200  201 0
 201   1.284   7.883 1 U          1.554e+03  0.00e+00 m   0  201  208 0
 202   2.638   7.883 1 U          7.720e+02  0.00e+00 m   0  212  208 0
 203   2.443   7.883 1 U          8.410e+02  0.00e+00 m   0  213  208 0
 204   2.638   7.803 1 U          1.610e+02  0.00e+00 m   0  212  219 0
 206   4.470   2.638 1 U          1.417e+03  0.00e+00 m   0  210  212 0
 207   4.470   2.443 1 U          1.792e+03  0.00e+00 m   0  210  213 0
 208   2.638   2.443 1 U          7.169e+03  0.00e+00 m   0  212  213 0
 209   2.638   2.638 1 U          3.972e+04  0.00e+00 m   0  212  212 0
 210   3.975   7.782 1 U          4.660e+02  0.00e+00 m   0  221  226 0
 211   3.416   7.782 1 U          6.630e+02  0.00e+00 m   0  222  226 0
 212   3.975   3.944 1 U         -2.155e+03  0.00e+00 m   0  221    0 0
 213   3.975   3.416 1 U          3.624e+03  0.00e+00 m   0  221  222 0
 214   3.416   3.416 1 U          2.443e+05  0.00e+00 m   0  222  222 0
 215   1.795   7.782 1 U          1.195e+03  0.00e+00 m   0  230  226 0
 216   1.096   7.782 1 U          6.310e+02  0.00e+00 m   0  234  226 0
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 736   4.350   1.096 1 U          7.910e+02  0.00e+00 m   0  228  234 0
 737   5.544   2.742 1 U          3.550e+02  0.00e+00 m   0  312  314 0
 738   5.172   4.145 1 U          6.800e+01  0.00e+00 m   0   87  335 0
 739   4.923   3.451 1 U          9.040e+02  0.00e+00 m   0  462  464 0
 740   4.923   2.976 1 U          5.920e+02  0.00e+00 m   0  462  465 0
 741   3.451   2.976 1 U          3.976e+03  0.00e+00 m   0  464  465 0
 742   2.454   1.096 1 U          1.299e+03  0.00e+00 m   0  238  234 0
 743   2.454   1.736 1 U          2.300e+01  0.00e+00 m   0  238  231 0
 745   2.886   0.559 1 U          1.980e+02  0.00e+00 m   0   89  583 0
 747   2.730   0.559 1 U          1.220e+02  0.00e+00 m   0   90  583 0
 750   1.094   0.034 1 U          3.410e+02  0.00e+00 m   0  452  532 0
 751   1.094  -0.175 1 U          3.480e+02  0.00e+00 m   0  452  533 0
 752   5.544   6.794 1 U          1.208e+03  0.00e+00 m   0  312  330 0
 753   4.148   8.038 1 U          5.881e+03  0.00e+00 m   0   11   19 0
 754   2.664   9.216 1 U          7.470e+02  0.00e+00 m   0  315  310 0
 755   2.664   9.216 1 U          7.470e+02  0.00e+00 m   0  315  310 0
 756   2.477   8.758 1 U          9.580e+02  0.00e+00 m   0  292  287 0
 757   0.539   6.394 1 U          1.188e+03  0.00e+00 m   0  410    0 0
 758   6.588   5.991 1 U          4.914e+03  0.00e+00 m   0  284  283 0
 759   7.152   9.216 1 U          9.000e+02  0.00e+00 m   0  473  310 0
 760   7.152   8.273 1 U          7.940e+02  0.00e+00 m   0  473    0 0
 761   7.152   8.028 1 U          3.740e+02  0.00e+00 m   0  473  474 0
 762   1.730   8.350 1 U          2.116e+03  0.00e+00 m   0  545  540 0
 763   2.664   6.794 1 U          2.107e+03  0.00e+00 m   0  315  330 0
 764   0.696   6.571 1 U          2.606e+03  0.00e+00 m   0  142  157 0
 765   2.664   6.398 1 U          1.359e+03  0.00e+00 m   0  315  156 0
 766   2.742   5.555 1 U          4.150e+02  0.00e+00 m   0  314  312 0
 767   2.664   5.555 1 U          5.970e+02  0.00e+00 m   0  315  312 0
 768   1.573   6.518 1 U          7.620e+02  0.00e+00 m   0  126  307 0
 769   1.573   6.471 1 U          1.341e+03  0.00e+00 m   0  126  306 0
 771   1.645   8.372 1 U          9.160e+02  0.00e+00 m   0  130  137 0
 774   0.644   6.471 1 U          5.460e+02  0.00e+00 m   0  582  306 0
 775   0.644   6.518 1 U          5.160e+02  0.00e+00 m   0  582  307 0
 776   2.471   6.518 1 U          3.024e+03  0.00e+00 m   0  292  307 0
 777   2.475   6.471 1 U          1.556e+03  0.00e+00 m   0  292  306 0
 778   4.267   6.518 1 U          8.790e+02  0.00e+00 m   0  124  307 0
 779   4.267   6.471 1 U          4.180e+02  0.00e+00 m   0  124  306 0
 780   2.384   6.518 1 U          4.700e+02  0.00e+00 m   0  535  307 0
 781   2.382   6.471 1 U          4.740e+02  0.00e+00 m   0  535  306 0
 782   4.088   8.521 1 U          5.320e+02  0.00e+00 m   0  451  460 0
 783   4.207   7.998 1 U          1.251e+03  0.00e+00 m   0  692  690 0
 784   4.041   7.998 1 U          9.362e+03  0.00e+00 m   0  670  690 0
 785   4.041   8.167 1 U          2.863e+03  0.00e+00 m   0  670  668 0
 786   4.207   3.585 1 U          6.500e+03  0.00e+00 m   0  692  722 0
 787   4.207   3.322 1 U          2.315e+03  0.00e+00 m   0  692  723 0
 790   3.573   3.322 1 U          2.827e+04  0.00e+00 m   0  722  723 0
 791   4.352   3.546 1 U          5.174e+03  0.00e+00 m   0  713  738 0
 792   4.352   3.364 1 U          4.578e+03  0.00e+00 m   0  713  739 0
 793   4.352   1.635 1 U          9.940e+02  0.00e+00 m   0  713  715 0
 794   4.207   1.232 1 U          7.350e+02  0.00e+00 m   0  692  701 0
 795   4.207   0.656 1 U          6.026e+03  0.00e+00 m   0  692  695 0
 796   4.207   0.603 1 U          2.675e+03  0.00e+00 m   0  692  704 0
 797   4.207   0.907 1 U          1.291e+03  0.00e+00 m   0  692  702 0
 798   4.207   1.590 1 U          2.127e+03  0.00e+00 m   0  692  694 0
 799   1.583   1.579 1 U          2.596e+05  0.00e+00 m   0  694  694 0
 800   1.583   1.231 1 U          2.150e+03  0.00e+00 m   0  694  701 0
 801   1.583   0.915 1 U          1.448e+03  0.00e+00 m   0  694  702 0
 802   1.583   0.656 1 U          1.327e+04  0.00e+00 m   0  694  695 0
 803   1.583   0.596 1 U          1.962e+03  0.00e+00 m   0  694  704 0
 804   1.232   0.915 1 U          9.884e+03  0.00e+00 m   0  701  702 0
 805   1.232   0.654 1 U          1.596e+03  0.00e+00 m   0  701    0 0
 806   0.903   0.596 1 U          1.350e+04  0.00e+00 m   0  702  704 0
 807   4.175   8.167 1 U          1.046e+04  0.00e+00 m   0  654  668 0
 808   4.176   2.012 1 U          3.840e+02  0.00e+00 m   0  654  660 0
 809   4.176   1.768 1 U          6.610e+02  0.00e+00 m   0  654  661 0
 810   4.176   1.628 1 U          3.675e+03  0.00e+00 m   0  654  656 0
 811   3.539   2.012 1 U          6.300e+02  0.00e+00 m   0  663  660 0
 812   3.358   2.012 1 U          3.980e+02  0.00e+00 m   0  664  660 0
 813   3.537   1.768 1 U          7.283e+03  0.00e+00 m   0  663  656 0
 814   3.367   1.768 1 U          6.628e+03  0.00e+00 m   0  664  656 0
 815   3.539   3.374 1 U          4.846e+04  0.00e+00 m   0  663  664 0
 816   3.528   8.167 1 U          3.350e+02  0.00e+00 m   0  663  668 0
 817   3.376   8.167 1 U          3.270e+02  0.00e+00 m   0  664  668 0
 818   2.016   8.167 1 U          5.130e+02  0.00e+00 m   0  660  668 0
 819   1.771   8.167 1 U          2.380e+02  0.00e+00 m   0  656  668 0
 820   1.617   8.167 1 U          1.275e+03  0.00e+00 m   0  657  668 0
 821   0.605   7.998 1 U          5.850e+02  0.00e+00 m   0  704  690 0
 822   0.660   7.998 1 U          1.188e+03  0.00e+00 m   0  695  690 0
 823   0.905   7.998 1 U          1.923e+03  0.00e+00 m   0  702  690 0
 824   1.224   7.998 1 U          1.518e+03  0.00e+00 m   0  701  690 0
 825   1.579   7.998 1 U          3.794e+03  0.00e+00 m   0  694  690 0
 826   1.299   7.998 1 U          9.680e+02  0.00e+00 m   0  676  690 0
 827   1.356   7.998 1 U          1.041e+03  0.00e+00 m   0  672  690 0
 828   4.050   0.673 1 U          1.618e+03  0.00e+00 m   0  670  677 0
 829   1.360   8.167 1 U          6.122e+03  0.00e+00 m   0  672  668 0
 830   1.297   8.167 1 U          1.871e+03  0.00e+00 m   0  676  668 0
 831   0.681   8.167 1 U          2.970e+02  0.00e+00 m   0  677  668 0
 832   0.616   8.167 1 U          3.090e+02  0.00e+00 m   0  678  668 0
 833   4.041   1.367 1 U          4.567e+03  0.00e+00 m   0  670  672 0
 834   4.041   1.301 1 U          7.580e+02  0.00e+00 m   0  670  676 0
 835   4.350   6.588 1 U          4.330e+02  0.00e+00 m   0  228  284 0
 836   2.411   8.497 1 U          1.410e+02  0.00e+00 m   0  521  511 0
 837   2.333   8.497 1 U          1.640e+02  0.00e+00 m   0    0  511 0
 838   1.894   8.497 1 U          2.820e+02  0.00e+00 m   0    0  511 0
 839   1.793   8.497 1 U          5.590e+02  0.00e+00 m   0    0  511 0
 840   1.361   8.497 1 U          2.500e+01  0.00e+00 m   0    0  511 0
 841   8.025   8.233 1 U          1.026e+03  0.00e+00 m   0   42   60 0
 842   4.279   8.032 1 U          9.200e+02  0.00e+00 m   0   62    0 0
 843   1.806   8.027 1 U          5.000e+02  0.00e+00 m   0   78   85 0
 844   4.267   1.650 1 U          1.261e+03  0.00e+00 m   0  124  130 0
 845   1.473   1.148 1 U          1.253e+03  0.00e+00 m   0  164  168 0
 846   2.443   7.803 1 U          1.510e+02  0.00e+00 m   0  213  219 0
 847   7.794   7.883 1 U          1.506e+03  0.00e+00 m   0  219  208 0
 848   8.260   8.398 1 U          8.480e+02  0.00e+00 m   0  347  361 0
 849   4.350   1.736 1 U          1.494e+03  0.00e+00 m   0  228  231 0
 851   1.095   6.656 1 U          4.010e+02  0.00e+00 m   0  235  478 0
 852   1.746   6.893 1 U          4.400e+02  0.00e+00 m   0  231  481 0
 854   2.454   1.094 1 U          1.299e+03  0.00e+00 m   0  238  235 0
 856   1.392   6.656 1 U          1.208e+03  0.00e+00 m   0  190  478 0
 857   1.392   6.892 1 U          1.996e+03  0.00e+00 m   0  190  481 0
 858   1.392   7.161 1 U          5.060e+02  0.00e+00 m   0  190  480 0
 859   1.086   6.518 1 U          1.177e+03  0.00e+00 m   0  578  307 0
 860   1.092   6.471 1 U          4.080e+02  0.00e+00 m   0  578  306 0
 861   1.985   6.395 1 U          4.270e+02  0.00e+00 m   0  719  329 0
 862   1.560   6.395 1 U          3.720e+02  0.00e+00 m   0  694  329 0
 863   1.864   6.395 1 U          2.590e+02  0.00e+00 m   0  404  329 0
 864   1.698   6.398 1 U          7.920e+02  0.00e+00 m   0  656  156 0
 865   1.634   6.398 1 U          4.480e+02  0.00e+00 m   0  657  156 0
 866   1.773   6.398 1 U          2.480e+02  0.00e+00 m   0  661  156 0
 867   0.603   6.398 1 U          7.760e+02  0.00e+00 m   0  704  156 0
 868   0.603   6.571 1 U          5.290e+02  0.00e+00 m   0  704  157 0
 869   0.658   6.571 1 U          1.065e+03  0.00e+00 m   0  695  157 0
 870   4.420   3.374 1 U          3.120e+03  0.00e+00 m   0  638  664 0
 871   4.420   3.545 1 U          5.391e+03  0.00e+00 m   0  638  663 0
 872   4.352   1.985 1 U          2.940e+03  0.00e+00 m   0  713  719 0
 873   3.530   3.364 1 U          5.251e+04  0.00e+00 m   0  738  739 0
 874   4.420   2.085 1 U          3.971e+03  0.00e+00 m   0  638  644 0
 875   3.568   1.635 1 U          2.891e+03  0.00e+00 m   0  722  715 0
 876   3.324   1.635 1 U          2.317e+03  0.00e+00 m   0  723  715 0
 877   3.575   1.985 1 U          5.780e+02  0.00e+00 m   0  722  719 0
 878   3.346   1.985 1 U          5.260e+02  0.00e+00 m   0  723  719 0
 879   1.630   7.159 1 U          1.087e+03  0.00e+00 m   0  767  473 0
 880   2.031   7.161 1 U          3.060e+02  0.00e+00 m   0  747  480 0
 881   1.748   7.161 1 U          3.710e+02  0.00e+00 m   0  751  480 0
 882   1.748   5.992 1 U          3.990e+02  0.00e+00 m   0  751  283 0
 884   1.696   6.588 1 U          3.350e+02  0.00e+00 m   0  752  284 0
 885   1.680   7.161 1 U          3.560e+02  0.00e+00 m   0  752  480 0
 886   1.985   6.794 1 U          3.120e+02  0.00e+00 m   0  719  330 0
 887   1.635   6.794 1 U          2.000e+02  0.00e+00 m   0  715  330 0
 888   1.985   6.395 1 U          4.270e+02  0.00e+00 m   0  719  329 0
 889   1.635   6.395 1 U          5.830e+02  0.00e+00 m   0  715  329 0
 890   2.510   6.395 1 U          5.000e+02  0.00e+00 m   0  352  329 0
 891   1.560   5.996 1 U          4.460e+02  0.00e+00 m   0  694  283 0
 892   1.563   6.571 1 U          3.060e+02  0.00e+00 m   0  694  157 0
 893   3.321   6.395 1 U          3.320e+02  0.00e+00 m   0  723  329 0
 894   4.282   2.037 1 U          9.330e+02  0.00e+00 m   0  761  763 0
 895   3.454   2.037 1 U          4.670e+02  0.00e+00 m   0  770  763 0
 896   3.454   1.630 1 U          8.290e+02  0.00e+00 m   0  770  767 0
 897   4.447   3.571 1 U          6.692e+03  0.00e+00 m   0  729  754 0
 899   4.446   3.323 1 U          5.343e+03  0.00e+00 m   0  729  755 0
 900   4.449   2.058 1 U          2.875e+03  0.00e+00 m   0  729  731 0
 901   4.333   3.457 1 U          1.148e+03  0.00e+00 m   0  761  771 0
 902   6.783   9.216 1 U          4.650e+02  0.00e+00 m   0  330  310 0
 903   6.571   9.216 1 U          3.480e+02  0.00e+00 m   0  284  310 0
 904   6.592   8.758 1 U          6.640e+02  0.00e+00 m   0  307  287 0
 905   6.516   8.758 1 U          1.373e+03  0.00e+00 m   0  306  287 0
 906   6.571   8.381 1 U          6.020e+02  0.00e+00 m   0  157  137 0
 907   2.090   7.000 1 U          5.210e+02  0.00e+00 m   0  566   98 0
 908   1.813   7.000 1 U          7.470e+02  0.00e+00 m   0  562   98 0
 909   1.676   7.000 1 U          4.030e+02  0.00e+00 m   0   74   98 0
 910   1.608   7.000 1 U          1.750e+02  0.00e+00 m   0   75   98 0
 911   1.094   8.146 1 U          1.450e+03  0.00e+00 m   0  452  484 0
# Number of dimensions 2
#INAME 1 H
#INAME 2 H
   2   5.299   7.908 1 U          6.980e+02  0.00e+00 m   0  162  160 0
   3   5.299   9.118 1 U          4.493e+03  0.00e+00 m   0  162  185 0
   4   5.299   8.674 1 U          8.730e+02  0.00e+00 m   0  162  264 0
   7   4.650   9.118 1 U          8.500e+02  0.00e+00 m   0  187  185 0
   8   1.392   9.118 1 U          2.831e+03  0.00e+00 m   0  190  185 0
   9   5.299   5.299 1 U          3.874e+03  0.00e+00 m   0  162  162 0
  11   5.544   9.216 1 U          4.260e+02  0.00e+00 m   0  312  310 0
  12   5.814   8.217 1 U          5.310e+02  0.00e+00 m   0  439  437 0
  13   5.814   9.306 1 U          2.388e+03  0.00e+00 m   0  439  447 0
  14   5.814   7.972 1 U          5.240e+02  0.00e+00 m   0  439  333 0
  15   5.544   7.972 1 U          1.900e+03  0.00e+00 m   0  312  333 0
  16   5.045   9.216 1 U          2.360e+03  0.00e+00 m   0  289  310 0
  17   5.045   8.758 1 U          5.840e+02  0.00e+00 m   0  289  287 0
  18   5.045   8.372 1 U          5.140e+02  0.00e+00 m   0  289  137 0
  19   4.235   7.908 1 U          2.827e+03  0.00e+00 m   0  139  160 0
  20   4.235   8.372 1 U          8.630e+02  0.00e+00 m   0  139  137 0
  21   5.814   5.814 1 U          8.385e+03  0.00e+00 m   0  439  439 0
  22   5.544   5.814 1 U          1.123e+03  0.00e+00 m   0  312  439 0
  23   5.544   5.544 1 U          3.635e+03  0.00e+00 m   0  312  312 0
  24   4.844   5.299 1 U          9.620e+02  0.00e+00 m   0  253  162 0
  25   4.643   8.674 1 U          4.710e+02  0.00e+00 m   0  266  264 0
  26   4.643   8.758 1 U          1.514e+03  0.00e+00 m   0  266  287 0
  27   4.844   8.674 1 U          4.851e+03  0.00e+00 m   0  253  264 0
  28   4.923   8.521 1 U          7.380e+02  0.00e+00 m   0  462  460 0
  29   5.172   8.032 1 U          5.500e+02  0.00e+00 m   0   87   85 0
  30   5.172   9.212 1 U          2.534e+03  0.00e+00 m   0   87  109 0
  31   4.318   9.212 1 U          6.240e+02  0.00e+00 m   0  111  109 0
  32   3.691   9.212 1 U          1.175e+03  0.00e+00 m   0  113  109 0
  33   4.145   9.212 1 U          3.570e+02  0.00e+00 m   0  335  109 0
  34   3.691   8.278 1 U          2.790e+02  0.00e+00 m   0  113  122 0
  35   4.318   8.278 1 U          4.754e+03  0.00e+00 m   0  111  122 0
  36   4.267   8.278 1 U          7.250e+02  0.00e+00 m   0  124  122 0
  37   4.267   8.372 1 U          3.953e+03  0.00e+00 m   0  124  137 0
  38   4.267   9.216 1 U          4.350e+02  0.00e+00 m   0  124  310 0
  39   4.082   9.306 1 U          3.800e+02  0.00e+00 m   0  451  447 0
  40   4.623   9.306 1 U          5.360e+02  0.00e+00 m   0  449  447 0
  41   3.454   9.306 1 U          7.160e+02  0.00e+00 m   0  441  447 0
  42   5.172   8.272 1 U          5.600e+02  0.00e+00 m   0   87  347 0
  43   4.145   8.272 1 U          2.747e+03  0.00e+00 m   0  335  347 0
  44   4.145   7.972 1 U          3.540e+02  0.00e+00 m   0  335  333 0
  45   3.915   8.272 1 U          9.910e+02  0.00e+00 m   0  349  347 0
  46   3.915   8.398 1 U          3.990e+02  0.00e+00 m   0  349  361 0
  47   4.087   8.398 1 U          9.580e+02  0.00e+00 m   0  363  361 0
  48   4.087   7.750 1 U          2.870e+02  0.00e+00 m   0  363  387 0
  49   3.760   7.750 1 U          7.210e+02  0.00e+00 m   0  389  387 0
  50   3.566   7.750 1 U          3.080e+02  0.00e+00 m   0    0  387 0
  51   3.568   7.615 1 U          3.851e+03  0.00e+00 m   0  402  400 0
  52   3.760   7.615 1 U          3.070e+02  0.00e+00 m   0  389  400 0
  53   3.736   7.427 1 U          1.608e+03  0.00e+00 m   0  597  595 0
  54   4.192   7.427 1 U          2.025e+03  0.00e+00 m   0  575  595 0
  55   4.192   7.341 1 U          1.227e+03  0.00e+00 m   0  575  573 0
  56   4.092   6.910 1 U          1.180e+03  0.00e+00 m   0  424  422 0
  57   3.568   6.910 1 U          8.140e+02  0.00e+00 m   0  402  422 0
  58   3.454   5.814 1 U          1.263e+03  0.00e+00 m   0  441  439 0
  59   3.454   8.217 1 U          7.940e+02  0.00e+00 m   0  441  437 0
  60   3.451   8.521 1 U          7.670e+02  0.00e+00 m   0  464  460 0
  61   4.623   8.521 1 U          3.132e+03  0.00e+00 m   0  449  460 0
  62   4.350   7.782 1 U          9.200e+02  0.00e+00 m   0  228  226 0
  63   4.350   8.588 1 U          4.919e+03  0.00e+00 m   0  228  251 0
  64   4.844   8.588 1 U          9.160e+02  0.00e+00 m   0  253  251 0
  65   4.284   8.640 1 U          4.232e+03  0.00e+00 m   0   62   70 0
  66   3.985   8.640 1 U          1.016e+03  0.00e+00 m   0   72   70 0
  67   3.985   8.032 1 U          1.281e+03  0.00e+00 m   0   72   85 0
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 830   1.297   8.167 1 U          1.871e+03  0.00e+00 m   0  676  668 0
 831   0.681   8.167 1 U          2.970e+02  0.00e+00 m   0  677  668 0
 832   0.616   8.167 1 U          3.090e+02  0.00e+00 m   0  678  668 0
 833   4.041   1.367 1 U          4.567e+03  0.00e+00 m   0  670  672 0
 834   4.041   1.301 1 U          7.580e+02  0.00e+00 m   0  670  676 0
 835   4.350   6.588 1 U          4.330e+02  0.00e+00 m   0  228  284 0
 836   2.411   8.497 1 U          1.410e+02  0.00e+00 m   0  521  511 0
 837   2.333   8.497 1 U          1.640e+02  0.00e+00 m   0    0  511 0
 838   1.894   8.497 1 U          2.820e+02  0.00e+00 m   0    0  511 0
 839   1.793   8.497 1 U          5.590e+02  0.00e+00 m   0    0  511 0
 840   1.361   8.497 1 U          2.500e+01  0.00e+00 m   0    0  511 0
 841   8.025   8.233 1 U          1.026e+03  0.00e+00 m   0   42   60 0
 842   4.279   8.032 1 U          9.200e+02  0.00e+00 m   0   62    0 0
 843   1.806   8.027 1 U          5.000e+02  0.00e+00 m   0   78   85 0
 844   4.267   1.650 1 U          1.261e+03  0.00e+00 m   0  124  130 0
 845   1.473   1.148 1 U          1.253e+03  0.00e+00 m   0  164  168 0
 846   2.443   7.803 1 U          1.510e+02  0.00e+00 m   0  213  219 0
 847   7.794   7.883 1 U          1.506e+03  0.00e+00 m   0  219  208 0
 848   8.260   8.398 1 U          8.480e+02  0.00e+00 m   0  347  361 0
 849   4.350   1.736 1 U          1.494e+03  0.00e+00 m   0  228  231 0
 851   1.095   6.656 1 U          4.010e+02  0.00e+00 m   0  235  478 0
 852   1.746   6.893 1 U          4.400e+02  0.00e+00 m   0  231  481 0
 854   2.454   1.094 1 U          1.299e+03  0.00e+00 m   0  238  235 0
 856   1.392   6.656 1 U          1.208e+03  0.00e+00 m   0  190  478 0
 857   1.392   6.892 1 U          1.996e+03  0.00e+00 m   0  190  481 0
 858   1.392   7.161 1 U          5.060e+02  0.00e+00 m   0  190  480 0
 859   1.086   6.518 1 U          1.177e+03  0.00e+00 m   0  578  307 0
 860   1.092   6.471 1 U          4.080e+02  0.00e+00 m   0  578  306 0
 861   1.985   6.395 1 U          4.270e+02  0.00e+00 m   0  719  329 0
 862   1.560   6.395 1 U          3.720e+02  0.00e+00 m   0  694  329 0
 863   1.864   6.395 1 U          2.590e+02  0.00e+00 m   0  404  329 0
 864   1.698   6.398 1 U          7.920e+02  0.00e+00 m   0  656  156 0
 865   1.634   6.398 1 U          4.480e+02  0.00e+00 m   0  657  156 0
 866   1.773   6.398 1 U          2.480e+02  0.00e+00 m   0  661  156 0
 867   0.603   6.398 1 U          7.760e+02  0.00e+00 m   0  704  156 0
 868   0.603   6.571 1 U          5.290e+02  0.00e+00 m   0  704  157 0
 869   0.658   6.571 1 U          1.065e+03  0.00e+00 m   0  695  157 0
 870   4.420   3.374 1 U          3.120e+03  0.00e+00 m   0  638  664 0
 871   4.420   3.545 1 U          5.391e+03  0.00e+00 m   0  638  663 0
 872   4.352   1.985 1 U          2.940e+03  0.00e+00 m   0  713  719 0
 873   3.530   3.364 1 U          5.251e+04  0.00e+00 m   0  738  739 0
 874   4.420   2.085 1 U          3.971e+03  0.00e+00 m   0  638  644 0
 875   3.568   1.635 1 U          2.891e+03  0.00e+00 m   0  722  715 0
 876   3.324   1.635 1 U          2.317e+03  0.00e+00 m   0  723  715 0
 877   3.575   1.985 1 U          5.780e+02  0.00e+00 m   0  722  719 0
 878   3.346   1.985 1 U          5.260e+02  0.00e+00 m   0  723  719 0
 879   1.630   7.159 1 U          1.087e+03  0.00e+00 m   0  767  473 0
 880   2.031   7.161 1 U          3.060e+02  0.00e+00 m   0  747  480 0
 881   1.748   7.161 1 U          3.710e+02  0.00e+00 m   0  751  480 0
 882   1.748   5.992 1 U          3.990e+02  0.00e+00 m   0  751  283 0
 884   1.696   6.588 1 U          3.350e+02  0.00e+00 m   0  752  284 0
 885   1.680   7.161 1 U          3.560e+02  0.00e+00 m   0  752  480 0
 886   1.985   6.794 1 U          3.120e+02  0.00e+00 m   0  719  330 0
 887   1.635   6.794 1 U          2.000e+02  0.00e+00 m   0  715  330 0
 888   1.985   6.395 1 U          4.270e+02  0.00e+00 m   0  719  329 0
 889   1.635   6.395 1 U          5.830e+02  0.00e+00 m   0  715  329 0
 890   2.510   6.395 1 U          5.000e+02  0.00e+00 m   0  352  329 0
 891   1.560   5.996 1 U          4.460e+02  0.00e+00 m   0  694  283 0
 892   1.563   6.571 1 U          3.060e+02  0.00e+00 m   0  694  157 0
 893   3.321   6.395 1 U          3.320e+02  0.00e+00 m   0  723  329 0
 894   4.282   2.037 1 U          9.330e+02  0.00e+00 m   0  761  763 0
 895   3.454   2.037 1 U          4.670e+02  0.00e+00 m   0  770  763 0
 896   3.454   1.630 1 U          8.290e+02  0.00e+00 m   0  770  767 0
 897   4.447   3.571 1 U          6.692e+03  0.00e+00 m   0  729  754 0
 899   4.446   3.323 1 U          5.343e+03  0.00e+00 m   0  729  755 0
 900   4.449   2.058 1 U          2.875e+03  0.00e+00 m   0  729  731 0
 901   4.333   3.457 1 U          1.148e+03  0.00e+00 m   0  761  771 0
 902   6.783   9.216 1 U          4.650e+02  0.00e+00 m   0  330  310 0
 903   6.571   9.216 1 U          3.480e+02  0.00e+00 m   0  284  310 0
 904   6.592   8.758 1 U          6.640e+02  0.00e+00 m   0  307  287 0
 905   6.516   8.758 1 U          1.373e+03  0.00e+00 m   0  306  287 0
 906   6.571   8.381 1 U          6.020e+02  0.00e+00 m   0  157  137 0
 907   2.090   7.000 1 U          5.210e+02  0.00e+00 m   0  566   98 0
 908   1.813   7.000 1 U          7.470e+02  0.00e+00 m   0  562   98 0
 909   1.676   7.000 1 U          4.030e+02  0.00e+00 m   0   74   98 0
 910   1.608   7.000 1 U          1.750e+02  0.00e+00 m   0   75   98 0
 911   1.094   8.146 1 U          1.450e+03  0.00e+00 m   0  452  484 0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1HT      GLY   1 -11.227 -22.876  -9.034
    2    H2   GLY   1           2HT      GLY   1 -11.200 -21.899  -7.652
    3    H3   GLY   1           3HT      GLY   1 -11.404 -23.573  -7.496
    4    HA2  GLY   1           1HA      GLY   1  -9.163 -23.028  -6.909
    5    HA3  GLY   1           2HA      GLY   1  -9.175 -23.924  -8.422
    6    H    ALA   2           H        ALA   2  -9.493 -20.545  -7.334
    7    HA   ALA   2           HA       ALA   2  -7.346 -19.774  -9.152
    8    HB1  ALA   2           1HB      ALA   2 -10.067 -18.475  -9.234
    9    HB2  ALA   2           2HB      ALA   2  -9.414 -19.552 -10.468
   10    HB3  ALA   2           3HB      ALA   2  -8.650 -17.991 -10.168
   11    H    THR   3           H        THR   3  -6.256 -17.954  -8.493
   12    HA   THR   3           HA       THR   3  -6.948 -16.993  -5.817
   13    HB   THR   3           HB       THR   3  -4.653 -17.925  -6.209
   14    HG1  THR   3           1HG      THR   3  -5.193 -16.247  -4.604
   15   HG21  THR   3          3HG2      THR   3  -4.280 -17.137  -8.471
   16   HG22  THR   3          1HG2      THR   3  -3.023 -16.508  -7.404
   17   HG23  THR   3          2HG2      THR   3  -4.346 -15.463  -7.922
   18    H    ALA   4           H        ALA   4  -6.361 -14.598  -5.461
   19    HA   ALA   4           HA       ALA   4  -7.280 -13.037  -7.780
   20    HB1  ALA   4           1HB      ALA   4  -8.539 -11.602  -6.279
   21    HB2  ALA   4           2HB      ALA   4  -8.004 -12.549  -4.890
   22    HB3  ALA   4           3HB      ALA   4  -9.057 -13.277  -6.104
   23    H    VAL   5           H        VAL   5  -6.244 -11.173  -8.226
   24    HA   VAL   5           HA       VAL   5  -4.301 -10.222  -6.254
   25    HB   VAL   5           HB       VAL   5  -2.966 -11.004  -8.010
   26   HG11  VAL   5          1HG1      VAL   5  -3.350 -10.418 -10.349
   27   HG12  VAL   5          2HG1      VAL   5  -4.793  -9.519  -9.869
   28   HG13  VAL   5          3HG1      VAL   5  -4.725 -11.261  -9.639
   29   HG21  VAL   5          3HG2      VAL   5  -3.332  -8.024  -8.304
   30   HG22  VAL   5          1HG2      VAL   5  -1.989  -8.934  -9.001
   31   HG23  VAL   5          2HG2      VAL   5  -2.184  -8.859  -7.250
   32    H    SER   6           H        SER   6  -4.830  -8.421  -5.407
   33    HA   SER   6           HA       SER   6  -6.944  -6.819  -6.528
   34    HG   SER   6           HG       SER   6  -7.189  -8.395  -4.670
   35    HB2  SER   6           2HB      SER   6  -5.518  -6.552  -3.910
   36    HB3  SER   6           1HB      SER   6  -6.974  -5.684  -4.392
   37    H    GLU   7           H        GLU   7  -6.631  -4.350  -5.927
   38    HA   GLU   7           HA       GLU   7  -4.562  -3.482  -7.689
   39    HB2  GLU   7           2HB      GLU   7  -6.562  -2.159  -7.680
   40    HB3  GLU   7           1HB      GLU   7  -6.531  -2.004  -5.930
   41    HG2  GLU   7           2HG      GLU   7  -5.868   0.081  -6.839
   42    HG3  GLU   7           1HG      GLU   7  -4.433  -0.673  -6.154
   43    H    TRP   8           H        TRP   8  -2.601  -3.605  -7.076
   44    HA   TRP   8           HA       TRP   8  -1.852  -2.935  -4.300
   45    HD1  TRP   8           HD       TRP   8  -0.665  -7.131  -6.448
   46    HE1  TRP   8           1HE      TRP   8  -2.202  -8.835  -5.284
   47    HE3  TRP   8           3HE      TRP   8  -2.602  -4.095  -2.887
   48    HZ2  TRP   8           2HZ      TRP   8  -4.044  -8.855  -3.129
   49    HZ3  TRP   8           3HZ      TRP   8  -4.319  -5.007  -1.389
   50    HH2  TRP   8           HH       TRP   8  -5.000  -7.299  -1.451
   51    HB2  TRP   8           2HB      TRP   8  -0.262  -4.603  -6.279
   52    HB3  TRP   8           1HB      TRP   8   0.103  -4.364  -4.584
   53    H    THR   9           H        THR   9  -1.568  -0.707  -4.708
   54    HA   THR   9           HA       THR   9   0.424   0.001  -6.715
   55    HB   THR   9           HB       THR   9  -1.410   1.476  -6.774
   56    HG1  THR   9           1HG      THR   9  -0.505   3.493  -6.417
   57   HG21  THR   9          3HG2      THR   9  -2.183   2.834  -4.873
   58   HG22  THR   9          1HG2      THR   9  -1.029   1.976  -3.847
   59   HG23  THR   9          2HG2      THR   9  -2.378   1.106  -4.580
   60    H    GLU  10           H        GLU  10   1.546   1.978  -5.959
   61    HA   GLU  10           HA       GLU  10   3.176   1.122  -3.628
   62    HB2  GLU  10           2HB      GLU  10   4.063   2.675  -6.035
   63    HB3  GLU  10           1HB      GLU  10   5.062   2.342  -4.641
   64    HG2  GLU  10           2HG      GLU  10   4.650  -0.117  -5.146
   65    HG3  GLU  10           1HG      GLU  10   4.060   0.439  -6.713
   66    H    TYR  11           H        TYR  11   2.507   2.247  -2.032
   67    HA   TYR  11           HA       TYR  11   2.504   5.164  -2.303
   68    HD1  TYR  11           2HD      TYR  11   1.498   6.944  -1.340
   69    HD2  TYR  11           1HD      TYR  11  -1.557   4.174  -2.318
   70    HE1  TYR  11           2HE      TYR  11   0.187   8.783  -2.271
   71    HE2  TYR  11           1HE      TYR  11  -2.898   5.992  -3.300
   72    HH   TYR  11           HH       TYR  11  -3.084   8.497  -3.026
   73    HB2  TYR  11           2HB      TYR  11   0.423   3.403  -1.341
   74    HB3  TYR  11           1HB      TYR  11   0.939   4.501  -0.070
   75    H    LYS  12           H        LYS  12   4.721   4.998  -1.811
   76    HA   LYS  12           HA       LYS  12   5.413   3.796   0.733
   77    HB2  LYS  12           2HB      LYS  12   7.789   4.382  -0.037
   78    HB3  LYS  12           1HB      LYS  12   6.923   3.170  -0.968
   79    HG2  LYS  12           2HG      LYS  12   6.273   5.143  -2.504
   80    HG3  LYS  12           1HG      LYS  12   7.606   5.986  -1.710
   81    HD2  LYS  12           2HD      LYS  12   8.446   4.964  -3.715
   82    HD3  LYS  12           1HD      LYS  12   9.095   4.087  -2.328
   83    HE2  LYS  12           2HE      LYS  12   7.384   2.368  -2.605
   84    HE3  LYS  12           1HE      LYS  12   6.713   3.244  -3.978
   85    HZ1  LYS  12           3HZ      LYS  12   8.843   2.926  -5.133
   86    HZ2  LYS  12           1HZ      LYS  12   8.115   1.445  -4.726
   87    HZ3  LYS  12           2HZ      LYS  12   9.421   2.033  -3.812
   88    H    THR  13           H        THR  13   5.722   4.846   2.518
   89    HA   THR  13           HA       THR  13   5.072   7.658   2.568
   90    HB   THR  13           HB       THR  13   4.908   7.325   5.002
   91    HG1  THR  13           1HG      THR  13   5.930   5.682   5.909
   92   HG21  THR  13          3HG2      THR  13   3.625   5.120   3.419
   93   HG22  THR  13          1HG2      THR  13   2.993   6.752   3.626
   94   HG23  THR  13          2HG2      THR  13   3.116   5.671   5.016
   95    H    ALA  14           H        ALA  14   6.373   8.697   4.687
   96    HA   ALA  14           HA       ALA  14   8.914   9.310   3.548
   97    HB1  ALA  14           1HB      ALA  14   9.146  10.900   5.342
   98    HB2  ALA  14           2HB      ALA  14   7.827  10.138   6.229
   99    HB3  ALA  14           3HB      ALA  14   7.500  10.969   4.709
  100    H    ASP  15           H        ASP  15   8.154   6.626   5.071
  101    HA   ASP  15           HA       ASP  15  10.335   6.444   6.974
  102    HB2  ASP  15           2HB      ASP  15   8.386   4.359   5.966
  103    HB3  ASP  15           1HB      ASP  15   9.564   4.099   7.246
  104    H    GLY  16           H        GLY  16   9.947   6.068   3.634
  105    HA2  GLY  16           2HA      GLY  16  11.451   5.284   2.035
  106    HA3  GLY  16           1HA      GLY  16  12.503   4.741   3.339
  107    H    LYS  17           H        LYS  17   9.312   3.831   3.729
  108    HA   LYS  17           HA       LYS  17   9.934   1.071   2.974
  109    HB2  LYS  17           2HB      LYS  17   9.266   1.398   5.312
  110    HB3  LYS  17           1HB      LYS  17   7.792   2.208   4.798
  111    HG2  LYS  17           2HG      LYS  17   7.302  -0.048   5.490
  112    HG3  LYS  17           1HG      LYS  17   7.028   0.121   3.756
  113    HD2  LYS  17           2HD      LYS  17   9.209  -0.902   3.315
  114    HD3  LYS  17           1HD      LYS  17   9.479  -1.069   5.052
  115    HE2  LYS  17           2HE      LYS  17   8.727  -3.169   4.086
  116    HE3  LYS  17           1HE      LYS  17   7.528  -2.538   5.209
  117    HZ1  LYS  17           3HZ      LYS  17   6.852  -3.435   2.861
  118    HZ2  LYS  17           1HZ      LYS  17   7.258  -1.871   2.368
  119    HZ3  LYS  17           2HZ      LYS  17   6.054  -2.097   3.534
  120    H    THR  18           H        THR  18   8.759   0.041   1.420
  121    HA   THR  18           HA       THR  18   6.940   1.609  -0.175
  122    HB   THR  18           HB       THR  18   7.586  -1.335  -0.440
  123    HG1  THR  18           1HG      THR  18   9.356  -0.785  -1.533
  124   HG21  THR  18          3HG2      THR  18   5.608  -0.609  -1.688
  125   HG22  THR  18          1HG2      THR  18   6.937  -1.009  -2.779
  126   HG23  THR  18          2HG2      THR  18   6.553   0.678  -2.440
  127    H    TYR  19           H        TYR  19   5.107   1.996   0.920
  128    HA   TYR  19           HA       TYR  19   3.672  -0.208   2.173
  129    HD1  TYR  19           1HD      TYR  19   0.985   0.264   2.621
  130    HD2  TYR  19           2HD      TYR  19   2.196   4.326   3.277
  131    HE1  TYR  19           1HE      TYR  19  -1.344   0.906   3.005
  132    HE2  TYR  19           2HE      TYR  19  -0.053   4.915   3.646
  133    HH   TYR  19           HH       TYR  19  -2.307   4.199   3.223
  134    HB2  TYR  19           2HB      TYR  19   3.635   1.565   3.639
  135    HB3  TYR  19           1HB      TYR  19   3.766   2.760   2.370
  136    H    TYR  20           H        TYR  20   1.747  -0.977   1.337
  137    HA   TYR  20           HA       TYR  20   1.189  -0.069  -1.411
  138    HD1  TYR  20           1HD      TYR  20   2.759  -3.352   0.688
  139    HD2  TYR  20           2HD      TYR  20   1.844  -2.370  -3.389
  140    HE1  TYR  20           1HE      TYR  20   4.821  -4.415  -0.055
  141    HE2  TYR  20           2HE      TYR  20   3.928  -3.443  -4.105
  142    HH   TYR  20           HH       TYR  20   6.105  -4.030  -3.195
  143    HB2  TYR  20           2HB      TYR  20   0.395  -2.699  -0.112
  144    HB3  TYR  20           1HB      TYR  20   0.150  -2.241  -1.779
  145    H    TYR  21           H        TYR  21  -0.808   0.734  -1.901
  146    HA   TYR  21           HA       TYR  21  -2.826   0.513   0.243
  147    HD1  TYR  21           1HD      TYR  21  -5.161   2.144  -2.285
  148    HD2  TYR  21           2HD      TYR  21  -3.741   3.503   1.522
  149    HE1  TYR  21           1HE      TYR  21  -7.435   2.811  -1.663
  150    HE2  TYR  21           2HE      TYR  21  -6.028   4.144   2.129
  151    HH   TYR  21           HH       TYR  21  -8.142   4.768   0.996
  152    HB2  TYR  21           2HB      TYR  21  -2.167   2.873  -0.188
  153    HB3  TYR  21           1HB      TYR  21  -2.696   2.692  -1.858
  154    H    ASN  22           H        ASN  22  -4.270  -0.818  -0.168
  155    HA   ASN  22           HA       ASN  22  -4.524  -1.962  -2.813
  156    HB2  ASN  22           2HB      ASN  22  -4.225  -3.486  -1.001
  157    HB3  ASN  22           1HB      ASN  22  -5.485  -2.707  -0.052
  158   HD21  ASN  22          1HD2      ASN  22  -5.731  -3.464  -3.469
  159   HD22  ASN  22          2HD2      ASN  22  -6.965  -4.662  -3.286
  160    H    ASN  23           H        ASN  23  -6.197  -1.508  -4.136
  161    HA   ASN  23           HA       ASN  23  -8.519  -0.152  -3.001
  162    HB2  ASN  23           2HB      ASN  23  -7.368   0.568  -5.189
  163    HB3  ASN  23           1HB      ASN  23  -8.146  -0.826  -5.915
  164   HD21  ASN  23          1HD2      ASN  23  -8.523   1.930  -6.563
  165   HD22  ASN  23          2HD2      ASN  23 -10.188   2.302  -6.292
  166    H    ARG  24           H        ARG  24  -8.441  -2.630  -1.977
  167    HA   ARG  24           HA       ARG  24  -9.927  -4.531  -3.531
  168    HE   ARG  24           HE       ARG  24  -9.079  -5.812   1.004
  169    HB2  ARG  24           2HB      ARG  24  -8.477  -5.275  -1.699
  170    HB3  ARG  24           1HB      ARG  24  -9.495  -4.427  -0.548
  171    HG2  ARG  24           2HG      ARG  24 -11.311  -5.909  -0.927
  172    HG3  ARG  24           1HG      ARG  24 -10.502  -6.644  -2.310
  173    HD2  ARG  24           2HD      ARG  24 -10.398  -8.075  -0.325
  174    HD3  ARG  24           1HD      ARG  24  -8.795  -7.568  -0.849
  175   HH11  ARG  24          1HH1      ARG  24 -10.414  -9.046   1.122
  176   HH12  ARG  24          2HH1      ARG  24 -10.318  -9.161   2.852
  177   HH21  ARG  24          1HH2      ARG  24  -8.941  -5.977   3.307
  178   HH22  ARG  24          2HH2      ARG  24  -9.489  -7.437   4.074
  179    H    THR  25           H        THR  25 -11.059  -3.801  -0.345
  180    HA   THR  25           HA       THR  25 -13.430  -2.432  -1.354
  181    HB   THR  25           HB       THR  25 -13.889  -4.288   0.169
  182    HG1  THR  25           1HG      THR  25 -14.419  -1.647   1.030
  183   HG21  THR  25          3HG2      THR  25 -13.132  -4.160   2.489
  184   HG22  THR  25          1HG2      THR  25 -12.220  -2.707   2.086
  185   HG23  THR  25          2HG2      THR  25 -11.790  -4.245   1.347
  186    H    LEU  26           H        LEU  26 -10.771  -1.348  -1.359
  187    HA   LEU  26           HA       LEU  26  -9.482   0.393  -0.756
  188    HG   LEU  26           HG       LEU  26 -12.268   1.549  -1.432
  189    HB2  LEU  26           2HB      LEU  26 -11.835   1.216   0.944
  190    HB3  LEU  26           1HB      LEU  26 -10.350   2.140   0.823
  191   HD11  LEU  26          1HD1      LEU  26 -12.668   3.955  -1.407
  192   HD12  LEU  26          2HD1      LEU  26 -11.589   4.126  -0.023
  193   HD13  LEU  26          3HD1      LEU  26 -13.092   3.218   0.139
  194   HD21  LEU  26          3HD2      LEU  26 -10.837   3.047  -2.756
  195   HD22  LEU  26          1HD2      LEU  26  -9.998   1.574  -2.268
  196   HD23  LEU  26          2HD2      LEU  26  -9.678   3.094  -1.429
  197    H    GLU  27           H        GLU  27  -7.857  -0.606   0.136
  198    HA   GLU  27           HA       GLU  27  -7.935  -1.306   2.992
  199    HB2  GLU  27           2HB      GLU  27  -8.364  -3.352   1.586
  200    HB3  GLU  27           1HB      GLU  27  -6.824  -3.076   0.794
  201    HG2  GLU  27           2HG      GLU  27  -6.550  -4.772   2.448
  202    HG3  GLU  27           1HG      GLU  27  -5.700  -3.316   2.984
  203    H    SER  28           H        SER  28  -5.850  -1.337   3.978
  204    HA   SER  28           HA       SER  28  -3.688  -0.308   2.276
  205    HG   SER  28           HG       SER  28  -4.990   1.458   3.041
  206    HB2  SER  28           2HB      SER  28  -4.160   0.202   5.205
  207    HB3  SER  28           1HB      SER  28  -2.734   0.709   4.334
  208    H    THR  29           H        THR  29  -1.647  -1.184   2.526
  209    HA   THR  29           HA       THR  29  -1.331  -3.501   4.285
  210    HB   THR  29           HB       THR  29  -0.021  -4.495   2.239
  211    HG1  THR  29           1HG      THR  29  -0.887  -2.355   1.110
  212   HG21  THR  29          3HG2      THR  29  -3.010  -4.461   2.468
  213   HG22  THR  29          1HG2      THR  29  -1.892  -5.598   3.226
  214   HG23  THR  29          2HG2      THR  29  -2.109  -5.606   1.466
  215    H    TRP  30           H        TRP  30   0.558  -3.456   5.327
  216    HA   TRP  30           HA       TRP  30   2.325  -1.247   4.887
  217    HD1  TRP  30           HD       TRP  30   0.644  -1.750   8.411
  218    HE1  TRP  30           1HE      TRP  30   1.038   0.562   9.471
  219    HE3  TRP  30           3HE      TRP  30   5.074  -0.573   6.139
  220    HZ2  TRP  30           2HZ      TRP  30   2.954   2.649   9.301
  221    HZ3  TRP  30           3HZ      TRP  30   6.124   1.586   6.648
  222    HH2  TRP  30           HH       TRP  30   5.094   3.157   8.207
  223    HB2  TRP  30           2HB      TRP  30   2.049  -3.344   6.932
  224    HB3  TRP  30           1HB      TRP  30   3.719  -2.879   6.607
  225    H    GLU  31           H        GLU  31   2.739  -4.763   4.666
  226    HA   GLU  31           HA       GLU  31   4.995  -4.248   2.862
  227    HB2  GLU  31           2HB      GLU  31   4.552  -6.185   4.967
  228    HB3  GLU  31           1HB      GLU  31   5.039  -6.924   3.442
  229    HG2  GLU  31           2HG      GLU  31   6.481  -4.555   4.492
  230    HG3  GLU  31           1HG      GLU  31   6.851  -6.166   5.126
  231    H    LYS  32           H        LYS  32   5.297  -6.518   1.600
  232    HA   LYS  32           HA       LYS  32   3.602  -6.416  -0.571
  233    HB2  LYS  32           2HB      LYS  32   5.277  -8.747   0.383
  234    HB3  LYS  32           1HB      LYS  32   4.635  -8.553  -1.242
  235    HG2  LYS  32           2HG      LYS  32   5.970  -6.512  -1.511
  236    HG3  LYS  32           1HG      LYS  32   6.635  -6.749   0.102
  237    HD2  LYS  32           2HD      LYS  32   6.884  -8.789  -2.095
  238    HD3  LYS  32           1HD      LYS  32   8.077  -7.523  -1.822
  239    HE2  LYS  32           2HE      LYS  32   7.228  -9.568   0.222
  240    HE3  LYS  32           1HE      LYS  32   8.673  -9.690  -0.780
  241    HZ1  LYS  32           3HZ      LYS  32   9.472  -8.788   1.170
  242    HZ2  LYS  32           1HZ      LYS  32   8.103  -7.816   1.431
  243    HZ3  LYS  32           2HZ      LYS  32   9.221  -7.399   0.233
  244    HA   PRO  33           HA       PRO  33  -0.191  -7.953   1.187
  245    HB2  PRO  33           2HB      PRO  33  -0.625  -8.346  -1.750
  246    HB3  PRO  33           1HB      PRO  33  -1.704  -7.632  -0.549
  247    HG2  PRO  33           2HG      PRO  33  -0.357  -6.068  -2.189
  248    HG3  PRO  33           1HG      PRO  33  -0.506  -5.634  -0.474
  249    HD2  PRO  33           2HD      PRO  33   1.825  -6.765  -1.950
  250    HD3  PRO  33           1HD      PRO  33   1.793  -5.593  -0.617
  251    H    GLN  34           H        GLN  34  -1.207  -9.917   1.496
  252    HA   GLN  34           HA       GLN  34   0.291 -12.285   1.094
  253    HB2  GLN  34           2HB      GLN  34  -2.649 -11.997   1.757
  254    HB3  GLN  34           1HB      GLN  34  -1.687 -13.455   1.952
  255    HG2  GLN  34           2HG      GLN  34  -1.165 -10.865   3.386
  256    HG3  GLN  34           1HG      GLN  34  -2.073 -12.218   4.056
  257   HE21  GLN  34          1HE2      GLN  34   1.066 -11.079   3.074
  258   HE22  GLN  34          2HE2      GLN  34   1.979 -12.306   3.873
  259    H    GLU  35           H        GLU  35  -1.997 -10.599  -0.821
  260    HA   GLU  35           HA       GLU  35  -2.258 -12.827  -2.700
  261    HB2  GLU  35           2HB      GLU  35  -3.753 -10.217  -2.446
  262    HB3  GLU  35           1HB      GLU  35  -3.978 -11.335  -3.783
  263    HG2  GLU  35           2HG      GLU  35  -4.390 -12.074  -0.900
  264    HG3  GLU  35           1HG      GLU  35  -5.673 -11.489  -1.957
  265    H    LEU  36           H        LEU  36  -0.004 -10.665  -2.180
  266    HA   LEU  36           HA       LEU  36   0.328  -9.494  -4.785
  267    HG   LEU  36           HG       LEU  36   3.245  -7.715  -3.513
  268    HB2  LEU  36           2HB      LEU  36   1.329  -8.716  -2.548
  269    HB3  LEU  36           1HB      LEU  36   2.557  -9.911  -2.854
  270   HD11  LEU  36          1HD1      LEU  36   4.095  -9.590  -4.726
  271   HD12  LEU  36          2HD1      LEU  36   3.970  -8.164  -5.756
  272   HD13  LEU  36          3HD1      LEU  36   2.766  -9.445  -5.870
  273   HD21  LEU  36          3HD2      LEU  36   2.228  -6.455  -5.282
  274   HD22  LEU  36          1HD2      LEU  36   1.061  -6.731  -3.987
  275   HD23  LEU  36          2HD2      LEU  36   0.981  -7.691  -5.473
  276    H    LYS  37           H        LYS  37   0.332 -11.002  -6.328
  277    HA   LYS  37           HA       LYS  37   2.534 -12.890  -6.434
  278    HB2  LYS  37           2HB      LYS  37  -0.333 -13.823  -6.729
  279    HB3  LYS  37           1HB      LYS  37   1.104 -14.807  -6.946
  280    HG2  LYS  37           2HG      LYS  37   1.663 -14.383  -4.556
  281    HG3  LYS  37           1HG      LYS  37   0.089 -13.605  -4.387
  282    HD2  LYS  37           2HD      LYS  37   0.540 -16.449  -5.290
  283    HD3  LYS  37           1HD      LYS  37   0.075 -15.971  -3.657
  284    HE2  LYS  37           2HE      LYS  37  -1.528 -15.409  -6.149
  285    HE3  LYS  37           1HE      LYS  37  -1.826 -16.754  -5.049
  286    HZ1  LYS  37           3HZ      LYS  37  -2.220 -15.118  -3.278
  287    HZ2  LYS  37           1HZ      LYS  37  -3.304 -14.945  -4.568
  288    HZ3  LYS  37           2HZ      LYS  37  -2.012 -13.871  -4.399
  289    H1   GLY 101           1HT      GLY 101  -1.232  19.509  -8.671
  290    H2   GLY 101           2HT      GLY 101  -2.175  18.206  -8.132
  291    H3   GLY 101           3HT      GLY 101  -1.033  17.974  -9.363
  292    HA2  GLY 101           1HA      GLY 101   0.772  18.445  -7.841
  293    HA3  GLY 101           2HA      GLY 101  -0.402  18.736  -6.562
  294    HA   PRO 102           HA       PRO 102   0.699  14.149  -6.782
  295    HB2  PRO 102           2HB      PRO 102   2.449  14.407  -4.509
  296    HB3  PRO 102           1HB      PRO 102   2.853  13.875  -6.138
  297    HG2  PRO 102           2HG      PRO 102   3.744  16.220  -5.014
  298    HG3  PRO 102           1HG      PRO 102   3.601  15.936  -6.758
  299    HD2  PRO 102           2HD      PRO 102   1.769  17.417  -4.918
  300    HD3  PRO 102           1HD      PRO 102   2.230  17.791  -6.594
  301    HA   PRO 103           HA       PRO 103  -2.121  13.674  -3.364
  302    HB2  PRO 103           2HB      PRO 103  -2.234  10.979  -3.271
  303    HB3  PRO 103           1HB      PRO 103  -2.980  11.908  -4.572
  304    HG2  PRO 103           2HG      PRO 103  -0.399  10.405  -4.554
  305    HG3  PRO 103           1HG      PRO 103  -1.614  10.534  -5.839
  306    HD2  PRO 103           2HD      PRO 103   0.725  11.976  -5.764
  307    HD3  PRO 103           1HD      PRO 103  -0.740  12.492  -6.624
  308    H    LEU 104           H        LEU 104  -2.024  13.368  -1.152
  309    HA   LEU 104           HA       LEU 104   0.508  12.655   0.032
  310    HG   LEU 104           HG       LEU 104  -1.034  15.311   2.178
  311    HB2  LEU 104           2HB      LEU 104  -2.172  13.251   1.306
  312    HB3  LEU 104           1HB      LEU 104  -0.687  12.984   2.195
  313   HD11  LEU 104          1HD1      LEU 104   0.862  16.192   0.885
  314   HD12  LEU 104          2HD1      LEU 104   0.981  14.643   0.049
  315   HD13  LEU 104          3HD1      LEU 104   1.263  14.731   1.787
  316   HD21  LEU 104          3HD2      LEU 104  -1.459  15.146  -0.801
  317   HD22  LEU 104          1HD2      LEU 104  -1.377  16.637   0.140
  318   HD23  LEU 104          2HD2      LEU 104  -2.685  15.487   0.419
  319    H    ILE 105           H        ILE 105   0.896  10.777   1.295
  320    HA   ILE 105           HA       ILE 105  -0.739   8.526   0.534
  321    HB   ILE 105           HB       ILE 105   1.492   8.264   2.583
  322   HG12  ILE 105          2HG1      ILE 105   2.919   7.725   0.469
  323   HG13  ILE 105          1HG1      ILE 105   1.728   8.673  -0.395
  324   HG21  ILE 105          1HG2      ILE 105   1.731   6.077   1.641
  325   HG22  ILE 105          2HG2      ILE 105   0.476   6.426   0.452
  326   HG23  ILE 105          3HG2      ILE 105   0.069   6.352   2.166
  327   HD11  ILE 105          3HD1      ILE 105   3.882   9.808   0.350
  328   HD12  ILE 105          1HD1      ILE 105   3.145   9.830   1.954
  329   HD13  ILE 105          2HD1      ILE 105   2.340  10.631   0.595
  330    HA   PRO 106           HA       PRO 106  -3.064   8.382   4.424
  331    HB2  PRO 106           2HB      PRO 106  -3.811   5.766   4.230
  332    HB3  PRO 106           1HB      PRO 106  -4.621   7.010   3.289
  333    HG2  PRO 106           2HG      PRO 106  -2.474   5.123   2.458
  334    HG3  PRO 106           1HG      PRO 106  -3.941   5.605   1.587
  335    HD2  PRO 106           2HD      PRO 106  -1.526   6.653   1.016
  336    HD3  PRO 106           1HD      PRO 106  -3.019   7.605   0.889
  337    HA   PRO 107           HA       PRO 107   0.233   6.170   6.571
  338    HB2  PRO 107           2HB      PRO 107  -1.321   6.006   9.012
  339    HB3  PRO 107           1HB      PRO 107   0.084   7.017   8.682
  340    HG2  PRO 107           2HG      PRO 107  -2.455   7.998   9.047
  341    HG3  PRO 107           1HG      PRO 107  -1.192   8.831   8.125
  342    HD2  PRO 107           2HD      PRO 107  -3.511   7.224   7.142
  343    HD3  PRO 107           1HD      PRO 107  -2.779   8.690   6.454
  344    HA   PRO 108           HA       PRO 108  -1.628   2.141   6.284
  345    HB2  PRO 108           2HB      PRO 108   0.764   0.804   7.043
  346    HB3  PRO 108           1HB      PRO 108   0.142   1.066   5.409
  347    HG2  PRO 108           2HG      PRO 108   2.436   2.220   6.478
  348    HG3  PRO 108           1HG      PRO 108   1.563   2.768   5.033
  349    HD2  PRO 108           2HD      PRO 108   1.551   3.888   7.783
  350    HD3  PRO 108           1HD      PRO 108   1.377   4.677   6.193
  351    HA   PRO 109           HA       PRO 109  -2.570   0.889  10.448
  352    HB2  PRO 109           2HB      PRO 109  -3.870  -1.405   9.807
  353    HB3  PRO 109           1HB      PRO 109  -4.582   0.191   9.558
  354    HG2  PRO 109           2HG      PRO 109  -3.269  -1.620   7.568
  355    HG3  PRO 109           1HG      PRO 109  -4.716  -0.617   7.389
  356    HD2  PRO 109           2HD      PRO 109  -2.250   0.061   6.457
  357    HD3  PRO 109           1HD      PRO 109  -3.498   1.241   6.900
  Start of MODEL    2
    1    H1   GLY   1           1HT      GLY   1  -7.252 -10.708   0.816
    2    H2   GLY   1           2HT      GLY   1  -8.367 -11.979   0.696
    3    H3   GLY   1           3HT      GLY   1  -7.435 -11.537  -0.652
    4    HA2  GLY   1           1HA      GLY   1  -5.434 -12.278   0.396
    5    HA3  GLY   1           2HA      GLY   1  -6.323 -12.620   1.874
    6    H    ALA   2           H        ALA   2  -7.277 -13.285  -1.480
    7    HA   ALA   2           HA       ALA   2  -6.756 -16.041  -1.460
    8    HB1  ALA   2           1HB      ALA   2  -8.408 -16.105   0.358
    9    HB2  ALA   2           2HB      ALA   2  -8.974 -16.974  -1.069
   10    HB3  ALA   2           3HB      ALA   2  -9.605 -15.367  -0.706
   11    H    THR   3           H        THR   3  -6.220 -15.656  -3.582
   12    HA   THR   3           HA       THR   3  -6.629 -16.039  -5.786
   13    HB   THR   3           HB       THR   3  -9.533 -15.966  -4.958
   14    HG1  THR   3           1HG      THR   3  -8.440 -18.283  -5.968
   15   HG21  THR   3          3HG2      THR   3  -9.363 -15.304  -7.304
   16   HG22  THR   3          1HG2      THR   3 -10.030 -16.930  -7.162
   17   HG23  THR   3          2HG2      THR   3  -8.345 -16.707  -7.637
   18    H    ALA   4           H        ALA   4  -6.524 -14.753  -7.482
   19    HA   ALA   4           HA       ALA   4  -6.776 -13.025  -8.911
   20    HB1  ALA   4           1HB      ALA   4  -8.642 -11.495  -8.743
   21    HB2  ALA   4           2HB      ALA   4  -8.974 -12.047  -7.100
   22    HB3  ALA   4           3HB      ALA   4  -9.177 -13.152  -8.458
   23    H    VAL   5           H        VAL   5  -5.521 -11.334  -9.192
   24    HA   VAL   5           HA       VAL   5  -4.227 -10.141  -6.911
   25    HB   VAL   5           HB       VAL   5  -3.934  -9.393  -9.818
   26   HG11  VAL   5          1HG1      VAL   5  -2.098  -8.945  -7.465
   27   HG12  VAL   5          2HG1      VAL   5  -3.062  -7.718  -8.292
   28   HG13  VAL   5          3HG1      VAL   5  -1.747  -8.526  -9.146
   29   HG21  VAL   5          3HG2      VAL   5  -2.371 -11.414  -8.223
   30   HG22  VAL   5          1HG2      VAL   5  -1.973 -10.868  -9.851
   31   HG23  VAL   5          2HG2      VAL   5  -3.468 -11.758  -9.560
   32    H    SER   6           H        SER   6  -4.801  -8.327  -5.947
   33    HA   SER   6           HA       SER   6  -7.014  -6.761  -6.864
   34    HG   SER   6           HG       SER   6  -6.373  -7.595  -3.408
   35    HB2  SER   6           2HB      SER   6  -5.224  -6.217  -4.541
   36    HB3  SER   6           1HB      SER   6  -6.837  -5.558  -4.823
   37    H    GLU   7           H        GLU   7  -6.872  -4.372  -6.843
   38    HA   GLU   7           HA       GLU   7  -4.727  -3.557  -8.533
   39    HB2  GLU   7           2HB      GLU   7  -6.695  -1.797  -7.056
   40    HB3  GLU   7           1HB      GLU   7  -5.723  -1.349  -8.451
   41    HG2  GLU   7           2HG      GLU   7  -7.996  -3.318  -8.384
   42    HG3  GLU   7           1HG      GLU   7  -8.005  -1.716  -9.120
   43    H    TRP   8           H        TRP   8  -2.850  -3.386  -7.789
   44    HA   TRP   8           HA       TRP   8  -2.396  -2.718  -4.949
   45    HD1  TRP   8           HD       TRP   8  -0.849  -6.903  -6.750
   46    HE1  TRP   8           1HE      TRP   8  -2.196  -8.553  -5.307
   47    HE3  TRP   8           3HE      TRP   8  -2.928  -3.583  -3.585
   48    HZ2  TRP   8           2HZ      TRP   8  -3.979  -8.411  -3.075
   49    HZ3  TRP   8           3HZ      TRP   8  -4.504  -4.370  -1.901
   50    HH2  TRP   8           HH       TRP   8  -5.001  -6.696  -1.583
   51    HB2  TRP   8           2HB      TRP   8  -0.729  -4.310  -6.944
   52    HB3  TRP   8           1HB      TRP   8  -0.196  -3.917  -5.320
   53    H    THR   9           H        THR   9  -1.678  -0.661  -4.735
   54    HA   THR   9           HA       THR   9   0.151   0.391  -6.773
   55    HB   THR   9           HB       THR   9  -1.332   2.063  -6.696
   56    HG1  THR   9           1HG      THR   9   0.469   2.664  -4.652
   57   HG21  THR   9          3HG2      THR   9  -2.688   2.767  -4.774
   58   HG22  THR   9          1HG2      THR   9  -1.815   1.627  -3.744
   59   HG23  THR   9          2HG2      THR   9  -2.855   1.034  -5.047
   60    H    GLU  10           H        GLU  10   1.670   1.899  -6.036
   61    HA   GLU  10           HA       GLU  10   3.009   0.981  -3.573
   62    HB2  GLU  10           2HB      GLU  10   5.114   1.740  -4.580
   63    HB3  GLU  10           1HB      GLU  10   4.306   0.516  -5.545
   64    HG2  GLU  10           2HG      GLU  10   3.491   2.218  -7.070
   65    HG3  GLU  10           1HG      GLU  10   4.276   3.466  -6.102
   66    H    TYR  11           H        TYR  11   2.637   2.299  -1.993
   67    HA   TYR  11           HA       TYR  11   2.702   5.199  -2.515
   68    HD1  TYR  11           2HD      TYR  11   1.891   7.089  -1.146
   69    HD2  TYR  11           1HD      TYR  11  -1.351   4.809  -2.683
   70    HE1  TYR  11           2HE      TYR  11   0.827   9.155  -1.929
   71    HE2  TYR  11           1HE      TYR  11  -2.427   6.860  -3.483
   72    HH   TYR  11           HH       TYR  11  -2.371   9.336  -2.878
   73    HB2  TYR  11           2HB      TYR  11   0.439   3.699  -1.737
   74    HB3  TYR  11           1HB      TYR  11   0.982   4.543  -0.289
   75    H    LYS  12           H        LYS  12   4.691   5.562  -1.683
   76    HA   LYS  12           HA       LYS  12   5.453   4.196   0.768
   77    HB2  LYS  12           2HB      LYS  12   7.177   6.021  -0.922
   78    HB3  LYS  12           1HB      LYS  12   7.702   4.799   0.230
   79    HG2  LYS  12           2HG      LYS  12   6.930   3.040  -1.200
   80    HG3  LYS  12           1HG      LYS  12   6.232   4.206  -2.322
   81    HD2  LYS  12           2HD      LYS  12   8.551   5.128  -2.632
   82    HD3  LYS  12           1HD      LYS  12   9.140   3.738  -1.720
   83    HE2  LYS  12           2HE      LYS  12   8.029   2.251  -3.367
   84    HE3  LYS  12           1HE      LYS  12   7.594   3.674  -4.309
   85    HZ1  LYS  12           3HZ      LYS  12   9.571   2.678  -5.202
   86    HZ2  LYS  12           1HZ      LYS  12  10.344   2.736  -3.694
   87    HZ3  LYS  12           2HZ      LYS  12   9.980   4.176  -4.515
   88    H    THR  13           H        THR  13   5.430   5.124   2.684
   89    HA   THR  13           HA       THR  13   4.358   7.762   2.950
   90    HB   THR  13           HB       THR  13   4.436   7.307   5.372
   91    HG1  THR  13           1HG      THR  13   5.791   5.852   6.141
   92   HG21  THR  13          3HG2      THR  13   2.979   5.335   5.397
   93   HG22  THR  13          1HG2      THR  13   3.470   4.964   3.745
   94   HG23  THR  13          2HG2      THR  13   2.562   6.435   4.082
   95    H    ALA  14           H        ALA  14   5.470   9.039   4.937
   96    HA   ALA  14           HA       ALA  14   7.772  10.231   3.858
   97    HB1  ALA  14           1HB      ALA  14   6.192  11.395   5.329
   98    HB2  ALA  14           2HB      ALA  14   7.857  11.541   5.893
   99    HB3  ALA  14           3HB      ALA  14   6.751  10.419   6.688
  100    H    ASP  15           H        ASP  15   7.430   7.423   5.721
  101    HA   ASP  15           HA       ASP  15   9.917   7.337   7.061
  102    HB2  ASP  15           2HB      ASP  15   8.263   5.052   5.965
  103    HB3  ASP  15           1HB      ASP  15   9.555   4.908   7.147
  104    H    GLY  16           H        GLY  16   8.995   6.880   3.754
  105    HA2  GLY  16           2HA      GLY  16  10.276   6.317   1.897
  106    HA3  GLY  16           1HA      GLY  16  11.666   6.104   2.954
  107    H    LYS  17           H        LYS  17   8.735   4.553   3.816
  108    HA   LYS  17           HA       LYS  17   9.884   1.934   3.196
  109    HB2  LYS  17           2HB      LYS  17   7.495   2.717   4.887
  110    HB3  LYS  17           1HB      LYS  17   8.034   1.067   4.626
  111    HG2  LYS  17           2HG      LYS  17  10.133   1.553   5.754
  112    HG3  LYS  17           1HG      LYS  17   9.630   3.227   5.992
  113    HD2  LYS  17           2HD      LYS  17   7.781   2.518   7.383
  114    HD3  LYS  17           1HD      LYS  17   8.151   0.824   7.063
  115    HE2  LYS  17           2HE      LYS  17   8.984   1.367   9.236
  116    HE3  LYS  17           1HE      LYS  17  10.363   1.170   8.160
  117    HZ1  LYS  17           3HZ      LYS  17  10.653   3.512   8.046
  118    HZ2  LYS  17           1HZ      LYS  17  10.503   3.100   9.686
  119    HZ3  LYS  17           2HZ      LYS  17   9.195   3.807   8.867
  120    H    THR  18           H        THR  18   8.716   0.382   1.995
  121    HA   THR  18           HA       THR  18   7.017   1.589  -0.020
  122    HB   THR  18           HB       THR  18   7.891  -1.297   0.175
  123    HG1  THR  18           1HG      THR  18   9.704   0.132   0.141
  124   HG21  THR  18          3HG2      THR  18   7.009   0.387  -2.174
  125   HG22  THR  18          1HG2      THR  18   6.048  -0.868  -1.389
  126   HG23  THR  18          2HG2      THR  18   7.529  -1.296  -2.247
  127    H    TYR  19           H        TYR  19   5.085   2.001   0.925
  128    HA   TYR  19           HA       TYR  19   3.644  -0.169   2.230
  129    HD1  TYR  19           2HD      TYR  19   0.895   0.274   2.432
  130    HD2  TYR  19           1HD      TYR  19   2.044   4.340   3.073
  131    HE1  TYR  19           2HE      TYR  19  -1.452   0.921   2.591
  132    HE2  TYR  19           1HE      TYR  19  -0.245   4.940   3.222
  133    HH   TYR  19           HH       TYR  19  -2.445   4.204   2.578
  134    HB2  TYR  19           2HB      TYR  19   3.454   1.618   3.627
  135    HB3  TYR  19           1HB      TYR  19   3.675   2.786   2.344
  136    H    TYR  20           H        TYR  20   1.749  -1.003   1.439
  137    HA   TYR  20           HA       TYR  20   1.261  -0.545  -1.376
  138    HD1  TYR  20           1HD      TYR  20   1.475  -2.662  -3.085
  139    HD2  TYR  20           2HD      TYR  20   3.096  -3.658   0.731
  140    HE1  TYR  20           1HE      TYR  20   3.387  -3.746  -4.183
  141    HE2  TYR  20           2HE      TYR  20   5.015  -4.742  -0.358
  142    HH   TYR  20           HH       TYR  20   5.572  -5.752  -2.558
  143    HB2  TYR  20           2HB      TYR  20   0.977  -2.769   0.609
  144    HB3  TYR  20           1HB      TYR  20   0.079  -2.801  -0.864
  145    H    TYR  21           H        TYR  21  -0.733   0.234  -2.017
  146    HA   TYR  21           HA       TYR  21  -2.829   0.313   0.049
  147    HD1  TYR  21           1HD      TYR  21  -5.102   1.666  -2.603
  148    HD2  TYR  21           2HD      TYR  21  -3.531   3.510   0.915
  149    HE1  TYR  21           1HE      TYR  21  -7.346   2.484  -2.023
  150    HE2  TYR  21           2HE      TYR  21  -5.772   4.318   1.486
  151    HH   TYR  21           HH       TYR  21  -8.570   3.154   0.067
  152    HB2  TYR  21           2HB      TYR  21  -2.029   2.579  -0.733
  153    HB3  TYR  21           1HB      TYR  21  -2.632   2.172  -2.337
  154    H    ASN  22           H        ASN  22  -4.541  -0.813  -0.284
  155    HA   ASN  22           HA       ASN  22  -4.674  -2.485  -2.672
  156    HB2  ASN  22           2HB      ASN  22  -4.692  -3.606  -0.524
  157    HB3  ASN  22           1HB      ASN  22  -5.998  -2.583   0.060
  158   HD21  ASN  22          1HD2      ASN  22  -7.163  -4.496   0.558
  159   HD22  ASN  22          2HD2      ASN  22  -7.970  -5.384  -0.684
  160    H    ASN  23           H        ASN  23  -6.093  -2.054  -4.249
  161    HA   ASN  23           HA       ASN  23  -8.430  -0.379  -3.642
  162    HB2  ASN  23           2HB      ASN  23  -7.131  -1.136  -6.259
  163    HB3  ASN  23           1HB      ASN  23  -8.684  -0.324  -6.175
  164   HD21  ASN  23          1HD2      ASN  23  -5.953   0.292  -4.044
  165   HD22  ASN  23          2HD2      ASN  23  -5.655   1.897  -4.601
  166    H    ARG  24           H        ARG  24  -7.980  -3.415  -3.173
  167    HA   ARG  24           HA       ARG  24  -9.790  -4.857  -4.731
  168    HE   ARG  24           HE       ARG  24 -11.151  -9.243  -3.825
  169    HB2  ARG  24           2HB      ARG  24  -8.224  -5.852  -3.065
  170    HB3  ARG  24           1HB      ARG  24  -9.271  -5.268  -1.785
  171    HG2  ARG  24           2HG      ARG  24  -9.798  -7.541  -2.050
  172    HG3  ARG  24           1HG      ARG  24 -11.112  -6.658  -2.833
  173    HD2  ARG  24           2HD      ARG  24 -10.339  -7.184  -4.979
  174    HD3  ARG  24           1HD      ARG  24  -8.737  -7.626  -4.388
  175   HH11  ARG  24          1HH1      ARG  24  -7.780  -8.968  -4.756
  176   HH12  ARG  24          2HH1      ARG  24  -7.543 -10.685  -4.895
  177   HH21  ARG  24          1HH2      ARG  24 -10.831 -11.498  -3.983
  178   HH22  ARG  24          2HH2      ARG  24  -9.283 -12.125  -4.472
  179    H    THR  25           H        THR  25 -10.653  -4.480  -1.379
  180    HA   THR  25           HA       THR  25 -13.180  -3.168  -2.074
  181    HB   THR  25           HB       THR  25 -13.701  -3.694   0.382
  182    HG1  THR  25           1HG      THR  25 -12.140  -4.589   1.482
  183   HG21  THR  25          3HG2      THR  25 -14.288  -6.023  -0.116
  184   HG22  THR  25          1HG2      THR  25 -13.211  -5.996  -1.514
  185   HG23  THR  25          2HG2      THR  25 -14.647  -4.973  -1.487
  186    H    LEU  26           H        LEU  26 -10.406  -2.018  -1.887
  187    HA   LEU  26           HA       LEU  26  -9.288  -0.211  -1.152
  188    HG   LEU  26           HG       LEU  26 -11.971   0.752  -2.334
  189    HB2  LEU  26           2HB      LEU  26 -11.935   0.525   0.086
  190    HB3  LEU  26           1HB      LEU  26 -10.505   1.535   0.190
  191   HD11  LEU  26          1HD1      LEU  26 -13.095   2.470  -1.027
  192   HD12  LEU  26          2HD1      LEU  26 -12.412   3.146  -2.505
  193   HD13  LEU  26          3HD1      LEU  26 -11.602   3.409  -0.962
  194   HD21  LEU  26          3HD2      LEU  26  -9.568   0.850  -2.758
  195   HD22  LEU  26          1HD2      LEU  26  -9.492   2.444  -2.003
  196   HD23  LEU  26          2HD2      LEU  26 -10.396   2.219  -3.500
  197    H    GLU  27           H        GLU  27  -7.770  -1.065   0.027
  198    HA   GLU  27           HA       GLU  27  -8.092  -1.150   2.938
  199    HB2  GLU  27           2HB      GLU  27  -8.482  -3.487   2.141
  200    HB3  GLU  27           1HB      GLU  27  -6.959  -3.427   1.286
  201    HG2  GLU  27           2HG      GLU  27  -6.829  -4.691   3.373
  202    HG3  GLU  27           1HG      GLU  27  -5.723  -3.314   3.328
  203    H    SER  28           H        SER  28  -5.963  -0.982   4.021
  204    HA   SER  28           HA       SER  28  -3.822  -0.124   2.297
  205    HG   SER  28           HG       SER  28  -3.596   2.367   3.582
  206    HB2  SER  28           2HB      SER  28  -4.944   0.408   5.002
  207    HB3  SER  28           1HB      SER  28  -3.261   0.609   4.749
  208    H    THR  29           H        THR  29  -1.856  -1.324   2.456
  209    HA   THR  29           HA       THR  29  -1.575  -3.152   4.702
  210    HB   THR  29           HB       THR  29  -2.650  -4.567   3.063
  211    HG1  THR  29           1HG      THR  29  -1.346  -6.011   3.818
  212   HG21  THR  29          3HG2      THR  29  -1.966  -3.261   1.054
  213   HG22  THR  29          1HG2      THR  29  -1.773  -5.009   0.878
  214   HG23  THR  29          2HG2      THR  29  -0.366  -3.988   1.192
  215    H    TRP  30           H        TRP  30   0.653  -3.955   4.946
  216    HA   TRP  30           HA       TRP  30   2.391  -1.720   4.268
  217    HD1  TRP  30           HD       TRP  30   0.730  -2.177   7.838
  218    HE1  TRP  30           1HE      TRP  30   0.965   0.192   8.826
  219    HE3  TRP  30           3HE      TRP  30   5.066  -0.748   5.524
  220    HZ2  TRP  30           2HZ      TRP  30   2.730   2.411   8.596
  221    HZ3  TRP  30           3HZ      TRP  30   5.964   1.498   5.970
  222    HH2  TRP  30           HH       TRP  30   4.829   3.033   7.483
  223    HB2  TRP  30           2HB      TRP  30   2.364  -3.737   6.459
  224    HB3  TRP  30           1HB      TRP  30   3.922  -3.062   5.986
  225    H    GLU  31           H        GLU  31   2.996  -5.243   4.560
  226    HA   GLU  31           HA       GLU  31   5.016  -4.930   2.478
  227    HB2  GLU  31           2HB      GLU  31   4.402  -7.131   4.424
  228    HB3  GLU  31           1HB      GLU  31   5.455  -7.389   3.037
  229    HG2  GLU  31           2HG      GLU  31   5.887  -5.265   5.110
  230    HG3  GLU  31           1HG      GLU  31   6.643  -6.862   5.155
  231    H    LYS  32           H        LYS  32   5.139  -7.187   1.177
  232    HA   LYS  32           HA       LYS  32   3.231  -6.865  -0.807
  233    HB2  LYS  32           2HB      LYS  32   4.159  -8.898  -1.815
  234    HB3  LYS  32           1HB      LYS  32   5.422  -7.813  -1.252
  235    HG2  LYS  32           2HG      LYS  32   5.657  -9.215   0.774
  236    HG3  LYS  32           1HG      LYS  32   4.480 -10.338   0.093
  237    HD2  LYS  32           2HD      LYS  32   7.161  -9.604  -1.070
  238    HD3  LYS  32           1HD      LYS  32   6.715 -11.145  -0.338
  239    HE2  LYS  32           2HE      LYS  32   5.463  -9.973  -2.818
  240    HE3  LYS  32           1HE      LYS  32   6.723 -11.203  -2.808
  241    HZ1  LYS  32           3HZ      LYS  32   4.000 -11.500  -1.661
  242    HZ2  LYS  32           1HZ      LYS  32   5.210 -12.686  -1.633
  243    HZ3  LYS  32           2HZ      LYS  32   4.549 -12.182  -3.111
  244    HA   PRO  33           HA       PRO  33  -0.476  -8.931   0.746
  245    HB2  PRO  33           2HB      PRO  33  -0.630  -8.770  -2.258
  246    HB3  PRO  33           1HB      PRO  33  -1.928  -8.531  -1.069
  247    HG2  PRO  33           2HG      PRO  33  -0.794  -6.431  -2.138
  248    HG3  PRO  33           1HG      PRO  33  -1.045  -6.458  -0.380
  249    HD2  PRO  33           2HD      PRO  33   1.464  -6.851  -1.943
  250    HD3  PRO  33           1HD      PRO  33   1.228  -6.064  -0.371
  251    H    GLN  34           H        GLN  34  -1.369 -11.070   0.462
  252    HA   GLN  34           HA       GLN  34   0.411 -13.036  -0.677
  253    HB2  GLN  34           2HB      GLN  34  -2.307 -13.263   0.611
  254    HB3  GLN  34           1HB      GLN  34  -1.446 -14.648  -0.046
  255    HG2  GLN  34           2HG      GLN  34   0.438 -14.118   1.498
  256    HG3  GLN  34           1HG      GLN  34  -0.575 -12.868   2.220
  257   HE21  GLN  34          1HE2      GLN  34  -3.009 -14.463   1.894
  258   HE22  GLN  34          2HE2      GLN  34  -2.948 -15.668   3.129
  259    H    GLU  35           H        GLU  35  -2.087 -11.061  -1.748
  260    HA   GLU  35           HA       GLU  35  -2.742 -12.607  -4.100
  261    HB2  GLU  35           2HB      GLU  35  -3.210  -9.654  -3.947
  262    HB3  GLU  35           1HB      GLU  35  -4.236 -10.909  -4.626
  263    HG2  GLU  35           2HG      GLU  35  -3.798 -10.571  -1.674
  264    HG3  GLU  35           1HG      GLU  35  -5.088  -9.761  -2.554
  265    H    LEU  36           H        LEU  36  -0.102 -11.106  -3.021
  266    HA   LEU  36           HA       LEU  36   0.839 -10.099  -5.625
  267    HG   LEU  36           HG       LEU  36   3.147  -7.780  -4.101
  268    HB2  LEU  36           2HB      LEU  36   0.909  -8.886  -3.169
  269    HB3  LEU  36           1HB      LEU  36   2.461  -9.686  -3.194
  270   HD11  LEU  36          1HD1      LEU  36   1.773  -8.895  -6.530
  271   HD12  LEU  36          2HD1      LEU  36   3.398  -9.292  -5.974
  272   HD13  LEU  36          3HD1      LEU  36   3.036  -7.664  -6.545
  273   HD21  LEU  36          3HD2      LEU  36   0.374  -7.231  -5.128
  274   HD22  LEU  36          1HD2      LEU  36   1.731  -6.099  -5.142
  275   HD23  LEU  36          2HD2      LEU  36   1.048  -6.639  -3.607
  276    H    LYS  37           H        LYS  37   1.987 -11.686  -6.680
  277    HA   LYS  37           HA       LYS  37   3.019 -13.927  -5.195
  278    HB2  LYS  37           2HB      LYS  37   2.070 -13.680  -7.731
  279    HB3  LYS  37           1HB      LYS  37   3.804 -13.645  -8.028
  280    HG2  LYS  37           2HG      LYS  37   2.242 -15.813  -6.641
  281    HG3  LYS  37           1HG      LYS  37   3.013 -15.902  -8.223
  282    HD2  LYS  37           2HD      LYS  37   4.680 -15.269  -5.829
  283    HD3  LYS  37           1HD      LYS  37   4.159 -16.932  -6.084
  284    HE2  LYS  37           2HE      LYS  37   6.363 -16.576  -7.034
  285    HE3  LYS  37           1HE      LYS  37   5.189 -16.909  -8.302
  286    HZ1  LYS  37           3HZ      LYS  37   5.255 -14.742  -9.056
  287    HZ2  LYS  37           1HZ      LYS  37   6.872 -15.023  -8.632
  288    HZ3  LYS  37           2HZ      LYS  37   5.868 -14.122  -7.598
  289    H1   GLY 101           1HT      GLY 101   1.112  19.410  -5.971
  290    H2   GLY 101           2HT      GLY 101   2.113  20.718  -5.575
  291    H3   GLY 101           3HT      GLY 101   1.855  19.478  -4.451
  292    HA2  GLY 101           1HA      GLY 101   3.277  19.218  -7.041
  293    HA3  GLY 101           2HA      GLY 101   4.030  19.248  -5.451
  294    HA   PRO 102           HA       PRO 102   3.503  14.810  -5.692
  295    HB2  PRO 102           2HB      PRO 102   4.687  14.731  -3.027
  296    HB3  PRO 102           1HB      PRO 102   5.355  14.143  -4.550
  297    HG2  PRO 102           2HG      PRO 102   6.394  16.273  -3.258
  298    HG3  PRO 102           1HG      PRO 102   6.389  16.149  -5.029
  299    HD2  PRO 102           2HD      PRO 102   4.503  17.658  -3.234
  300    HD3  PRO 102           1HD      PRO 102   5.298  18.198  -4.731
  301    HA   PRO 103           HA       PRO 103  -0.126  14.409  -3.177
  302    HB2  PRO 103           2HB      PRO 103  -0.606  11.783  -3.465
  303    HB3  PRO 103           1HB      PRO 103  -0.800  12.919  -4.803
  304    HG2  PRO 103           2HG      PRO 103   1.454  11.041  -4.235
  305    HG3  PRO 103           1HG      PRO 103   0.684  11.437  -5.782
  306    HD2  PRO 103           2HD      PRO 103   3.057  12.525  -4.916
  307    HD3  PRO 103           1HD      PRO 103   1.964  13.308  -6.075
  308    H    LEU 104           H        LEU 104  -0.706  13.880  -1.096
  309    HA   LEU 104           HA       LEU 104   1.326  12.788   0.626
  310    HG   LEU 104           HG       LEU 104   1.183  14.761   2.139
  311    HB2  LEU 104           2HB      LEU 104  -1.479  13.789   1.090
  312    HB3  LEU 104           1HB      LEU 104  -0.570  12.993   2.360
  313   HD11  LEU 104          1HD1      LEU 104  -0.856  16.086   0.354
  314   HD12  LEU 104          2HD1      LEU 104   0.723  15.481  -0.146
  315   HD13  LEU 104          3HD1      LEU 104   0.614  16.835   0.979
  316   HD21  LEU 104          3HD2      LEU 104  -1.609  15.706   2.770
  317   HD22  LEU 104          1HD2      LEU 104  -0.114  16.477   3.297
  318   HD23  LEU 104          2HD2      LEU 104  -0.523  14.860   3.872
  319    H    ILE 105           H        ILE 105   1.235  10.859   1.737
  320    HA   ILE 105           HA       ILE 105  -0.254   8.760   0.423
  321    HB   ILE 105           HB       ILE 105   1.557   8.340   2.833
  322   HG12  ILE 105          2HG1      ILE 105   3.233   7.711   0.937
  323   HG13  ILE 105          1HG1      ILE 105   2.236   8.746  -0.071
  324   HG21  ILE 105          1HG2      ILE 105   1.835   6.134   1.916
  325   HG22  ILE 105          2HG2      ILE 105   0.804   6.547   0.546
  326   HG23  ILE 105          3HG2      ILE 105   0.126   6.485   2.172
  327   HD11  ILE 105          3HD1      ILE 105   2.705  10.639   1.328
  328   HD12  ILE 105          1HD1      ILE 105   4.213   9.889   0.808
  329   HD13  ILE 105          2HD1      ILE 105   3.619   9.628   2.449
  330    HA   PRO 106           HA       PRO 106  -3.316   8.378   3.760
  331    HB2  PRO 106           2HB      PRO 106  -3.520   5.564   2.931
  332    HB3  PRO 106           1HB      PRO 106  -4.767   6.795   2.878
  333    HG2  PRO 106           2HG      PRO 106  -3.654   5.779   0.653
  334    HG3  PRO 106           1HG      PRO 106  -4.228   7.451   0.748
  335    HD2  PRO 106           2HD      PRO 106  -1.438   6.396   0.894
  336    HD3  PRO 106           1HD      PRO 106  -2.052   7.873   0.121
  337    HA   PRO 107           HA       PRO 107  -0.365   6.144   6.304
  338    HB2  PRO 107           2HB      PRO 107  -2.233   5.854   8.494
  339    HB3  PRO 107           1HB      PRO 107  -0.852   6.944   8.377
  340    HG2  PRO 107           2HG      PRO 107  -3.476   7.768   8.401
  341    HG3  PRO 107           1HG      PRO 107  -2.139   8.700   7.703
  342    HD2  PRO 107           2HD      PRO 107  -4.199   7.013   6.341
  343    HD3  PRO 107           1HD      PRO 107  -3.452   8.536   5.805
  344    HA   PRO 108           HA       PRO 108  -1.990   1.962   6.004
  345    HB2  PRO 108           2HB      PRO 108   0.480   0.858   6.866
  346    HB3  PRO 108           1HB      PRO 108  -0.110   0.995   5.198
  347    HG2  PRO 108           2HG      PRO 108   2.063   2.366   6.268
  348    HG3  PRO 108           1HG      PRO 108   1.191   2.783   4.779
  349    HD2  PRO 108           2HD      PRO 108   0.995   3.992   7.485
  350    HD3  PRO 108           1HD      PRO 108   0.861   4.715   5.861
  351    HA   PRO 109           HA       PRO 109  -2.941   1.159  10.268
  352    HB2  PRO 109           2HB      PRO 109  -3.952  -1.346   9.998
  353    HB3  PRO 109           1HB      PRO 109  -4.826   0.096   9.472
  354    HG2  PRO 109           2HG      PRO 109  -3.269  -1.874   7.848
  355    HG3  PRO 109           1HG      PRO 109  -4.787  -1.045   7.464
  356    HD2  PRO 109           2HD      PRO 109  -2.333  -0.310   6.507
  357    HD3  PRO 109           1HD      PRO 109  -3.708   0.795   6.683
  Start of MODEL    3
    1    H1   GLY   1           1HT      GLY   1  -5.804 -23.688  -8.336
    2    H2   GLY   1           2HT      GLY   1  -5.527 -24.604  -6.936
    3    H3   GLY   1           3HT      GLY   1  -4.562 -24.837  -8.319
    4    HA2  GLY   1           1HA      GLY   1  -3.477 -23.529  -6.521
    5    HA3  GLY   1           2HA      GLY   1  -3.540 -22.735  -8.089
    6    H    ALA   2           H        ALA   2  -5.252 -21.195  -8.458
    7    HA   ALA   2           HA       ALA   2  -6.676 -19.508  -7.986
    8    HB1  ALA   2           1HB      ALA   2  -8.094 -19.578  -6.031
    9    HB2  ALA   2           2HB      ALA   2  -7.062 -20.808  -5.299
   10    HB3  ALA   2           3HB      ALA   2  -7.980 -21.180  -6.757
   11    H    THR   3           H        THR   3  -4.823 -18.152  -8.104
   12    HA   THR   3           HA       THR   3  -4.496 -16.720  -5.568
   13    HB   THR   3           HB       THR   3  -2.384 -17.955  -6.133
   14    HG1  THR   3           1HG      THR   3  -2.660 -15.600  -5.193
   15   HG21  THR   3          3HG2      THR   3  -2.305 -16.083  -8.502
   16   HG22  THR   3          1HG2      THR   3  -2.466 -17.840  -8.564
   17   HG23  THR   3          2HG2      THR   3  -0.978 -17.110  -7.964
   18    H    ALA   4           H        ALA   4  -4.909 -14.580  -5.702
   19    HA   ALA   4           HA       ALA   4  -5.465 -13.500  -8.388
   20    HB1  ALA   4           1HB      ALA   4  -7.361 -13.356  -6.052
   21    HB2  ALA   4           2HB      ALA   4  -7.550 -14.385  -7.470
   22    HB3  ALA   4           3HB      ALA   4  -7.608 -12.632  -7.640
   23    H    VAL   5           H        VAL   5  -4.543 -11.610  -8.682
   24    HA   VAL   5           HA       VAL   5  -3.549 -10.117  -6.426
   25    HB   VAL   5           HB       VAL   5  -1.989 -10.318  -8.175
   26   HG11  VAL   5          1HG1      VAL   5  -3.443 -10.879  -9.959
   27   HG12  VAL   5          2HG1      VAL   5  -2.481  -9.481 -10.457
   28   HG13  VAL   5          3HG1      VAL   5  -4.157  -9.271  -9.949
   29   HG21  VAL   5          3HG2      VAL   5  -1.769  -8.158  -7.194
   30   HG22  VAL   5          1HG2      VAL   5  -3.166  -7.547  -8.093
   31   HG23  VAL   5          2HG2      VAL   5  -1.671  -7.929  -8.944
   32    H    SER   6           H        SER   6  -4.530  -8.489  -5.518
   33    HA   SER   6           HA       SER   6  -6.934  -7.357  -6.612
   34    HG   SER   6           HG       SER   6  -6.903  -8.818  -4.721
   35    HB2  SER   6           2HB      SER   6  -5.482  -6.618  -4.114
   36    HB3  SER   6           1HB      SER   6  -7.130  -6.164  -4.550
   37    H    GLU   7           H        GLU   7  -7.044  -4.824  -6.190
   38    HA   GLU   7           HA       GLU   7  -5.186  -3.755  -8.076
   39    HB2  GLU   7           2HB      GLU   7  -6.692  -1.789  -6.510
   40    HB3  GLU   7           1HB      GLU   7  -6.621  -2.011  -8.249
   41    HG2  GLU   7           2HG      GLU   7  -8.352  -3.576  -6.345
   42    HG3  GLU   7           1HG      GLU   7  -8.887  -2.243  -7.359
   43    H    TRP   8           H        TRP   8  -3.172  -3.542  -7.431
   44    HA   TRP   8           HA       TRP   8  -2.621  -2.687  -4.644
   45    HD1  TRP   8           HD       TRP   8  -0.895  -6.960  -6.156
   46    HE1  TRP   8           1HE      TRP   8  -2.299  -8.578  -4.732
   47    HE3  TRP   8           3HE      TRP   8  -3.240  -3.562  -3.301
   48    HZ2  TRP   8           2HZ      TRP   8  -4.247  -8.386  -2.661
   49    HZ3  TRP   8           3HZ      TRP   8  -4.948  -4.310  -1.743
   50    HH2  TRP   8           HH       TRP   8  -5.462  -6.616  -1.362
   51    HB2  TRP   8           2HB      TRP   8  -0.893  -4.378  -6.515
   52    HB3  TRP   8           1HB      TRP   8  -0.442  -3.889  -4.893
   53    H    THR   9           H        THR   9  -1.841  -0.634  -4.606
   54    HA   THR   9           HA       THR   9  -0.086   0.182  -6.812
   55    HB   THR   9           HB       THR   9  -1.489   1.925  -6.769
   56    HG1  THR   9           1HG      THR   9  -0.083   2.998  -4.620
   57   HG21  THR   9          3HG2      THR   9  -2.653   2.841  -4.792
   58   HG22  THR   9          1HG2      THR   9  -1.824   1.644  -3.788
   59   HG23  THR   9          2HG2      THR   9  -2.983   1.124  -5.016
   60    H    GLU  10           H        GLU  10   1.525   1.756  -6.141
   61    HA   GLU  10           HA       GLU  10   2.915   0.693  -3.756
   62    HB2  GLU  10           2HB      GLU  10   5.034   0.941  -4.759
   63    HB3  GLU  10           1HB      GLU  10   4.028   0.144  -5.960
   64    HG2  GLU  10           2HG      GLU  10   4.070   1.916  -7.380
   65    HG3  GLU  10           1HG      GLU  10   4.233   3.099  -6.080
   66    H    TYR  11           H        TYR  11   3.459   2.065  -2.244
   67    HA   TYR  11           HA       TYR  11   3.639   4.924  -2.792
   68    HD1  TYR  11           1HD      TYR  11   2.346   7.129  -1.884
   69    HD2  TYR  11           2HD      TYR  11  -0.239   3.882  -2.768
   70    HE1  TYR  11           1HE      TYR  11   0.874   8.672  -3.089
   71    HE2  TYR  11           2HE      TYR  11  -1.720   5.394  -4.022
   72    HH   TYR  11           HH       TYR  11  -2.260   7.809  -4.080
   73    HB2  TYR  11           2HB      TYR  11   1.496   3.576  -1.274
   74    HB3  TYR  11           1HB      TYR  11   2.220   4.966  -0.472
   75    H    LYS  12           H        LYS  12   4.828   6.050  -1.136
   76    HA   LYS  12           HA       LYS  12   5.756   4.342   1.052
   77    HB2  LYS  12           2HB      LYS  12   7.501   6.482  -0.206
   78    HB3  LYS  12           1HB      LYS  12   7.970   5.301   1.001
   79    HG2  LYS  12           2HG      LYS  12   8.935   4.397  -0.854
   80    HG3  LYS  12           1HG      LYS  12   7.366   3.590  -0.899
   81    HD2  LYS  12           2HD      LYS  12   6.589   4.935  -2.642
   82    HD3  LYS  12           1HD      LYS  12   7.797   6.185  -2.341
   83    HE2  LYS  12           2HE      LYS  12   8.375   5.000  -4.356
   84    HE3  LYS  12           1HE      LYS  12   9.551   4.627  -3.097
   85    HZ1  LYS  12           3HZ      LYS  12   7.395   2.898  -4.158
   86    HZ2  LYS  12           1HZ      LYS  12   8.178   2.565  -2.686
   87    HZ3  LYS  12           2HZ      LYS  12   9.063   2.603  -4.123
   88    H    THR  13           H        THR  13   5.698   5.225   3.025
   89    HA   THR  13           HA       THR  13   4.533   7.911   3.177
   90    HB   THR  13           HB       THR  13   4.020   7.237   5.564
   91    HG1  THR  13           1HG      THR  13   4.676   5.335   6.245
   92   HG21  THR  13          3HG2      THR  13   2.100   5.856   4.918
   93   HG22  THR  13          1HG2      THR  13   2.848   5.540   3.350
   94   HG23  THR  13          2HG2      THR  13   2.343   7.174   3.771
   95    H    ALA  14           H        ALA  14   5.161   8.785   5.624
   96    HA   ALA  14           HA       ALA  14   7.841   9.691   5.259
   97    HB1  ALA  14           1HB      ALA  14   6.031  11.057   6.270
   98    HB2  ALA  14           2HB      ALA  14   7.498  10.998   7.246
   99    HB3  ALA  14           3HB      ALA  14   6.101  10.024   7.696
  100    H    ASP  15           H        ASP  15   6.708   6.846   6.459
  101    HA   ASP  15           HA       ASP  15   8.557   6.453   8.632
  102    HB2  ASP  15           2HB      ASP  15   6.969   4.393   7.088
  103    HB3  ASP  15           1HB      ASP  15   7.707   4.182   8.672
  104    H    GLY  16           H        GLY  16   8.776   6.393   5.267
  105    HA2  GLY  16           2HA      GLY  16  10.547   5.888   3.886
  106    HA3  GLY  16           1HA      GLY  16  11.476   5.457   5.318
  107    H    LYS  17           H        LYS  17   8.427   4.121   4.103
  108    HA   LYS  17           HA       LYS  17   9.786   1.581   3.615
  109    HB2  LYS  17           2HB      LYS  17   8.886   1.567   5.940
  110    HB3  LYS  17           1HB      LYS  17   7.279   1.840   5.283
  111    HG2  LYS  17           2HG      LYS  17   7.294  -0.289   4.186
  112    HG3  LYS  17           1HG      LYS  17   8.983  -0.550   4.619
  113    HD2  LYS  17           2HD      LYS  17   6.789  -0.214   6.662
  114    HD3  LYS  17           1HD      LYS  17   7.276  -1.780   6.017
  115    HE2  LYS  17           2HE      LYS  17   8.419  -1.520   8.070
  116    HE3  LYS  17           1HE      LYS  17   9.614  -1.248   6.807
  117    HZ1  LYS  17           3HZ      LYS  17   9.224   1.170   7.133
  118    HZ2  LYS  17           1HZ      LYS  17   9.911   0.397   8.473
  119    HZ3  LYS  17           2HZ      LYS  17   8.263   0.804   8.476
  120    H    THR  18           H        THR  18   8.683   0.177   2.206
  121    HA   THR  18           HA       THR  18   7.075   1.561   0.244
  122    HB   THR  18           HB       THR  18   7.883  -1.354   0.220
  123    HG1  THR  18           1HG      THR  18   9.812  -0.768  -0.613
  124   HG21  THR  18          3HG2      THR  18   7.327   0.588  -2.026
  125   HG22  THR  18          1HG2      THR  18   6.180  -0.608  -1.420
  126   HG23  THR  18          2HG2      THR  18   7.679  -1.133  -2.188
  127    H    TYR  19           H        TYR  19   4.982   1.721   0.591
  128    HA   TYR  19           HA       TYR  19   3.549  -0.496   1.880
  129    HD1  TYR  19           2HD      TYR  19   0.765   0.003   2.429
  130    HD2  TYR  19           1HD      TYR  19   2.107   4.048   2.868
  131    HE1  TYR  19           2HE      TYR  19  -1.556   0.775   2.535
  132    HE2  TYR  19           1HE      TYR  19  -0.139   4.754   2.962
  133    HH   TYR  19           HH       TYR  19  -2.818   2.716   3.394
  134    HB2  TYR  19           2HB      TYR  19   3.306   1.054   3.521
  135    HB3  TYR  19           1HB      TYR  19   3.695   2.385   2.456
  136    H    TYR  20           H        TYR  20   1.675  -1.197   0.943
  137    HA   TYR  20           HA       TYR  20   1.031   0.017  -1.670
  138    HD1  TYR  20           2HD      TYR  20   2.433  -3.481   0.247
  139    HD2  TYR  20           1HD      TYR  20   1.970  -2.119  -3.789
  140    HE1  TYR  20           2HE      TYR  20   4.602  -4.432  -0.338
  141    HE2  TYR  20           1HE      TYR  20   4.156  -3.085  -4.353
  142    HH   TYR  20           HH       TYR  20   5.871  -5.160  -2.197
  143    HB2  TYR  20           2HB      TYR  20   0.139  -2.739  -0.750
  144    HB3  TYR  20           1HB      TYR  20   0.127  -2.067  -2.370
  145    H    TYR  21           H        TYR  21  -1.101   0.612  -2.125
  146    HA   TYR  21           HA       TYR  21  -2.869   0.480   0.217
  147    HD1  TYR  21           1HD      TYR  21  -5.421   2.178  -2.390
  148    HD2  TYR  21           2HD      TYR  21  -3.849   3.203   1.451
  149    HE1  TYR  21           1HE      TYR  21  -7.674   2.803  -1.627
  150    HE2  TYR  21           2HE      TYR  21  -6.101   3.822   2.196
  151    HH   TYR  21           HH       TYR  21  -8.919   3.054   0.392
  152    HB2  TYR  21           2HB      TYR  21  -2.346   2.806  -0.458
  153    HB3  TYR  21           1HB      TYR  21  -2.991   2.478  -2.063
  154    H    ASN  22           H        ASN  22  -4.009  -1.153   0.037
  155    HA   ASN  22           HA       ASN  22  -4.736  -2.609  -2.210
  156    HB2  ASN  22           2HB      ASN  22  -4.748  -3.566   0.011
  157    HB3  ASN  22           1HB      ASN  22  -5.875  -2.361   0.599
  158   HD21  ASN  22          1HD2      ASN  22  -5.931  -5.262   0.703
  159   HD22  ASN  22          2HD2      ASN  22  -7.413  -5.750  -0.036
  160    H    ASN  23           H        ASN  23  -5.766  -1.585  -3.844
  161    HA   ASN  23           HA       ASN  23  -8.041   0.145  -3.264
  162    HB2  ASN  23           2HB      ASN  23  -6.210   0.648  -5.003
  163    HB3  ASN  23           1HB      ASN  23  -6.979  -0.582  -5.996
  164   HD21  ASN  23          1HD2      ASN  23  -8.829  -0.096  -7.082
  165   HD22  ASN  23          2HD2      ASN  23  -9.551   1.473  -7.086
  166    H    ARG  24           H        ARG  24  -7.677  -2.967  -3.172
  167    HA   ARG  24           HA       ARG  24  -9.584  -4.048  -4.947
  168    HE   ARG  24           HE       ARG  24 -10.946  -8.397  -4.722
  169    HB2  ARG  24           2HB      ARG  24  -7.864  -5.394  -3.788
  170    HB3  ARG  24           1HB      ARG  24  -8.742  -5.153  -2.284
  171    HG2  ARG  24           2HG      ARG  24  -9.247  -7.324  -3.243
  172    HG3  ARG  24           1HG      ARG  24 -10.683  -6.296  -3.210
  173    HD2  ARG  24           2HD      ARG  24 -10.377  -5.764  -5.568
  174    HD3  ARG  24           1HD      ARG  24  -8.907  -6.738  -5.610
  175   HH11  ARG  24          1HH1      ARG  24 -10.140  -6.576  -7.627
  176   HH12  ARG  24          2HH1      ARG  24 -11.013  -7.651  -8.686
  177   HH21  ARG  24          1HH2      ARG  24 -12.079  -9.818  -6.139
  178   HH22  ARG  24          2HH2      ARG  24 -12.104  -9.476  -7.844
  179    H    THR  25           H        THR  25  -9.853  -3.973  -1.431
  180    HA   THR  25           HA       THR  25 -12.709  -3.383  -1.648
  181    HB   THR  25           HB       THR  25 -12.137  -5.394  -0.377
  182    HG1  THR  25           1HG      THR  25 -13.148  -3.224   1.174
  183   HG21  THR  25          3HG2      THR  25  -9.948  -4.692   0.343
  184   HG22  THR  25          1HG2      THR  25 -10.921  -5.174   1.732
  185   HG23  THR  25          2HG2      THR  25 -10.664  -3.465   1.377
  186    H    LEU  26           H        LEU  26 -10.193  -1.609  -1.717
  187    HA   LEU  26           HA       LEU  26  -9.330   0.283  -0.891
  188    HG   LEU  26           HG       LEU  26 -12.129   0.765  -2.193
  189    HB2  LEU  26           2HB      LEU  26 -12.103   0.672   0.243
  190    HB3  LEU  26           1HB      LEU  26 -10.834   1.880   0.296
  191   HD11  LEU  26          1HD1      LEU  26 -12.182   3.506  -0.945
  192   HD12  LEU  26          2HD1      LEU  26 -13.516   2.352  -0.985
  193   HD13  LEU  26          3HD1      LEU  26 -12.918   3.059  -2.485
  194   HD21  LEU  26          3HD2      LEU  26  -9.743   1.187  -2.557
  195   HD22  LEU  26          1HD2      LEU  26  -9.936   2.822  -1.923
  196   HD23  LEU  26          2HD2      LEU  26 -10.744   2.355  -3.418
  197    H    GLU  27           H        GLU  27  -7.877  -0.762   0.274
  198    HA   GLU  27           HA       GLU  27  -8.168  -0.813   3.181
  199    HB2  GLU  27           2HB      GLU  27  -8.729  -3.111   2.290
  200    HB3  GLU  27           1HB      GLU  27  -7.165  -3.140   1.504
  201    HG2  GLU  27           2HG      GLU  27  -7.286  -4.438   3.611
  202    HG3  GLU  27           1HG      GLU  27  -6.012  -3.211   3.560
  203    H    SER  28           H        SER  28  -5.884  -1.297   4.115
  204    HA   SER  28           HA       SER  28  -3.826  -0.252   2.291
  205    HG   SER  28           HG       SER  28  -4.954   1.612   3.642
  206    HB2  SER  28           2HB      SER  28  -4.244   0.028   5.237
  207    HB3  SER  28           1HB      SER  28  -2.642   0.244   4.562
  208    H    THR  29           H        THR  29  -1.779  -1.239   2.304
  209    HA   THR  29           HA       THR  29  -1.454  -3.725   3.815
  210    HB   THR  29           HB       THR  29  -0.254  -4.562   1.642
  211    HG1  THR  29           1HG      THR  29  -0.992  -2.333   0.704
  212   HG21  THR  29          3HG2      THR  29  -3.225  -4.457   1.973
  213   HG22  THR  29          1HG2      THR  29  -2.119  -5.683   2.598
  214   HG23  THR  29          2HG2      THR  29  -2.390  -5.534   0.847
  215    H    TRP  30           H        TRP  30   0.422  -3.735   4.813
  216    HA   TRP  30           HA       TRP  30   2.084  -1.425   4.551
  217    HD1  TRP  30           HD       TRP  30   0.753  -2.203   8.299
  218    HE1  TRP  30           1HE      TRP  30   1.103   0.162   9.268
  219    HE3  TRP  30           3HE      TRP  30   4.610  -0.676   5.314
  220    HZ2  TRP  30           2HZ      TRP  30   2.783   2.413   8.766
  221    HZ3  TRP  30           3HZ      TRP  30   5.538   1.577   5.630
  222    HH2  TRP  30           HH       TRP  30   4.655   3.079   7.334
  223    HB2  TRP  30           2HB      TRP  30   1.870  -3.626   6.444
  224    HB3  TRP  30           1HB      TRP  30   3.547  -3.176   6.122
  225    H    GLU  31           H        GLU  31   3.090  -4.841   4.308
  226    HA   GLU  31           HA       GLU  31   4.927  -3.958   2.187
  227    HB2  GLU  31           2HB      GLU  31   5.326  -5.635   4.409
  228    HB3  GLU  31           1HB      GLU  31   5.265  -6.674   2.994
  229    HG2  GLU  31           2HG      GLU  31   7.020  -4.254   3.035
  230    HG3  GLU  31           1HG      GLU  31   7.546  -5.779   3.748
  231    H    LYS  32           H        LYS  32   5.401  -6.244   0.910
  232    HA   LYS  32           HA       LYS  32   3.556  -6.673  -1.003
  233    HB2  LYS  32           2HB      LYS  32   5.409  -8.686   0.266
  234    HB3  LYS  32           1HB      LYS  32   4.521  -8.994  -1.216
  235    HG2  LYS  32           2HG      LYS  32   5.703  -7.231  -2.351
  236    HG3  LYS  32           1HG      LYS  32   6.506  -6.760  -0.850
  237    HD2  LYS  32           2HD      LYS  32   7.613  -8.923  -0.737
  238    HD3  LYS  32           1HD      LYS  32   6.781  -9.440  -2.203
  239    HE2  LYS  32           2HE      LYS  32   8.638  -7.071  -2.074
  240    HE3  LYS  32           1HE      LYS  32   9.155  -8.696  -2.522
  241    HZ1  LYS  32           3HZ      LYS  32   7.220  -6.964  -3.963
  242    HZ2  LYS  32           1HZ      LYS  32   7.465  -8.601  -4.333
  243    HZ3  LYS  32           2HZ      LYS  32   8.737  -7.493  -4.505
  244    HA   PRO  33           HA       PRO  33  -0.020  -8.330   1.216
  245    HB2  PRO  33           2HB      PRO  33  -0.825  -8.609  -1.638
  246    HB3  PRO  33           1HB      PRO  33  -1.725  -7.918  -0.288
  247    HG2  PRO  33           2HG      PRO  33  -0.627  -6.343  -2.116
  248    HG3  PRO  33           1HG      PRO  33  -0.596  -5.891  -0.399
  249    HD2  PRO  33           2HD      PRO  33   1.587  -6.996  -2.114
  250    HD3  PRO  33           1HD      PRO  33   1.671  -5.782  -0.820
  251    H    GLN  34           H        GLN  34  -1.219 -10.364   1.029
  252    HA   GLN  34           HA       GLN  34   0.388 -12.593   1.082
  253    HB2  GLN  34           2HB      GLN  34  -2.558 -12.595   0.403
  254    HB3  GLN  34           1HB      GLN  34  -1.642 -13.910   1.125
  255    HG2  GLN  34           2HG      GLN  34  -1.383 -12.756   3.154
  256    HG3  GLN  34           1HG      GLN  34  -1.930 -11.239   2.449
  257   HE21  GLN  34          1HE2      GLN  34  -2.881 -14.327   3.706
  258   HE22  GLN  34          2HE2      GLN  34  -4.575 -13.984   3.819
  259    H    GLU  35           H        GLU  35  -1.474 -11.320  -1.618
  260    HA   GLU  35           HA       GLU  35  -0.798 -13.577  -3.293
  261    HB2  GLU  35           2HB      GLU  35  -2.431 -11.099  -3.835
  262    HB3  GLU  35           1HB      GLU  35  -2.190 -12.408  -4.990
  263    HG2  GLU  35           2HG      GLU  35  -3.479 -12.654  -2.280
  264    HG3  GLU  35           1HG      GLU  35  -4.317 -12.651  -3.833
  265    H    LEU  36           H        LEU  36   0.268 -10.327  -2.792
  266    HA   LEU  36           HA       LEU  36   1.920 -10.325  -5.168
  267    HG   LEU  36           HG       LEU  36   0.450  -8.131  -5.464
  268    HB2  LEU  36           2HB      LEU  36   1.146  -8.378  -3.135
  269    HB3  LEU  36           1HB      LEU  36   2.822  -8.251  -3.608
  270   HD11  LEU  36          1HD1      LEU  36   2.312  -5.897  -4.681
  271   HD12  LEU  36          2HD1      LEU  36   0.750  -6.172  -3.898
  272   HD13  LEU  36          3HD1      LEU  36   0.819  -5.806  -5.626
  273   HD21  LEU  36          3HD2      LEU  36   2.101  -7.485  -7.121
  274   HD22  LEU  36          1HD2      LEU  36   2.433  -9.088  -6.469
  275   HD23  LEU  36          2HD2      LEU  36   3.381  -7.705  -5.928
  276    H    LYS  37           H        LYS  37   2.810 -12.401  -4.416
  277    HA   LYS  37           HA       LYS  37   4.883 -12.105  -2.367
  278    HB2  LYS  37           2HB      LYS  37   4.836 -14.705  -2.549
  279    HB3  LYS  37           1HB      LYS  37   3.551 -13.877  -1.681
  280    HG2  LYS  37           2HG      LYS  37   2.174 -13.999  -3.767
  281    HG3  LYS  37           1HG      LYS  37   3.433 -15.015  -4.470
  282    HD2  LYS  37           2HD      LYS  37   3.111 -16.677  -2.739
  283    HD3  LYS  37           1HD      LYS  37   1.942 -15.637  -1.920
  284    HE2  LYS  37           2HE      LYS  37   1.624 -16.772  -4.698
  285    HE3  LYS  37           1HE      LYS  37   0.871 -17.430  -3.245
  286    HZ1  LYS  37           3HZ      LYS  37  -0.398 -15.429  -2.977
  287    HZ2  LYS  37           1HZ      LYS  37  -0.607 -15.968  -4.570
  288    HZ3  LYS  37           2HZ      LYS  37   0.426 -14.669  -4.246
  289    H1   GLY 101           1HT      GLY 101  -0.679  18.259  -8.079
  290    H2   GLY 101           2HT      GLY 101  -0.155  17.563  -9.530
  291    H3   GLY 101           3HT      GLY 101   0.333  19.135  -9.112
  292    HA2  GLY 101           1HA      GLY 101   2.133  17.600  -8.729
  293    HA3  GLY 101           2HA      GLY 101   1.551  18.264  -7.207
  294    HA   PRO 102           HA       PRO 102   1.583  13.633  -6.981
  295    HB2  PRO 102           2HB      PRO 102   3.115  13.823  -4.547
  296    HB3  PRO 102           1HB      PRO 102   3.606  13.144  -6.096
  297    HG2  PRO 102           2HG      PRO 102   4.653  15.436  -4.998
  298    HG3  PRO 102           1HG      PRO 102   4.671  15.055  -6.728
  299    HD2  PRO 102           2HD      PRO 102   2.857  16.869  -5.198
  300    HD3  PRO 102           1HD      PRO 102   3.523  17.054  -6.836
  301    HA   PRO 103           HA       PRO 103  -1.615  13.543  -3.879
  302    HB2  PRO 103           2HB      PRO 103  -1.958  10.874  -3.740
  303    HB3  PRO 103           1HB      PRO 103  -2.467  11.803  -5.142
  304    HG2  PRO 103           2HG      PRO 103  -0.024  10.134  -4.776
  305    HG3  PRO 103           1HG      PRO 103  -1.079  10.279  -6.194
  306    HD2  PRO 103           2HD      PRO 103   1.324  11.569  -5.927
  307    HD3  PRO 103           1HD      PRO 103  -0.010  12.157  -6.938
  308    H    LEU 104           H        LEU 104  -1.800  13.266  -1.661
  309    HA   LEU 104           HA       LEU 104   0.537  12.401  -0.209
  310    HG   LEU 104           HG       LEU 104  -0.899  11.889   2.489
  311    HB2  LEU 104           2HB      LEU 104  -0.906  14.239   0.594
  312    HB3  LEU 104           1HB      LEU 104  -2.232  13.109   0.778
  313   HD11  LEU 104          1HD1      LEU 104   1.070  12.946   3.443
  314   HD12  LEU 104          2HD1      LEU 104   0.979  14.236   2.244
  315   HD13  LEU 104          3HD1      LEU 104   1.328  12.583   1.736
  316   HD21  LEU 104          3HD2      LEU 104  -1.414  14.818   3.001
  317   HD22  LEU 104          1HD2      LEU 104  -1.175  13.600   4.254
  318   HD23  LEU 104          2HD2      LEU 104  -2.570  13.498   3.179
  319    H    ILE 105           H        ILE 105   0.726  10.514   1.015
  320    HA   ILE 105           HA       ILE 105  -0.931   8.314   0.166
  321    HB   ILE 105           HB       ILE 105   1.190   7.951   2.301
  322   HG12  ILE 105          2HG1      ILE 105   2.733   7.519   0.264
  323   HG13  ILE 105          1HG1      ILE 105   1.592   8.495  -0.640
  324   HG21  ILE 105          1HG2      ILE 105  -0.238   6.089   1.652
  325   HG22  ILE 105          2HG2      ILE 105   1.453   5.815   1.228
  326   HG23  ILE 105          3HG2      ILE 105   0.295   6.273  -0.020
  327   HD11  ILE 105          3HD1      ILE 105   3.259   9.966  -0.108
  328   HD12  ILE 105          1HD1      ILE 105   3.454   9.330   1.533
  329   HD13  ILE 105          2HD1      ILE 105   2.033  10.287   1.120
  330    HA   PRO 106           HA       PRO 106  -3.345   8.122   4.012
  331    HB2  PRO 106           2HB      PRO 106  -3.678   5.278   3.344
  332    HB3  PRO 106           1HB      PRO 106  -4.921   6.513   3.466
  333    HG2  PRO 106           2HG      PRO 106  -4.219   5.414   1.114
  334    HG3  PRO 106           1HG      PRO 106  -4.741   7.104   1.245
  335    HD2  PRO 106           2HD      PRO 106  -1.974   5.984   1.003
  336    HD3  PRO 106           1HD      PRO 106  -2.687   7.419   0.232
  337    HA   PRO 107           HA       PRO 107  -0.062   5.873   6.154
  338    HB2  PRO 107           2HB      PRO 107  -1.629   5.783   8.594
  339    HB3  PRO 107           1HB      PRO 107  -0.187   6.742   8.257
  340    HG2  PRO 107           2HG      PRO 107  -2.676   7.818   8.603
  341    HG3  PRO 107           1HG      PRO 107  -1.407   8.578   7.627
  342    HD2  PRO 107           2HD      PRO 107  -3.775   6.969   6.746
  343    HD3  PRO 107           1HD      PRO 107  -3.058   8.421   6.009
  344    HA   PRO 108           HA       PRO 108  -1.947   1.814   6.126
  345    HB2  PRO 108           2HB      PRO 108   0.544   0.591   6.784
  346    HB3  PRO 108           1HB      PRO 108  -0.224   0.701   5.190
  347    HG2  PRO 108           2HG      PRO 108   2.112   1.983   5.912
  348    HG3  PRO 108           1HG      PRO 108   1.053   2.464   4.566
  349    HD2  PRO 108           2HD      PRO 108   1.299   3.622   7.297
  350    HD3  PRO 108           1HD      PRO 108   1.028   4.396   5.710
  351    HA   PRO 109           HA       PRO 109  -2.556   0.884  10.442
  352    HB2  PRO 109           2HB      PRO 109  -3.734  -1.545  10.125
  353    HB3  PRO 109           1HB      PRO 109  -4.561  -0.025   9.762
  354    HG2  PRO 109           2HG      PRO 109  -3.221  -1.945   7.881
  355    HG3  PRO 109           1HG      PRO 109  -4.761  -1.081   7.695
  356    HD2  PRO 109           2HD      PRO 109  -2.458  -0.295   6.521
  357    HD3  PRO 109           1HD      PRO 109  -3.740   0.832   7.003
  Start of MODEL    4
    1    H1   GLY   1           1HT      GLY   1  -1.481 -18.652 -16.545
    2    H2   GLY   1           2HT      GLY   1  -0.947 -18.558 -14.939
    3    H3   GLY   1           3HT      GLY   1  -0.051 -17.820 -16.174
    4    HA2  GLY   1           1HA      GLY   1  -1.233 -16.133 -15.005
    5    HA3  GLY   1           2HA      GLY   1  -1.905 -16.313 -16.616
    6    H    ALA   2           H        ALA   2  -2.394 -18.218 -13.642
    7    HA   ALA   2           HA       ALA   2  -5.267 -17.594 -13.827
    8    HB1  ALA   2           1HB      ALA   2  -3.861 -19.707 -12.185
    9    HB2  ALA   2           2HB      ALA   2  -4.678 -19.980 -13.725
   10    HB3  ALA   2           3HB      ALA   2  -5.603 -19.475 -12.312
   11    H    THR   3           H        THR   3  -2.587 -16.395 -12.525
   12    HA   THR   3           HA       THR   3  -3.613 -15.842  -9.861
   13    HB   THR   3           HB       THR   3  -1.314 -14.633  -9.716
   14    HG1  THR   3           1HG      THR   3  -0.576 -14.611 -11.775
   15   HG21  THR   3          3HG2      THR   3  -1.870 -16.749  -8.578
   16   HG22  THR   3          1HG2      THR   3  -0.203 -16.734  -9.158
   17   HG23  THR   3          2HG2      THR   3  -1.435 -17.637 -10.036
   18    H    ALA   4           H        ALA   4  -5.134 -14.280  -9.965
   19    HA   ALA   4           HA       ALA   4  -4.274 -11.705 -11.104
   20    HB1  ALA   4           1HB      ALA   4  -6.640 -11.135 -11.395
   21    HB2  ALA   4           2HB      ALA   4  -7.104 -12.719 -10.773
   22    HB3  ALA   4           3HB      ALA   4  -6.222 -12.593 -12.296
   23    H    VAL   5           H        VAL   5  -3.338 -10.845  -9.308
   24    HA   VAL   5           HA       VAL   5  -4.556 -11.158  -6.717
   25    HB   VAL   5           HB       VAL   5  -2.696  -9.964  -5.807
   26   HG11  VAL   5          1HG1      VAL   5  -0.816 -11.288  -6.593
   27   HG12  VAL   5          2HG1      VAL   5  -1.699 -11.693  -8.066
   28   HG13  VAL   5          3HG1      VAL   5  -2.275 -12.273  -6.504
   29   HG21  VAL   5          3HG2      VAL   5  -1.678  -9.308  -8.560
   30   HG22  VAL   5          1HG2      VAL   5  -1.102  -8.693  -7.003
   31   HG23  VAL   5          2HG2      VAL   5  -2.683  -8.194  -7.632
   32    H    SER   6           H        SER   6  -4.532  -8.991  -5.351
   33    HA   SER   6           HA       SER   6  -6.470  -7.216  -6.505
   34    HG   SER   6           HG       SER   6  -5.644  -8.872  -3.833
   35    HB2  SER   6           2HB      SER   6  -5.024  -6.709  -3.976
   36    HB3  SER   6           1HB      SER   6  -6.678  -6.284  -4.419
   37    H    GLU   7           H        GLU   7  -6.208  -4.912  -6.598
   38    HA   GLU   7           HA       GLU   7  -3.784  -4.399  -8.004
   39    HB2  GLU   7           2HB      GLU   7  -6.093  -2.601  -7.262
   40    HB3  GLU   7           1HB      GLU   7  -4.708  -2.072  -8.213
   41    HG2  GLU   7           2HG      GLU   7  -5.235  -3.803  -9.887
   42    HG3  GLU   7           1HG      GLU   7  -6.662  -4.242  -8.955
   43    H    TRP   8           H        TRP   8  -2.053  -4.097  -7.058
   44    HA   TRP   8           HA       TRP   8  -1.953  -2.926  -4.350
   45    HD1  TRP   8           HD       TRP   8  -0.322  -7.394  -5.312
   46    HE1  TRP   8           1HE      TRP   8  -2.042  -8.797  -3.985
   47    HE3  TRP   8           3HE      TRP   8  -2.681  -3.642  -3.002
   48    HZ2  TRP   8           2HZ      TRP   8  -4.216  -8.289  -2.184
   49    HZ3  TRP   8           3HZ      TRP   8  -4.614  -4.115  -1.618
   50    HH2  TRP   8           HH       TRP   8  -5.387  -6.338  -1.161
   51    HB2  TRP   8           2HB      TRP   8   0.002  -4.822  -5.738
   52    HB3  TRP   8           1HB      TRP   8   0.169  -4.214  -4.101
   53    H    THR   9           H        THR   9  -1.443  -0.792  -4.688
   54    HA   THR   9           HA       THR   9   0.550  -0.150  -6.726
   55    HB   THR   9           HB       THR   9  -1.414   1.262  -6.702
   56    HG1  THR   9           1HG      THR   9  -0.274   2.842  -7.359
   57   HG21  THR   9          3HG2      THR   9  -2.059   1.191  -4.376
   58   HG22  THR   9          1HG2      THR   9  -1.858   2.866  -4.892
   59   HG23  THR   9          2HG2      THR   9  -0.595   2.075  -3.947
   60    H    GLU  10           H        GLU  10   1.463   2.043  -5.846
   61    HA   GLU  10           HA       GLU  10   3.297   1.154  -3.674
   62    HB2  GLU  10           2HB      GLU  10   3.900   2.990  -6.000
   63    HB3  GLU  10           1HB      GLU  10   5.016   2.604  -4.709
   64    HG2  GLU  10           2HG      GLU  10   5.024   0.266  -5.438
   65    HG3  GLU  10           1HG      GLU  10   3.934   0.695  -6.766
   66    H    TYR  11           H        TYR  11   2.729   2.201  -1.928
   67    HA   TYR  11           HA       TYR  11   2.594   5.103  -2.171
   68    HD1  TYR  11           2HD      TYR  11   1.620   6.861  -1.004
   69    HD2  TYR  11           1HD      TYR  11  -1.327   4.173  -2.408
   70    HE1  TYR  11           2HE      TYR  11   0.450   8.758  -2.000
   71    HE2  TYR  11           1HE      TYR  11  -2.545   6.038  -3.461
   72    HH   TYR  11           HH       TYR  11  -2.743   8.515  -3.193
   73    HB2  TYR  11           2HB      TYR  11   0.525   3.351  -1.206
   74    HB3  TYR  11           1HB      TYR  11   1.043   4.453   0.071
   75    H    LYS  12           H        LYS  12   4.718   5.262  -1.661
   76    HA   LYS  12           HA       LYS  12   5.651   4.016   0.791
   77    HB2  LYS  12           2HB      LYS  12   7.152   5.580  -1.331
   78    HB3  LYS  12           1HB      LYS  12   7.898   4.829   0.072
   79    HG2  LYS  12           2HG      LYS  12   8.304   3.231  -1.496
   80    HG3  LYS  12           1HG      LYS  12   6.750   2.664  -0.894
   81    HD2  LYS  12           2HD      LYS  12   6.577   2.560  -3.238
   82    HD3  LYS  12           1HD      LYS  12   5.703   4.022  -2.778
   83    HE2  LYS  12           2HE      LYS  12   7.581   5.398  -3.396
   84    HE3  LYS  12           1HE      LYS  12   8.568   3.973  -3.720
   85    HZ1  LYS  12           3HZ      LYS  12   7.052   3.384  -5.526
   86    HZ2  LYS  12           1HZ      LYS  12   7.721   4.928  -5.761
   87    HZ3  LYS  12           2HZ      LYS  12   6.124   4.777  -5.215
   88    H    THR  13           H        THR  13   5.746   5.036   2.624
   89    HA   THR  13           HA       THR  13   4.976   7.817   2.737
   90    HB   THR  13           HB       THR  13   4.859   7.431   5.175
   91    HG1  THR  13           1HG      THR  13   5.167   5.093   5.758
   92   HG21  THR  13          3HG2      THR  13   3.087   5.738   5.155
   93   HG22  THR  13          1HG2      THR  13   3.571   5.267   3.528
   94   HG23  THR  13          2HG2      THR  13   2.924   6.881   3.823
   95    H    ALA  14           H        ALA  14   6.238   8.946   4.785
   96    HA   ALA  14           HA       ALA  14   8.824   9.490   3.656
   97    HB1  ALA  14           1HB      ALA  14   7.425  11.286   4.542
   98    HB2  ALA  14           2HB      ALA  14   8.981  11.224   5.371
   99    HB3  ALA  14           3HB      ALA  14   7.538  10.584   6.157
  100    H    ASP  15           H        ASP  15   7.773   7.147   5.733
  101    HA   ASP  15           HA       ASP  15   9.996   7.059   7.539
  102    HB2  ASP  15           2HB      ASP  15   7.739   6.063   8.014
  103    HB3  ASP  15           1HB      ASP  15   8.084   4.825   6.810
  104    H    GLY  16           H        GLY  16   9.570   6.323   4.291
  105    HA2  GLY  16           2HA      GLY  16  11.139   5.546   2.773
  106    HA3  GLY  16           1HA      GLY  16  12.192   5.134   4.117
  107    H    LYS  17           H        LYS  17   8.877   4.062   3.817
  108    HA   LYS  17           HA       LYS  17   9.864   1.320   3.382
  109    HB2  LYS  17           2HB      LYS  17   7.408   2.205   4.915
  110    HB3  LYS  17           1HB      LYS  17   7.871   0.539   4.614
  111    HG2  LYS  17           2HG      LYS  17   9.453   2.531   6.222
  112    HG3  LYS  17           1HG      LYS  17   8.424   1.258   6.881
  113    HD2  LYS  17           2HD      LYS  17   9.851  -0.405   5.684
  114    HD3  LYS  17           1HD      LYS  17  10.934   0.917   5.247
  115    HE2  LYS  17           2HE      LYS  17  10.230   0.048   8.049
  116    HE3  LYS  17           1HE      LYS  17  11.746  -0.279   7.215
  117    HZ1  LYS  17           3HZ      LYS  17  12.172   2.097   7.126
  118    HZ2  LYS  17           1HZ      LYS  17  11.950   1.587   8.727
  119    HZ3  LYS  17           2HZ      LYS  17  10.709   2.417   7.927
  120    H    THR  18           H        THR  18   8.775   0.059   1.880
  121    HA   THR  18           HA       THR  18   7.118   1.497  -0.005
  122    HB   THR  18           HB       THR  18   7.929  -1.420  -0.096
  123    HG1  THR  18           1HG      THR  18   9.497  -0.406  -1.697
  124   HG21  THR  18          3HG2      THR  18   7.512  -1.176  -2.514
  125   HG22  THR  18          1HG2      THR  18   6.997   0.490  -2.252
  126   HG23  THR  18          2HG2      THR  18   6.059  -0.841  -1.572
  127    H    TYR  19           H        TYR  19   5.295   1.887   1.213
  128    HA   TYR  19           HA       TYR  19   3.796  -0.350   2.286
  129    HD1  TYR  19           1HD      TYR  19   1.012   0.181   2.715
  130    HD2  TYR  19           2HD      TYR  19   2.331   4.240   3.297
  131    HE1  TYR  19           1HE      TYR  19  -1.297   0.934   2.898
  132    HE2  TYR  19           2HE      TYR  19   0.076   4.913   3.459
  133    HH   TYR  19           HH       TYR  19  -2.132   4.289   2.960
  134    HB2  TYR  19           2HB      TYR  19   3.627   1.334   3.821
  135    HB3  TYR  19           1HB      TYR  19   3.925   2.582   2.636
  136    H    TYR  20           H        TYR  20   1.892  -1.109   1.383
  137    HA   TYR  20           HA       TYR  20   1.455  -0.194  -1.398
  138    HD1  TYR  20           2HD      TYR  20   2.485  -2.300  -3.138
  139    HD2  TYR  20           1HD      TYR  20   2.522  -3.864   0.860
  140    HE1  TYR  20           2HE      TYR  20   4.583  -3.477  -3.605
  141    HE2  TYR  20           1HE      TYR  20   4.609  -5.026   0.356
  142    HH   TYR  20           HH       TYR  20   5.797  -5.914  -1.734
  143    HB2  TYR  20           2HB      TYR  20   0.442  -2.795  -0.155
  144    HB3  TYR  20           1HB      TYR  20   0.453  -2.339  -1.843
  145    H    TYR  21           H        TYR  21  -0.626   0.425  -2.033
  146    HA   TYR  21           HA       TYR  21  -2.619   0.432   0.134
  147    HD1  TYR  21           2HD      TYR  21  -4.868   2.057  -2.648
  148    HD2  TYR  21           1HD      TYR  21  -3.551   3.402   1.204
  149    HE1  TYR  21           2HE      TYR  21  -7.137   2.835  -2.137
  150    HE2  TYR  21           1HE      TYR  21  -5.819   4.159   1.696
  151    HH   TYR  21           HH       TYR  21  -7.850   4.880   0.448
  152    HB2  TYR  21           2HB      TYR  21  -1.935   2.732  -0.525
  153    HB3  TYR  21           1HB      TYR  21  -2.452   2.401  -2.170
  154    H    ASN  22           H        ASN  22  -4.342  -0.660  -0.169
  155    HA   ASN  22           HA       ASN  22  -4.468  -2.463  -2.390
  156    HB2  ASN  22           2HB      ASN  22  -4.903  -3.352  -0.233
  157    HB3  ASN  22           1HB      ASN  22  -5.998  -2.050   0.184
  158   HD21  ASN  22          1HD2      ASN  22  -6.202  -5.037   0.199
  159   HD22  ASN  22          2HD2      ASN  22  -7.662  -5.373  -0.665
  160    H    ASN  23           H        ASN  23  -5.366  -1.928  -4.242
  161    HA   ASN  23           HA       ASN  23  -7.592  -0.033  -4.294
  162    HB2  ASN  23           2HB      ASN  23  -6.035  -1.273  -6.580
  163    HB3  ASN  23           1HB      ASN  23  -7.292  -0.052  -6.747
  164   HD21  ASN  23          1HD2      ASN  23  -6.858   2.066  -6.122
  165   HD22  ASN  23          2HD2      ASN  23  -5.248   2.645  -5.874
  166    H    ARG  24           H        ARG  24  -7.399  -3.135  -3.616
  167    HA   ARG  24           HA       ARG  24  -9.205  -4.361  -5.413
  168    HE   ARG  24           HE       ARG  24 -10.994  -8.867  -3.509
  169    HB2  ARG  24           2HB      ARG  24  -7.742  -5.655  -3.880
  170    HB3  ARG  24           1HB      ARG  24  -8.747  -5.124  -2.536
  171    HG2  ARG  24           2HG      ARG  24 -10.664  -6.266  -3.453
  172    HG3  ARG  24           1HG      ARG  24  -9.753  -6.707  -4.898
  173    HD2  ARG  24           2HD      ARG  24  -8.182  -7.969  -3.408
  174    HD3  ARG  24           1HD      ARG  24  -9.300  -7.664  -2.078
  175   HH11  ARG  24          1HH1      ARG  24  -7.554  -9.503  -3.831
  176   HH12  ARG  24          2HH1      ARG  24  -7.778 -11.151  -4.339
  177   HH21  ARG  24          1HH2      ARG  24 -11.288 -11.011  -4.190
  178   HH22  ARG  24          2HH2      ARG  24  -9.911 -12.008  -4.563
  179    H    THR  25           H        THR  25  -9.922  -3.893  -1.983
  180    HA   THR  25           HA       THR  25 -12.575  -2.880  -2.683
  181    HB   THR  25           HB       THR  25 -12.603  -4.848  -1.248
  182    HG1  THR  25           1HG      THR  25 -13.481  -2.357  -0.212
  183   HG21  THR  25          3HG2      THR  25 -11.029  -3.088   0.596
  184   HG22  THR  25          1HG2      THR  25 -10.477  -4.563  -0.184
  185   HG23  THR  25          2HG2      THR  25 -11.734  -4.640   1.054
  186    H    LEU  26           H        LEU  26  -9.742  -1.595  -2.270
  187    HA   LEU  26           HA       LEU  26  -8.852   0.345  -1.547
  188    HG   LEU  26           HG       LEU  26 -11.449   0.999  -3.109
  189    HB2  LEU  26           2HB      LEU  26 -11.661   1.027  -0.676
  190    HB3  LEU  26           1HB      LEU  26 -10.293   2.120  -0.554
  191   HD11  LEU  26          1HD1      LEU  26 -11.469   3.775  -1.936
  192   HD12  LEU  26          2HD1      LEU  26 -12.859   2.704  -2.126
  193   HD13  LEU  26          3HD1      LEU  26 -12.038   3.350  -3.549
  194   HD21  LEU  26          3HD2      LEU  26  -9.152   2.903  -2.674
  195   HD22  LEU  26          1HD2      LEU  26  -9.863   2.493  -4.237
  196   HD23  LEU  26          2HD2      LEU  26  -9.039   1.253  -3.288
  197    H    GLU  27           H        GLU  27  -7.555  -0.648  -0.193
  198    HA   GLU  27           HA       GLU  27  -8.156  -0.591   2.669
  199    HB2  GLU  27           2HB      GLU  27  -8.656  -2.837   2.468
  200    HB3  GLU  27           1HB      GLU  27  -7.784  -2.993   0.962
  201    HG2  GLU  27           2HG      GLU  27  -5.688  -3.163   2.161
  202    HG3  GLU  27           1HG      GLU  27  -6.522  -2.947   3.688
  203    H    SER  28           H        SER  28  -5.968  -0.998   3.898
  204    HA   SER  28           HA       SER  28  -3.735  -0.152   2.188
  205    HG   SER  28           HG       SER  28  -3.403   2.450   3.598
  206    HB2  SER  28           2HB      SER  28  -4.244   0.387   5.087
  207    HB3  SER  28           1HB      SER  28  -2.682   0.633   4.371
  208    H    THR  29           H        THR  29  -1.743  -1.129   2.437
  209    HA   THR  29           HA       THR  29  -1.582  -3.499   4.134
  210    HB   THR  29           HB       THR  29  -0.330  -4.535   2.086
  211    HG1  THR  29           1HG      THR  29  -0.898  -2.349   0.966
  212   HG21  THR  29          3HG2      THR  29  -2.336  -5.447   3.072
  213   HG22  THR  29          1HG2      THR  29  -2.413  -5.538   1.306
  214   HG23  THR  29          2HG2      THR  29  -3.319  -4.289   2.168
  215    H    TRP  30           H        TRP  30   0.263  -3.531   5.208
  216    HA   TRP  30           HA       TRP  30   2.146  -1.416   4.798
  217    HD1  TRP  30           HD       TRP  30   0.607  -1.918   8.497
  218    HE1  TRP  30           1HE      TRP  30   1.115   0.421   9.456
  219    HE3  TRP  30           3HE      TRP  30   4.776  -0.802   5.750
  220    HZ2  TRP  30           2HZ      TRP  30   3.014   2.495   9.046
  221    HZ3  TRP  30           3HZ      TRP  30   5.881   1.368   6.101
  222    HH2  TRP  30           HH       TRP  30   5.026   2.972   7.729
  223    HB2  TRP  30           2HB      TRP  30   1.752  -3.504   6.821
  224    HB3  TRP  30           1HB      TRP  30   3.452  -3.159   6.487
  225    H    GLU  31           H        GLU  31   2.789  -4.888   4.916
  226    HA   GLU  31           HA       GLU  31   4.796  -4.462   2.823
  227    HB2  GLU  31           2HB      GLU  31   5.900  -6.399   3.684
  228    HB3  GLU  31           1HB      GLU  31   5.667  -5.229   4.967
  229    HG2  GLU  31           2HG      GLU  31   3.520  -6.584   5.462
  230    HG3  GLU  31           1HG      GLU  31   4.320  -7.857   4.544
  231    H    LYS  32           H        LYS  32   5.250  -7.007   2.029
  232    HA   LYS  32           HA       LYS  32   3.637  -7.528  -0.060
  233    HB2  LYS  32           2HB      LYS  32   5.076  -9.575   1.629
  234    HB3  LYS  32           1HB      LYS  32   4.486  -9.849  -0.002
  235    HG2  LYS  32           2HG      LYS  32   6.016  -8.164  -0.856
  236    HG3  LYS  32           1HG      LYS  32   6.582  -7.836   0.783
  237    HD2  LYS  32           2HD      LYS  32   7.368 -10.153   0.968
  238    HD3  LYS  32           1HD      LYS  32   6.816 -10.466  -0.676
  239    HE2  LYS  32           2HE      LYS  32   8.907  -8.439   0.104
  240    HE3  LYS  32           1HE      LYS  32   9.238 -10.041  -0.550
  241    HZ1  LYS  32           3HZ      LYS  32   7.719  -7.907  -1.951
  242    HZ2  LYS  32           1HZ      LYS  32   8.102  -9.432  -2.580
  243    HZ3  LYS  32           2HZ      LYS  32   9.335  -8.312  -2.253
  244    HA   PRO  33           HA       PRO  33  -0.375  -8.838   1.631
  245    HB2  PRO  33           2HB      PRO  33  -0.408  -9.280  -1.343
  246    HB3  PRO  33           1HB      PRO  33  -1.684  -8.633  -0.291
  247    HG2  PRO  33           2HG      PRO  33  -0.282  -6.962  -1.730
  248    HG3  PRO  33           1HG      PRO  33  -0.552  -6.585  -0.015
  249    HD2  PRO  33           2HD      PRO  33   1.894  -7.701  -1.342
  250    HD3  PRO  33           1HD      PRO  33   1.766  -6.459  -0.078
  251    H    GLN  34           H        GLN  34  -1.636 -10.862   1.266
  252    HA   GLN  34           HA       GLN  34  -0.066 -13.185   1.569
  253    HB2  GLN  34           2HB      GLN  34  -2.075 -14.330   1.837
  254    HB3  GLN  34           1HB      GLN  34  -2.528 -12.685   2.240
  255    HG2  GLN  34           2HG      GLN  34  -3.516 -12.354   0.091
  256    HG3  GLN  34           1HG      GLN  34  -2.972 -13.947  -0.436
  257   HE21  GLN  34          1HE2      GLN  34  -4.002 -15.779   0.355
  258   HE22  GLN  34          2HE2      GLN  34  -5.565 -15.695   1.100
  259    H    GLU  35           H        GLU  35  -1.796 -11.798  -1.096
  260    HA   GLU  35           HA       GLU  35  -1.141 -13.804  -3.021
  261    HB2  GLU  35           2HB      GLU  35  -1.865 -10.935  -3.601
  262    HB3  GLU  35           1HB      GLU  35  -2.099 -12.333  -4.638
  263    HG2  GLU  35           2HG      GLU  35  -3.806 -13.184  -3.137
  264    HG3  GLU  35           1HG      GLU  35  -3.543 -11.820  -2.049
  265    H    LEU  36           H        LEU  36  -0.142 -10.420  -2.734
  266    HA   LEU  36           HA       LEU  36   1.902 -10.646  -4.681
  267    HG   LEU  36           HG       LEU  36   3.228  -7.888  -3.202
  268    HB2  LEU  36           2HB      LEU  36   0.623  -8.660  -4.449
  269    HB3  LEU  36           1HB      LEU  36   1.003  -8.544  -2.757
  270   HD11  LEU  36          1HD1      LEU  36   2.504  -8.225  -6.101
  271   HD12  LEU  36          2HD1      LEU  36   3.580  -9.279  -5.186
  272   HD13  LEU  36          3HD1      LEU  36   4.031  -7.597  -5.484
  273   HD21  LEU  36          3HD2      LEU  36   1.204  -6.464  -4.920
  274   HD22  LEU  36          1HD2      LEU  36   2.735  -5.771  -4.356
  275   HD23  LEU  36          2HD2      LEU  36   1.469  -6.203  -3.191
  276    H    LYS  37           H        LYS  37   3.764 -11.642  -4.284
  277    HA   LYS  37           HA       LYS  37   5.214 -10.932  -1.844
  278    HB2  LYS  37           2HB      LYS  37   6.108 -13.295  -1.798
  279    HB3  LYS  37           1HB      LYS  37   4.425 -13.107  -1.335
  280    HG2  LYS  37           2HG      LYS  37   3.782 -13.799  -3.641
  281    HG3  LYS  37           1HG      LYS  37   5.482 -14.142  -3.960
  282    HD2  LYS  37           2HD      LYS  37   4.352 -16.186  -3.353
  283    HD3  LYS  37           1HD      LYS  37   5.474 -15.739  -2.068
  284    HE2  LYS  37           2HE      LYS  37   3.390 -16.463  -1.091
  285    HE3  LYS  37           1HE      LYS  37   3.603 -14.734  -0.820
  286    HZ1  LYS  37           3HZ      LYS  37   1.363 -15.120  -1.478
  287    HZ2  LYS  37           1HZ      LYS  37   1.836 -16.012  -2.840
  288    HZ3  LYS  37           2HZ      LYS  37   2.147 -14.348  -2.763
  289    H1   GLY 101           1HT      GLY 101   0.916  17.876  -9.182
  290    H2   GLY 101           2HT      GLY 101   0.395  19.414  -8.677
  291    H3   GLY 101           3HT      GLY 101  -0.424  18.025  -8.162
  292    HA2  GLY 101           1HA      GLY 101   2.392  18.645  -7.479
  293    HA3  GLY 101           2HA      GLY 101   1.019  18.952  -6.420
  294    HA   PRO 102           HA       PRO 102   2.485  14.474  -6.065
  295    HB2  PRO 102           2HB      PRO 102   3.866  14.545  -3.746
  296    HB3  PRO 102           1HB      PRO 102   4.626  14.890  -5.304
  297    HG2  PRO 102           2HG      PRO 102   3.687  16.785  -3.189
  298    HG3  PRO 102           1HG      PRO 102   5.151  16.853  -4.187
  299    HD2  PRO 102           2HD      PRO 102   2.873  18.306  -4.690
  300    HD3  PRO 102           1HD      PRO 102   4.058  17.852  -5.929
  301    HA   PRO 103           HA       PRO 103  -0.865  13.933  -3.178
  302    HB2  PRO 103           2HB      PRO 103  -0.958  11.260  -3.132
  303    HB3  PRO 103           1HB      PRO 103  -1.426  12.175  -4.571
  304    HG2  PRO 103           2HG      PRO 103   1.135  10.732  -3.995
  305    HG3  PRO 103           1HG      PRO 103   0.200  10.798  -5.500
  306    HD2  PRO 103           2HD      PRO 103   2.425  12.338  -4.991
  307    HD3  PRO 103           1HD      PRO 103   1.147  12.773  -6.141
  308    H    LEU 104           H        LEU 104  -1.102  13.652  -0.969
  309    HA   LEU 104           HA       LEU 104   1.163  12.727   0.560
  310    HG   LEU 104           HG       LEU 104  -2.304  13.917   0.352
  311    HB2  LEU 104           2HB      LEU 104  -0.453  12.948   2.501
  312    HB3  LEU 104           1HB      LEU 104  -0.078  14.421   1.633
  313   HD11  LEU 104          1HD1      LEU 104  -2.650  11.690   1.286
  314   HD12  LEU 104          2HD1      LEU 104  -3.979  12.779   1.685
  315   HD13  LEU 104          3HD1      LEU 104  -2.763  12.390   2.905
  316   HD21  LEU 104          3HD2      LEU 104  -3.537  15.194   2.031
  317   HD22  LEU 104          1HD2      LEU 104  -1.921  15.847   1.778
  318   HD23  LEU 104          2HD2      LEU 104  -2.264  14.875   3.209
  319    H    ILE 105           H        ILE 105   1.299  10.752   1.673
  320    HA   ILE 105           HA       ILE 105  -0.316   8.648   0.542
  321    HB   ILE 105           HB       ILE 105   1.759   8.224   2.746
  322   HG12  ILE 105          2HG1      ILE 105   3.221   7.605   0.662
  323   HG13  ILE 105          1HG1      ILE 105   2.097   8.615  -0.225
  324   HG21  ILE 105          1HG2      ILE 105   1.957   6.019   1.678
  325   HG22  ILE 105          2HG2      ILE 105   0.582   6.434   0.651
  326   HG23  ILE 105          3HG2      ILE 105   0.381   6.336   2.396
  327   HD11  ILE 105          3HD1      ILE 105   2.766  10.535   0.791
  328   HD12  ILE 105          1HD1      ILE 105   4.275   9.655   0.542
  329   HD13  ILE 105          2HD1      ILE 105   3.537   9.698   2.147
  330    HA   PRO 106           HA       PRO 106  -3.085   8.335   4.116
  331    HB2  PRO 106           2HB      PRO 106  -3.764   5.702   3.749
  332    HB3  PRO 106           1HB      PRO 106  -4.509   6.977   2.804
  333    HG2  PRO 106           2HG      PRO 106  -2.280   5.151   2.053
  334    HG3  PRO 106           1HG      PRO 106  -3.665   5.693   1.086
  335    HD2  PRO 106           2HD      PRO 106  -1.219   6.759   0.793
  336    HD3  PRO 106           1HD      PRO 106  -2.697   7.726   0.606
  337    HA   PRO 107           HA       PRO 107  -0.005   6.100   6.513
  338    HB2  PRO 107           2HB      PRO 107  -1.241   5.873   8.919
  339    HB3  PRO 107           1HB      PRO 107  -0.524   7.389   8.363
  340    HG2  PRO 107           2HG      PRO 107  -3.387   6.556   8.429
  341    HG3  PRO 107           1HG      PRO 107  -2.675   8.152   8.711
  342    HD2  PRO 107           2HD      PRO 107  -3.894   7.361   6.353
  343    HD3  PRO 107           1HD      PRO 107  -2.721   8.689   6.488
  344    HA   PRO 108           HA       PRO 108  -1.802   2.020   6.206
  345    HB2  PRO 108           2HB      PRO 108   0.588   0.772   7.123
  346    HB3  PRO 108           1HB      PRO 108   0.001   0.914   5.461
  347    HG2  PRO 108           2HG      PRO 108   2.251   2.163   6.464
  348    HG3  PRO 108           1HG      PRO 108   1.365   2.647   5.002
  349    HD2  PRO 108           2HD      PRO 108   1.317   3.835   7.726
  350    HD3  PRO 108           1HD      PRO 108   1.188   4.589   6.115
  351    HA   PRO 109           HA       PRO 109  -2.845   0.908  10.402
  352    HB2  PRO 109           2HB      PRO 109  -3.959  -1.512   9.817
  353    HB3  PRO 109           1HB      PRO 109  -4.777   0.026   9.521
  354    HG2  PRO 109           2HG      PRO 109  -3.289  -1.720   7.587
  355    HG3  PRO 109           1HG      PRO 109  -4.818  -0.848   7.368
  356    HD2  PRO 109           2HD      PRO 109  -2.443   0.034   6.423
  357    HD3  PRO 109           1HD      PRO 109  -3.756   1.120   6.911
  Start of MODEL    5
    1    H1   GLY   1           1HT      GLY   1  -6.424 -23.874  -6.500
    2    H2   GLY   1           2HT      GLY   1  -8.064 -23.809  -6.070
    3    H3   GLY   1           3HT      GLY   1  -6.900 -23.039  -5.105
    4    HA2  GLY   1           1HA      GLY   1  -7.587 -22.299  -7.893
    5    HA3  GLY   1           2HA      GLY   1  -8.126 -21.447  -6.453
    6    H    ALA   2           H        ALA   2  -7.005 -19.681  -7.742
    7    HA   ALA   2           HA       ALA   2  -4.163 -19.619  -6.955
    8    HB1  ALA   2           1HB      ALA   2  -3.762 -18.112  -8.851
    9    HB2  ALA   2           2HB      ALA   2  -5.450 -18.281  -9.334
   10    HB3  ALA   2           3HB      ALA   2  -4.376 -19.679  -9.378
   11    H    THR   3           H        THR   3  -3.356 -17.348  -6.607
   12    HA   THR   3           HA       THR   3  -4.981 -16.041  -4.700
   13    HB   THR   3           HB       THR   3  -3.141 -14.223  -4.956
   14    HG1  THR   3           1HG      THR   3  -1.198 -15.223  -5.905
   15   HG21  THR   3          3HG2      THR   3  -3.239 -15.782  -3.098
   16   HG22  THR   3          1HG2      THR   3  -1.570 -15.606  -3.640
   17   HG23  THR   3          2HG2      THR   3  -2.494 -17.041  -4.083
   18    H    ALA   4           H        ALA   4  -6.295 -14.329  -4.853
   19    HA   ALA   4           HA       ALA   4  -6.895 -13.325  -7.522
   20    HB1  ALA   4           1HB      ALA   4  -8.830 -12.247  -6.439
   21    HB2  ALA   4           2HB      ALA   4  -8.282 -12.859  -4.878
   22    HB3  ALA   4           3HB      ALA   4  -8.783 -13.985  -6.140
   23    H    VAL   5           H        VAL   5  -5.379 -11.876  -8.085
   24    HA   VAL   5           HA       VAL   5  -4.090 -10.275  -6.104
   25    HB   VAL   5           HB       VAL   5  -2.661 -11.101  -7.748
   26   HG11  VAL   5          1HG1      VAL   5  -2.960 -10.554 -10.146
   27   HG12  VAL   5          2HG1      VAL   5  -4.531  -9.859  -9.730
   28   HG13  VAL   5          3HG1      VAL   5  -4.228 -11.576  -9.472
   29   HG21  VAL   5          3HG2      VAL   5  -3.126  -8.181  -8.322
   30   HG22  VAL   5          1HG2      VAL   5  -1.663  -9.083  -8.720
   31   HG23  VAL   5          2HG2      VAL   5  -2.118  -8.838  -7.032
   32    H    SER   6           H        SER   6  -4.796  -8.493  -5.379
   33    HA   SER   6           HA       SER   6  -6.842  -6.994  -6.732
   34    HG   SER   6           HG       SER   6  -7.184  -8.407  -4.825
   35    HB2  SER   6           2HB      SER   6  -5.557  -6.368  -4.113
   36    HB3  SER   6           1HB      SER   6  -7.100  -5.763  -4.722
   37    H    GLU   7           H        GLU   7  -6.637  -4.542  -6.508
   38    HA   GLU   7           HA       GLU   7  -4.373  -3.841  -8.093
   39    HB2  GLU   7           2HB      GLU   7  -6.551  -2.145  -6.851
   40    HB3  GLU   7           1HB      GLU   7  -5.365  -1.567  -8.020
   41    HG2  GLU   7           2HG      GLU   7  -6.245  -2.892  -9.734
   42    HG3  GLU   7           1HG      GLU   7  -7.156  -3.892  -8.606
   43    H    TRP   8           H        TRP   8  -2.526  -3.731  -7.236
   44    HA   TRP   8           HA       TRP   8  -2.190  -2.717  -4.484
   45    HD1  TRP   8           HD       TRP   8  -0.630  -6.979  -6.210
   46    HE1  TRP   8           1HE      TRP   8  -2.193  -8.703  -5.120
   47    HE3  TRP   8           3HE      TRP   8  -2.925  -3.924  -2.916
   48    HZ2  TRP   8           2HZ      TRP   8  -4.190  -8.722  -3.114
   49    HZ3  TRP   8           3HZ      TRP   8  -4.673  -4.829  -1.511
   50    HH2  TRP   8           HH       TRP   8  -5.311  -7.143  -1.547
   51    HB2  TRP   8           2HB      TRP   8  -0.246  -4.463  -6.042
   52    HB3  TRP   8           1HB      TRP   8  -0.178  -4.077  -4.335
   53    H    THR   9           H        THR   9  -1.623  -0.602  -4.712
   54    HA   THR   9           HA       THR   9   0.350   0.099  -6.745
   55    HB   THR   9           HB       THR   9  -1.284   1.712  -6.843
   56    HG1  THR   9           1HG      THR   9  -0.383   3.629  -6.206
   57   HG21  THR   9          3HG2      THR   9  -2.297   2.869  -4.900
   58   HG22  THR   9          1HG2      THR   9  -1.347   1.818  -3.847
   59   HG23  THR   9          2HG2      THR   9  -2.592   1.125  -4.891
   60    H    GLU  10           H        GLU  10   1.660   1.950  -5.951
   61    HA   GLU  10           HA       GLU  10   3.244   0.910  -3.656
   62    HB2  GLU  10           2HB      GLU  10   4.296   2.534  -5.974
   63    HB3  GLU  10           1HB      GLU  10   5.238   1.778  -4.701
   64    HG2  GLU  10           2HG      GLU  10   4.688  -0.413  -5.542
   65    HG3  GLU  10           1HG      GLU  10   3.637   0.295  -6.774
   66    H    TYR  11           H        TYR  11   2.630   2.152  -2.021
   67    HA   TYR  11           HA       TYR  11   2.758   5.060  -2.414
   68    HD1  TYR  11           2HD      TYR  11   1.929   6.898  -1.411
   69    HD2  TYR  11           1HD      TYR  11  -1.347   4.448  -2.532
   70    HE1  TYR  11           2HE      TYR  11   0.824   8.873  -2.343
   71    HE2  TYR  11           1HE      TYR  11  -2.482   6.401  -3.504
   72    HH   TYR  11           HH       TYR  11  -2.426   8.926  -3.157
   73    HB2  TYR  11           2HB      TYR  11   0.538   3.466  -1.587
   74    HB3  TYR  11           1HB      TYR  11   1.049   4.461  -0.225
   75    H    LYS  12           H        LYS  12   4.798   5.320  -1.615
   76    HA   LYS  12           HA       LYS  12   5.519   3.930   0.842
   77    HB2  LYS  12           2HB      LYS  12   7.158   5.533  -1.133
   78    HB3  LYS  12           1HB      LYS  12   7.820   4.722   0.283
   79    HG2  LYS  12           2HG      LYS  12   7.663   2.668  -0.649
   80    HG3  LYS  12           1HG      LYS  12   6.205   3.068  -1.557
   81    HD2  LYS  12           2HD      LYS  12   8.959   4.089  -2.243
   82    HD3  LYS  12           1HD      LYS  12   8.225   2.659  -2.968
   83    HE2  LYS  12           2HE      LYS  12   6.351   4.068  -3.760
   84    HE3  LYS  12           1HE      LYS  12   7.169   5.484  -3.102
   85    HZ1  LYS  12           3HZ      LYS  12   9.031   5.041  -4.603
   86    HZ2  LYS  12           1HZ      LYS  12   7.582   5.276  -5.458
   87    HZ3  LYS  12           2HZ      LYS  12   8.200   3.709  -5.253
   88    H    THR  13           H        THR  13   5.587   4.873   2.737
   89    HA   THR  13           HA       THR  13   4.845   7.677   2.916
   90    HB   THR  13           HB       THR  13   4.536   7.239   5.308
   91    HG1  THR  13           1HG      THR  13   5.326   5.475   6.251
   92   HG21  THR  13          3HG2      THR  13   3.355   5.060   3.596
   93   HG22  THR  13          1HG2      THR  13   2.717   6.692   3.779
   94   HG23  THR  13          2HG2      THR  13   2.745   5.598   5.163
   95    H    ALA  14           H        ALA  14   5.951   8.737   5.036
   96    HA   ALA  14           HA       ALA  14   8.683   9.120   4.251
   97    HB1  ALA  14           1HB      ALA  14   7.287  10.975   5.023
   98    HB2  ALA  14           2HB      ALA  14   8.750  10.804   5.994
   99    HB3  ALA  14           3HB      ALA  14   7.206  10.241   6.627
  100    H    ASP  15           H        ASP  15   7.339   6.695   5.944
  101    HA   ASP  15           HA       ASP  15   9.238   6.422   8.091
  102    HB2  ASP  15           2HB      ASP  15   7.382   4.366   6.854
  103    HB3  ASP  15           1HB      ASP  15   8.276   4.164   8.356
  104    H    GLY  16           H        GLY  16   9.255   5.900   4.750
  105    HA2  GLY  16           2HA      GLY  16  11.028   5.224   3.413
  106    HA3  GLY  16           1HA      GLY  16  11.903   4.743   4.861
  107    H    LYS  17           H        LYS  17   8.659   3.670   4.224
  108    HA   LYS  17           HA       LYS  17   9.706   1.006   3.532
  109    HB2  LYS  17           2HB      LYS  17   7.267   1.682   5.193
  110    HB3  LYS  17           1HB      LYS  17   7.696   0.064   4.659
  111    HG2  LYS  17           2HG      LYS  17   9.390   1.793   6.451
  112    HG3  LYS  17           1HG      LYS  17   8.308   0.515   7.004
  113    HD2  LYS  17           2HD      LYS  17  10.633   0.107   5.123
  114    HD3  LYS  17           1HD      LYS  17  10.684  -0.186   6.860
  115    HE2  LYS  17           2HE      LYS  17   8.747  -1.545   4.994
  116    HE3  LYS  17           1HE      LYS  17  10.314  -2.222   5.432
  117    HZ1  LYS  17           3HZ      LYS  17   8.109  -1.586   7.323
  118    HZ2  LYS  17           1HZ      LYS  17   9.621  -2.210   7.755
  119    HZ3  LYS  17           2HZ      LYS  17   8.562  -3.136   6.808
  120    H    THR  18           H        THR  18   8.604  -0.145   1.946
  121    HA   THR  18           HA       THR  18   7.034   1.449   0.126
  122    HB   THR  18           HB       THR  18   7.791  -1.476  -0.096
  123    HG1  THR  18           1HG      THR  18   9.533  -0.653  -1.375
  124   HG21  THR  18          3HG2      THR  18   5.972  -0.802  -1.597
  125   HG22  THR  18          1HG2      THR  18   7.449  -1.117  -2.505
  126   HG23  THR  18          2HG2      THR  18   6.947   0.545  -2.185
  127    H    TYR  19           H        TYR  19   5.094   1.811   1.062
  128    HA   TYR  19           HA       TYR  19   3.554  -0.399   2.148
  129    HD1  TYR  19           2HD      TYR  19   0.810   0.124   2.525
  130    HD2  TYR  19           1HD      TYR  19   2.100   4.176   3.067
  131    HE1  TYR  19           2HE      TYR  19  -1.515   0.862   2.683
  132    HE2  TYR  19           1HE      TYR  19  -0.168   4.849   3.244
  133    HH   TYR  19           HH       TYR  19  -2.811   2.725   3.600
  134    HB2  TYR  19           2HB      TYR  19   3.382   1.296   3.656
  135    HB3  TYR  19           1HB      TYR  19   3.693   2.535   2.464
  136    H    TYR  20           H        TYR  20   1.656  -1.138   1.245
  137    HA   TYR  20           HA       TYR  20   1.128  -0.180  -1.504
  138    HD1  TYR  20           1HD      TYR  20   2.645  -3.221   0.651
  139    HD2  TYR  20           2HD      TYR  20   1.664  -2.856  -3.492
  140    HE1  TYR  20           1HE      TYR  20   4.708  -4.383   0.047
  141    HE2  TYR  20           2HE      TYR  20   3.738  -4.023  -4.082
  142    HH   TYR  20           HH       TYR  20   5.979  -4.417  -3.073
  143    HB2  TYR  20           2HB      TYR  20   0.200  -2.805  -0.262
  144    HB3  TYR  20           1HB      TYR  20   0.059  -2.315  -1.937
  145    H    TYR  21           H        TYR  21  -0.908   0.588  -2.020
  146    HA   TYR  21           HA       TYR  21  -2.907   0.470   0.142
  147    HD1  TYR  21           2HD      TYR  21  -5.098   2.294  -2.622
  148    HD2  TYR  21           1HD      TYR  21  -3.865   3.333   1.341
  149    HE1  TYR  21           2HE      TYR  21  -7.364   3.064  -2.118
  150    HE2  TYR  21           1HE      TYR  21  -6.146   4.086   1.836
  151    HH   TYR  21           HH       TYR  21  -8.804   3.448  -0.218
  152    HB2  TYR  21           2HB      TYR  21  -2.207   2.794  -0.380
  153    HB3  TYR  21           1HB      TYR  21  -2.693   2.554  -2.053
  154    H    ASN  22           H        ASN  22  -4.749  -0.482  -0.262
  155    HA   ASN  22           HA       ASN  22  -4.782  -2.130  -2.676
  156    HB2  ASN  22           2HB      ASN  22  -6.511  -2.277  -0.182
  157    HB3  ASN  22           1HB      ASN  22  -6.389  -3.495  -1.439
  158   HD21  ASN  22          1HD2      ASN  22  -3.429  -1.999  -0.528
  159   HD22  ASN  22          2HD2      ASN  22  -2.826  -3.299   0.445
  160    H    ASN  23           H        ASN  23  -6.098  -1.501  -4.338
  161    HA   ASN  23           HA       ASN  23  -8.429   0.144  -3.732
  162    HB2  ASN  23           2HB      ASN  23  -6.949   0.590  -5.740
  163    HB3  ASN  23           1HB      ASN  23  -7.585  -0.888  -6.450
  164   HD21  ASN  23          1HD2      ASN  23  -9.543  -0.850  -7.426
  165   HD22  ASN  23          2HD2      ASN  23 -10.538   0.564  -7.539
  166    H    ARG  24           H        ARG  24  -7.865  -2.869  -3.191
  167    HA   ARG  24           HA       ARG  24  -9.790  -4.412  -4.499
  168    HE   ARG  24           HE       ARG  24 -10.705  -8.692  -1.442
  169    HB2  ARG  24           2HB      ARG  24  -7.980  -5.316  -3.059
  170    HB3  ARG  24           1HB      ARG  24  -8.856  -4.741  -1.647
  171    HG2  ARG  24           2HG      ARG  24 -10.709  -6.218  -2.157
  172    HG3  ARG  24           1HG      ARG  24  -9.900  -6.755  -3.631
  173    HD2  ARG  24           2HD      ARG  24  -8.064  -7.663  -2.285
  174    HD3  ARG  24           1HD      ARG  24  -8.879  -7.130  -0.815
  175   HH11  ARG  24          1HH1      ARG  24  -7.534  -9.155  -2.856
  176   HH12  ARG  24          2HH1      ARG  24  -7.698 -10.880  -2.987
  177   HH21  ARG  24          1HH2      ARG  24 -10.922 -10.966  -1.607
  178   HH22  ARG  24          2HH2      ARG  24  -9.612 -11.908  -2.271
  179    H    THR  25           H        THR  25 -10.299  -4.039  -1.066
  180    HA   THR  25           HA       THR  25 -12.974  -2.991  -1.565
  181    HB   THR  25           HB       THR  25 -12.900  -5.042  -0.262
  182    HG1  THR  25           1HG      THR  25 -13.662  -2.685   1.146
  183   HG21  THR  25          3HG2      THR  25 -11.854  -5.048   1.946
  184   HG22  THR  25          1HG2      THR  25 -11.274  -3.408   1.656
  185   HG23  THR  25          2HG2      THR  25 -10.683  -4.733   0.663
  186    H    LEU  26           H        LEU  26 -10.453  -1.457  -1.651
  187    HA   LEU  26           HA       LEU  26  -9.362   0.345  -0.855
  188    HG   LEU  26           HG       LEU  26 -12.118   1.157  -1.846
  189    HB2  LEU  26           2HB      LEU  26 -11.972   0.823   0.578
  190    HB3  LEU  26           1HB      LEU  26 -10.615   1.933   0.656
  191   HD11  LEU  26          1HD1      LEU  26 -13.432   2.598  -0.409
  192   HD12  LEU  26          2HD1      LEU  26 -12.861   3.503  -1.809
  193   HD13  LEU  26          3HD1      LEU  26 -12.074   3.712  -0.245
  194   HD21  LEU  26          3HD2      LEU  26 -10.761   2.810  -2.970
  195   HD22  LEU  26          1HD2      LEU  26  -9.716   1.599  -2.228
  196   HD23  LEU  26          2HD2      LEU  26  -9.913   3.179  -1.469
  197    H    GLU  27           H        GLU  27  -7.917  -1.034   0.084
  198    HA   GLU  27           HA       GLU  27  -8.070  -1.236   3.017
  199    HB2  GLU  27           2HB      GLU  27  -8.520  -3.449   1.954
  200    HB3  GLU  27           1HB      GLU  27  -7.005  -3.324   1.089
  201    HG2  GLU  27           2HG      GLU  27  -6.843  -4.814   3.008
  202    HG3  GLU  27           1HG      GLU  27  -5.759  -3.429   3.150
  203    H    SER  28           H        SER  28  -5.915  -1.376   4.022
  204    HA   SER  28           HA       SER  28  -3.779  -0.415   2.245
  205    HG   SER  28           HG       SER  28  -4.978   1.476   3.087
  206    HB2  SER  28           2HB      SER  28  -4.304   0.184   5.140
  207    HB3  SER  28           1HB      SER  28  -2.736   0.465   4.408
  208    H    THR  29           H        THR  29  -1.744  -1.313   2.468
  209    HA   THR  29           HA       THR  29  -1.432  -3.622   4.243
  210    HB   THR  29           HB       THR  29  -0.181  -4.700   2.246
  211    HG1  THR  29           1HG      THR  29  -0.597  -2.635   1.009
  212   HG21  THR  29          3HG2      THR  29  -2.152  -5.680   3.162
  213   HG22  THR  29          1HG2      THR  29  -2.265  -5.724   1.394
  214   HG23  THR  29          2HG2      THR  29  -3.177  -4.520   2.309
  215    H    TRP  30           H        TRP  30   0.549  -3.694   5.135
  216    HA   TRP  30           HA       TRP  30   2.190  -1.376   4.710
  217    HD1  TRP  30           HD       TRP  30   0.648  -1.934   8.208
  218    HE1  TRP  30           1HE      TRP  30   0.975   0.415   9.220
  219    HE3  TRP  30           3HE      TRP  30   5.002  -0.635   5.853
  220    HZ2  TRP  30           2HZ      TRP  30   2.816   2.572   8.982
  221    HZ3  TRP  30           3HZ      TRP  30   5.974   1.579   6.296
  222    HH2  TRP  30           HH       TRP  30   4.914   3.139   7.841
  223    HB2  TRP  30           2HB      TRP  30   2.124  -3.519   6.714
  224    HB3  TRP  30           1HB      TRP  30   3.751  -2.953   6.318
  225    H    GLU  31           H        GLU  31   3.216  -4.777   4.689
  226    HA   GLU  31           HA       GLU  31   4.808  -4.083   2.329
  227    HB2  GLU  31           2HB      GLU  31   5.245  -6.241   4.386
  228    HB3  GLU  31           1HB      GLU  31   6.164  -6.084   2.892
  229    HG2  GLU  31           2HG      GLU  31   7.012  -3.965   3.531
  230    HG3  GLU  31           1HG      GLU  31   5.938  -3.896   4.926
  231    H    LYS  32           H        LYS  32   5.295  -6.526   1.277
  232    HA   LYS  32           HA       LYS  32   3.439  -6.809  -0.595
  233    HB2  LYS  32           2HB      LYS  32   5.089  -9.039   0.571
  234    HB3  LYS  32           1HB      LYS  32   4.258  -9.116  -0.979
  235    HG2  LYS  32           2HG      LYS  32   5.580  -7.126  -1.702
  236    HG3  LYS  32           1HG      LYS  32   6.497  -7.257  -0.203
  237    HD2  LYS  32           2HD      LYS  32   6.273  -9.442  -2.269
  238    HD3  LYS  32           1HD      LYS  32   7.607  -8.293  -2.174
  239    HE2  LYS  32           2HE      LYS  32   8.091  -9.097   0.111
  240    HE3  LYS  32           1HE      LYS  32   6.808 -10.294  -0.061
  241    HZ1  LYS  32           3HZ      LYS  32   9.287 -10.116  -1.689
  242    HZ2  LYS  32           1HZ      LYS  32   8.022 -11.209  -1.979
  243    HZ3  LYS  32           2HZ      LYS  32   8.912 -11.309  -0.542
  244    HA   PRO  33           HA       PRO  33  -0.413  -8.007   1.393
  245    HB2  PRO  33           2HB      PRO  33  -0.823  -8.310  -1.567
  246    HB3  PRO  33           1HB      PRO  33  -1.908  -7.617  -0.364
  247    HG2  PRO  33           2HG      PRO  33  -0.504  -6.014  -1.902
  248    HG3  PRO  33           1HG      PRO  33  -0.656  -5.657  -0.171
  249    HD2  PRO  33           2HD      PRO  33   1.665  -6.755  -1.683
  250    HD3  PRO  33           1HD      PRO  33   1.639  -5.679  -0.273
  251    H    GLN  34           H        GLN  34  -1.637  -9.904   1.554
  252    HA   GLN  34           HA       GLN  34  -0.444 -12.392   1.243
  253    HB2  GLN  34           2HB      GLN  34  -3.376 -11.654   1.289
  254    HB3  GLN  34           1HB      GLN  34  -2.781 -13.306   1.383
  255    HG2  GLN  34           2HG      GLN  34  -2.019 -11.161   3.339
  256    HG3  GLN  34           1HG      GLN  34  -3.395 -12.239   3.562
  257   HE21  GLN  34          1HE2      GLN  34  -3.037 -14.405   3.997
  258   HE22  GLN  34          2HE2      GLN  34  -1.498 -15.003   4.512
  259    H    GLU  35           H        GLU  35  -2.693 -10.686  -0.887
  260    HA   GLU  35           HA       GLU  35  -2.495 -12.783  -2.893
  261    HB2  GLU  35           2HB      GLU  35  -4.084 -10.210  -2.970
  262    HB3  GLU  35           1HB      GLU  35  -4.255 -11.580  -4.056
  263    HG2  GLU  35           2HG      GLU  35  -4.851 -11.601  -1.104
  264    HG3  GLU  35           1HG      GLU  35  -6.042 -11.485  -2.397
  265    H    LEU  36           H        LEU  36  -0.258 -10.875  -2.166
  266    HA   LEU  36           HA       LEU  36   0.271  -9.498  -4.645
  267    HG   LEU  36           HG       LEU  36   3.020  -7.797  -2.958
  268    HB2  LEU  36           2HB      LEU  36   1.130  -9.004  -2.210
  269    HB3  LEU  36           1HB      LEU  36   2.403 -10.089  -2.688
  270   HD11  LEU  36          1HD1      LEU  36   3.723  -7.841  -5.292
  271   HD12  LEU  36          2HD1      LEU  36   2.631  -9.202  -5.540
  272   HD13  LEU  36          3HD1      LEU  36   3.995  -9.361  -4.441
  273   HD21  LEU  36          3HD2      LEU  36   0.760  -7.539  -4.906
  274   HD22  LEU  36          1HD2      LEU  36   1.983  -6.318  -4.564
  275   HD23  LEU  36          2HD2      LEU  36   0.833  -6.788  -3.310
  276    H    LYS  37           H        LYS  37   0.742 -12.470  -3.190
  277    HA   LYS  37           HA       LYS  37   2.465 -13.448  -5.376
  278    HB2  LYS  37           2HB      LYS  37   2.497 -14.751  -2.686
  279    HB3  LYS  37           1HB      LYS  37   3.758 -14.689  -3.907
  280    HG2  LYS  37           2HG      LYS  37   4.578 -12.717  -3.166
  281    HG3  LYS  37           1HG      LYS  37   3.002 -12.132  -2.631
  282    HD2  LYS  37           2HD      LYS  37   4.569 -14.304  -1.236
  283    HD3  LYS  37           1HD      LYS  37   4.610 -12.602  -0.776
  284    HE2  LYS  37           2HE      LYS  37   3.057 -13.664   0.670
  285    HE3  LYS  37           1HE      LYS  37   2.118 -12.719  -0.479
  286    HZ1  LYS  37           3HZ      LYS  37   1.622 -14.728  -1.705
  287    HZ2  LYS  37           1HZ      LYS  37   1.176 -14.928  -0.080
  288    HZ3  LYS  37           2HZ      LYS  37   2.591 -15.654  -0.667
  289    H1   GLY 101           1HT      GLY 101   1.104  18.265  -8.812
  290    H2   GLY 101           2HT      GLY 101   2.572  17.737  -9.471
  291    H3   GLY 101           3HT      GLY 101   2.407  19.338  -8.939
  292    HA2  GLY 101           1HA      GLY 101   3.671  18.087  -7.342
  293    HA3  GLY 101           2HA      GLY 101   2.125  18.582  -6.664
  294    HA   PRO 102           HA       PRO 102   2.611  13.837  -6.700
  295    HB2  PRO 102           2HB      PRO 102   4.073  13.299  -4.508
  296    HB3  PRO 102           1HB      PRO 102   4.835  13.632  -6.069
  297    HG2  PRO 102           2HG      PRO 102   4.447  15.452  -3.723
  298    HG3  PRO 102           1HG      PRO 102   5.873  15.252  -4.757
  299    HD2  PRO 102           2HD      PRO 102   4.065  17.283  -5.041
  300    HD3  PRO 102           1HD      PRO 102   5.045  16.644  -6.373
  301    HA   PRO 103           HA       PRO 103  -0.648  13.886  -3.681
  302    HB2  PRO 103           2HB      PRO 103  -1.274  11.265  -3.656
  303    HB3  PRO 103           1HB      PRO 103  -1.645  12.298  -5.038
  304    HG2  PRO 103           2HG      PRO 103   0.603  10.361  -4.673
  305    HG3  PRO 103           1HG      PRO 103  -0.388  10.667  -6.111
  306    HD2  PRO 103           2HD      PRO 103   2.126  11.698  -5.738
  307    HD3  PRO 103           1HD      PRO 103   0.884  12.455  -6.753
  308    H    LEU 104           H        LEU 104  -0.928  13.520  -1.493
  309    HA   LEU 104           HA       LEU 104   1.334  12.517  -0.018
  310    HG   LEU 104           HG       LEU 104   1.361  14.748   1.105
  311    HB2  LEU 104           2HB      LEU 104  -1.380  13.518   0.857
  312    HB3  LEU 104           1HB      LEU 104  -0.166  12.939   1.978
  313   HD11  LEU 104          1HD1      LEU 104  -1.186  15.770  -0.134
  314   HD12  LEU 104          2HD1      LEU 104   0.245  15.213  -1.001
  315   HD13  LEU 104          3HD1      LEU 104   0.330  16.660   0.001
  316   HD21  LEU 104          3HD2      LEU 104  -1.208  15.589   2.436
  317   HD22  LEU 104          1HD2      LEU 104   0.298  16.507   2.433
  318   HD23  LEU 104          2HD2      LEU 104   0.221  14.940   3.239
  319    H    ILE 105           H        ILE 105   1.369  10.657   1.276
  320    HA   ILE 105           HA       ILE 105  -0.304   8.525   0.299
  321    HB   ILE 105           HB       ILE 105   1.690   8.170   2.556
  322   HG12  ILE 105          2HG1      ILE 105   3.255   7.539   0.557
  323   HG13  ILE 105          1HG1      ILE 105   2.198   8.578  -0.379
  324   HG21  ILE 105          1HG2      ILE 105   0.832   6.351   0.336
  325   HG22  ILE 105          2HG2      ILE 105   0.225   6.310   1.992
  326   HG23  ILE 105          3HG2      ILE 105   1.924   5.963   1.665
  327   HD11  ILE 105          3HD1      ILE 105   4.320   9.601   0.501
  328   HD12  ILE 105          1HD1      ILE 105   3.561   9.551   2.093
  329   HD13  ILE 105          2HD1      ILE 105   2.815  10.476   0.782
  330    HA   PRO 106           HA       PRO 106  -2.996   8.408   3.965
  331    HB2  PRO 106           2HB      PRO 106  -3.754   5.792   3.684
  332    HB3  PRO 106           1HB      PRO 106  -4.494   7.066   2.723
  333    HG2  PRO 106           2HG      PRO 106  -2.333   5.155   1.982
  334    HG3  PRO 106           1HG      PRO 106  -3.724   5.702   1.023
  335    HD2  PRO 106           2HD      PRO 106  -1.241   6.686   0.659
  336    HD3  PRO 106           1HD      PRO 106  -2.693   7.682   0.435
  337    HA   PRO 107           HA       PRO 107   0.072   6.112   6.354
  338    HB2  PRO 107           2HB      PRO 107  -1.140   5.947   8.780
  339    HB3  PRO 107           1HB      PRO 107  -0.387   7.438   8.201
  340    HG2  PRO 107           2HG      PRO 107  -3.272   6.683   8.298
  341    HG3  PRO 107           1HG      PRO 107  -2.519   8.261   8.571
  342    HD2  PRO 107           2HD      PRO 107  -3.775   7.490   6.236
  343    HD3  PRO 107           1HD      PRO 107  -2.566   8.783   6.351
  344    HA   PRO 108           HA       PRO 108  -1.818   2.068   6.127
  345    HB2  PRO 108           2HB      PRO 108   0.612   0.816   6.940
  346    HB3  PRO 108           1HB      PRO 108  -0.043   0.953   5.299
  347    HG2  PRO 108           2HG      PRO 108   2.252   2.209   6.209
  348    HG3  PRO 108           1HG      PRO 108   1.297   2.700   4.791
  349    HD2  PRO 108           2HD      PRO 108   1.352   3.866   7.528
  350    HD3  PRO 108           1HD      PRO 108   1.176   4.634   5.931
  351    HA   PRO 109           HA       PRO 109  -2.574   1.047  10.426
  352    HB2  PRO 109           2HB      PRO 109  -3.901  -1.265  10.012
  353    HB3  PRO 109           1HB      PRO 109  -4.628   0.308   9.666
  354    HG2  PRO 109           2HG      PRO 109  -3.326  -1.629   7.784
  355    HG3  PRO 109           1HG      PRO 109  -4.845  -0.730   7.586
  356    HD2  PRO 109           2HD      PRO 109  -2.501   0.033   6.462
  357    HD3  PRO 109           1HD      PRO 109  -3.754   1.188   6.961
  Start of MODEL    6
    1    H1   GLY   1           1HT      GLY   1  -5.363 -21.930 -11.363
    2    H2   GLY   1           2HT      GLY   1  -4.610 -21.102 -10.085
    3    H3   GLY   1           3HT      GLY   1  -3.964 -21.013 -11.647
    4    HA2  GLY   1           1HA      GLY   1  -5.144 -18.984 -11.072
    5    HA3  GLY   1           2HA      GLY   1  -5.883 -19.816 -12.433
    6    H    ALA   2           H        ALA   2  -6.288 -18.655  -9.254
    7    HA   ALA   2           HA       ALA   2  -9.133 -19.267  -9.392
    8    HB1  ALA   2           1HB      ALA   2  -8.219 -21.181  -8.191
    9    HB2  ALA   2           2HB      ALA   2  -9.222 -20.191  -7.133
   10    HB3  ALA   2           3HB      ALA   2  -7.464 -20.101  -7.021
   11    H    THR   3           H        THR   3  -6.453 -17.568  -7.958
   12    HA   THR   3           HA       THR   3  -8.274 -15.698  -6.635
   13    HB   THR   3           HB       THR   3  -6.231 -14.837  -5.513
   14    HG1  THR   3           1HG      THR   3  -4.287 -15.673  -5.938
   15   HG21  THR   3          3HG2      THR   3  -5.880 -16.798  -4.073
   16   HG22  THR   3          1HG2      THR   3  -6.684 -17.814  -5.270
   17   HG23  THR   3          2HG2      THR   3  -7.589 -16.554  -4.435
   18    H    ALA   4           H        ALA   4  -7.797 -13.396  -6.802
   19    HA   ALA   4           HA       ALA   4  -6.651 -12.688  -9.415
   20    HB1  ALA   4           1HB      ALA   4  -9.038 -11.425  -8.066
   21    HB2  ALA   4           2HB      ALA   4  -9.084 -12.485  -9.475
   22    HB3  ALA   4           3HB      ALA   4  -8.319 -10.899  -9.588
   23    H    VAL   5           H        VAL   5  -5.288 -10.944  -9.469
   24    HA   VAL   5           HA       VAL   5  -4.259  -9.991  -6.954
   25    HB   VAL   5           HB       VAL   5  -3.554  -9.077  -9.742
   26   HG11  VAL   5          1HG1      VAL   5  -1.986  -8.830  -7.176
   27   HG12  VAL   5          2HG1      VAL   5  -2.842  -7.524  -7.999
   28   HG13  VAL   5          3HG1      VAL   5  -1.465  -8.302  -8.778
   29   HG21  VAL   5          3HG2      VAL   5  -1.645 -10.616  -9.589
   30   HG22  VAL   5          1HG2      VAL   5  -3.194 -11.457  -9.576
   31   HG23  VAL   5          2HG2      VAL   5  -2.295 -11.241  -8.074
   32    H    SER   6           H        SER   6  -4.885  -8.244  -5.941
   33    HA   SER   6           HA       SER   6  -6.913  -6.530  -7.019
   34    HG   SER   6           HG       SER   6  -7.507  -8.019  -5.294
   35    HB2  SER   6           2HB      SER   6  -5.507  -6.298  -4.396
   36    HB3  SER   6           1HB      SER   6  -7.050  -5.570  -4.850
   37    H    GLU   7           H        GLU   7  -6.647  -4.101  -6.563
   38    HA   GLU   7           HA       GLU   7  -4.346  -3.263  -8.021
   39    HB2  GLU   7           2HB      GLU   7  -6.411  -1.629  -6.519
   40    HB3  GLU   7           1HB      GLU   7  -5.156  -0.953  -7.548
   41    HG2  GLU   7           2HG      GLU   7  -6.974  -0.951  -8.946
   42    HG3  GLU   7           1HG      GLU   7  -6.182  -2.463  -9.378
   43    H    TRP   8           H        TRP   8  -2.495  -3.389  -7.147
   44    HA   TRP   8           HA       TRP   8  -2.135  -2.689  -4.295
   45    HD1  TRP   8           HD       TRP   8  -0.641  -6.922  -6.198
   46    HE1  TRP   8           1HE      TRP   8  -2.271  -8.607  -5.135
   47    HE3  TRP   8           3HE      TRP   8  -2.976  -3.793  -3.029
   48    HZ2  TRP   8           2HZ      TRP   8  -4.343  -8.567  -3.188
   49    HZ3  TRP   8           3HZ      TRP   8  -4.806  -4.625  -1.674
   50    HH2  TRP   8           HH       TRP   8  -5.488  -6.946  -1.693
   51    HB2  TRP   8           2HB      TRP   8  -0.311  -4.374  -6.077
   52    HB3  TRP   8           1HB      TRP   8  -0.105  -4.099  -4.358
   53    H    THR   9           H        THR   9  -1.537  -0.535  -4.423
   54    HA   THR   9           HA       THR   9   0.390   0.214  -6.480
   55    HB   THR   9           HB       THR   9  -0.942   1.963  -6.597
   56    HG1  THR   9           1HG      THR   9   0.466   2.730  -4.267
   57   HG21  THR   9          3HG2      THR   9  -2.655   1.059  -5.096
   58   HG22  THR   9          1HG2      THR   9  -2.454   2.791  -4.824
   59   HG23  THR   9          2HG2      THR   9  -1.736   1.629  -3.699
   60    H    GLU  10           H        GLU  10   2.039   1.625  -5.983
   61    HA   GLU  10           HA       GLU  10   3.427   0.739  -3.534
   62    HB2  GLU  10           2HB      GLU  10   4.862   2.210  -5.717
   63    HB3  GLU  10           1HB      GLU  10   5.466   0.976  -4.627
   64    HG2  GLU  10           2HG      GLU  10   5.441  -0.219  -6.554
   65    HG3  GLU  10           1HG      GLU  10   3.802  -0.554  -5.998
   66    H    TYR  11           H        TYR  11   2.794   2.129  -2.019
   67    HA   TYR  11           HA       TYR  11   3.110   5.003  -2.565
   68    HD1  TYR  11           2HD      TYR  11   2.392   6.912  -1.783
   69    HD2  TYR  11           1HD      TYR  11  -1.138   4.724  -2.661
   70    HE1  TYR  11           2HE      TYR  11   1.381   8.943  -2.740
   71    HE2  TYR  11           1HE      TYR  11  -2.151   6.737  -3.636
   72    HH   TYR  11           HH       TYR  11  -1.887   9.219  -3.405
   73    HB2  TYR  11           2HB      TYR  11   0.742   3.590  -1.885
   74    HB3  TYR  11           1HB      TYR  11   1.206   4.515  -0.466
   75    H    LYS  12           H        LYS  12   5.088   5.241  -1.611
   76    HA   LYS  12           HA       LYS  12   5.570   3.954   0.953
   77    HB2  LYS  12           2HB      LYS  12   7.789   5.565   0.173
   78    HB3  LYS  12           1HB      LYS  12   7.676   3.810   0.220
   79    HG2  LYS  12           2HG      LYS  12   6.786   3.809  -2.065
   80    HG3  LYS  12           1HG      LYS  12   6.921   5.570  -2.111
   81    HD2  LYS  12           2HD      LYS  12   9.325   5.420  -1.831
   82    HD3  LYS  12           1HD      LYS  12   9.222   3.664  -1.676
   83    HE2  LYS  12           2HE      LYS  12   9.946   4.207  -3.902
   84    HE3  LYS  12           1HE      LYS  12   8.309   3.571  -3.979
   85    HZ1  LYS  12           3HZ      LYS  12   8.905   6.474  -3.950
   86    HZ2  LYS  12           1HZ      LYS  12   7.431   5.721  -4.333
   87    HZ3  LYS  12           2HZ      LYS  12   8.763   5.574  -5.380
   88    H    THR  13           H        THR  13   5.511   4.930   2.839
   89    HA   THR  13           HA       THR  13   4.635   7.686   2.926
   90    HB   THR  13           HB       THR  13   4.376   7.244   5.375
   91    HG1  THR  13           1HG      THR  13   5.184   5.462   6.223
   92   HG21  THR  13          3HG2      THR  13   3.092   5.265   3.511
   93   HG22  THR  13          1HG2      THR  13   2.506   6.876   3.901
   94   HG23  THR  13          2HG2      THR  13   2.532   5.625   5.142
   95    H    ALA  14           H        ALA  14   5.600   8.717   5.226
   96    HA   ALA  14           HA       ALA  14   8.228   9.519   4.403
   97    HB1  ALA  14           1HB      ALA  14   6.722  10.251   6.915
   98    HB2  ALA  14           2HB      ALA  14   6.623  11.109   5.379
   99    HB3  ALA  14           3HB      ALA  14   8.147  11.071   6.266
  100    H    ASP  15           H        ASP  15   7.170   6.884   6.014
  101    HA   ASP  15           HA       ASP  15   9.238   6.627   7.989
  102    HB2  ASP  15           2HB      ASP  15   7.459   4.488   6.782
  103    HB3  ASP  15           1HB      ASP  15   8.413   4.336   8.253
  104    H    GLY  16           H        GLY  16   9.011   6.267   4.639
  105    HA2  GLY  16           2HA      GLY  16  10.667   5.772   3.108
  106    HA3  GLY  16           1HA      GLY  16  11.730   5.343   4.440
  107    H    LYS  17           H        LYS  17   8.584   3.921   4.244
  108    HA   LYS  17           HA       LYS  17   9.839   1.378   3.461
  109    HB2  LYS  17           2HB      LYS  17   9.074   1.493   5.844
  110    HB3  LYS  17           1HB      LYS  17   7.429   1.733   5.255
  111    HG2  LYS  17           2HG      LYS  17   7.380  -0.437   4.283
  112    HG3  LYS  17           1HG      LYS  17   9.108  -0.676   4.578
  113    HD2  LYS  17           2HD      LYS  17   7.051  -0.280   6.749
  114    HD3  LYS  17           1HD      LYS  17   7.613  -1.858   6.197
  115    HE2  LYS  17           2HE      LYS  17   9.332   0.318   7.388
  116    HE3  LYS  17           1HE      LYS  17   8.782  -1.132   8.225
  117    HZ1  LYS  17           3HZ      LYS  17  10.980  -1.527   7.502
  118    HZ2  LYS  17           1HZ      LYS  17  10.658  -0.968   5.935
  119    HZ3  LYS  17           2HZ      LYS  17   9.985  -2.427   6.476
  120    H    THR  18           H        THR  18   8.564  -0.080   2.230
  121    HA   THR  18           HA       THR  18   7.018   1.326   0.229
  122    HB   THR  18           HB       THR  18   7.593  -1.632   0.251
  123    HG1  THR  18           1HG      THR  18   9.467  -0.366  -1.140
  124   HG21  THR  18          3HG2      THR  18   7.399   0.385  -1.995
  125   HG22  THR  18          1HG2      THR  18   6.124  -0.732  -1.512
  126   HG23  THR  18          2HG2      THR  18   7.634  -1.355  -2.172
  127    H    TYR  19           H        TYR  19   5.017   1.748   1.004
  128    HA   TYR  19           HA       TYR  19   3.439  -0.431   2.163
  129    HD1  TYR  19           2HD      TYR  19   0.673   0.127   2.632
  130    HD2  TYR  19           1HD      TYR  19   2.049   4.171   2.940
  131    HE1  TYR  19           2HE      TYR  19  -1.634   0.925   2.711
  132    HE2  TYR  19           1HE      TYR  19  -0.212   4.902   3.017
  133    HH   TYR  19           HH       TYR  19  -2.912   2.830   3.408
  134    HB2  TYR  19           2HB      TYR  19   3.246   1.246   3.702
  135    HB3  TYR  19           1HB      TYR  19   3.616   2.495   2.540
  136    H    TYR  20           H        TYR  20   1.588  -1.154   1.192
  137    HA   TYR  20           HA       TYR  20   1.057  -0.076  -1.507
  138    HD1  TYR  20           1HD      TYR  20   2.044  -2.139  -3.481
  139    HD2  TYR  20           2HD      TYR  20   2.295  -3.665   0.500
  140    HE1  TYR  20           1HE      TYR  20   4.198  -3.183  -4.016
  141    HE2  TYR  20           2HE      TYR  20   4.433  -4.699  -0.042
  142    HH   TYR  20           HH       TYR  20   6.154  -4.009  -2.950
  143    HB2  TYR  20           2HB      TYR  20   0.143  -2.771  -0.421
  144    HB3  TYR  20           1HB      TYR  20   0.079  -2.202  -2.078
  145    H    TYR  21           H        TYR  21  -1.063   0.493  -2.068
  146    HA   TYR  21           HA       TYR  21  -2.956   0.534   0.185
  147    HD1  TYR  21           2HD      TYR  21  -5.243   2.389  -2.607
  148    HD2  TYR  21           1HD      TYR  21  -3.782   3.314   1.300
  149    HE1  TYR  21           2HE      TYR  21  -7.435   3.310  -2.004
  150    HE2  TYR  21           1HE      TYR  21  -5.980   4.226   1.896
  151    HH   TYR  21           HH       TYR  21  -7.935   5.196   0.775
  152    HB2  TYR  21           2HB      TYR  21  -2.228   2.786  -0.569
  153    HB3  TYR  21           1HB      TYR  21  -2.849   2.428  -2.174
  154    H    ASN  22           H        ASN  22  -4.340  -0.959  -0.007
  155    HA   ASN  22           HA       ASN  22  -4.760  -2.433  -2.420
  156    HB2  ASN  22           2HB      ASN  22  -4.673  -3.651  -0.375
  157    HB3  ASN  22           1HB      ASN  22  -5.755  -2.545   0.444
  158   HD21  ASN  22          1HD2      ASN  22  -5.795  -5.477   0.203
  159   HD22  ASN  22          2HD2      ASN  22  -7.347  -5.865  -0.451
  160    H    ASN  23           H        ASN  23  -6.165  -1.824  -3.958
  161    HA   ASN  23           HA       ASN  23  -8.447  -0.132  -3.211
  162    HB2  ASN  23           2HB      ASN  23  -6.876   0.626  -5.027
  163    HB3  ASN  23           1HB      ASN  23  -7.411  -0.744  -5.988
  164   HD21  ASN  23          1HD2      ASN  23  -9.308  -0.645  -7.067
  165   HD22  ASN  23          2HD2      ASN  23 -10.334   0.753  -7.088
  166    H    ARG  24           H        ARG  24  -8.040  -3.211  -3.073
  167    HA   ARG  24           HA       ARG  24  -9.926  -4.370  -4.828
  168    HE   ARG  24           HE       ARG  24 -11.459  -8.836  -2.559
  169    HB2  ARG  24           2HB      ARG  24  -8.264  -5.748  -3.690
  170    HB3  ARG  24           1HB      ARG  24  -8.981  -5.352  -2.135
  171    HG2  ARG  24           2HG      ARG  24 -11.062  -6.477  -2.841
  172    HG3  ARG  24           1HG      ARG  24 -10.282  -6.929  -4.357
  173    HD2  ARG  24           2HD      ARG  24  -8.657  -8.257  -3.169
  174    HD3  ARG  24           1HD      ARG  24  -9.290  -7.708  -1.618
  175   HH11  ARG  24          1HH1      ARG  24  -8.173  -9.975  -2.933
  176   HH12  ARG  24          2HH1      ARG  24  -8.607 -11.652  -2.907
  177   HH21  ARG  24          1HH2      ARG  24 -12.045 -11.044  -2.544
  178   HH22  ARG  24          2HH2      ARG  24 -10.817 -12.267  -2.702
  179    H    THR  25           H        THR  25 -10.338  -4.473  -1.334
  180    HA   THR  25           HA       THR  25 -13.139  -3.631  -1.609
  181    HB   THR  25           HB       THR  25 -13.293  -4.496   0.774
  182    HG1  THR  25           1HG      THR  25 -11.361  -4.847   1.596
  183   HG21  THR  25          3HG2      THR  25 -14.146  -5.797  -1.089
  184   HG22  THR  25          1HG2      THR  25 -13.371  -6.867   0.078
  185   HG23  THR  25          2HG2      THR  25 -12.534  -6.433  -1.414
  186    H    LEU  26           H        LEU  26 -10.586  -1.991  -1.496
  187    HA   LEU  26           HA       LEU  26  -9.773  -0.076  -0.622
  188    HG   LEU  26           HG       LEU  26 -12.064   2.594   0.416
  189    HB2  LEU  26           2HB      LEU  26 -12.353   0.421  -0.523
  190    HB3  LEU  26           1HB      LEU  26 -12.131   0.231   1.203
  191   HD11  LEU  26          1HD1      LEU  26  -9.536   1.554   1.678
  192   HD12  LEU  26          2HD1      LEU  26 -11.022   1.997   2.517
  193   HD13  LEU  26          3HD1      LEU  26 -10.074   3.235   1.693
  194   HD21  LEU  26          3HD2      LEU  26 -10.073   3.396  -0.748
  195   HD22  LEU  26          1HD2      LEU  26 -10.959   2.226  -1.725
  196   HD23  LEU  26          2HD2      LEU  26  -9.482   1.741  -0.893
  197    H    GLU  27           H        GLU  27  -8.099  -1.031   0.341
  198    HA   GLU  27           HA       GLU  27  -8.209  -1.396   3.233
  199    HB2  GLU  27           2HB      GLU  27  -8.597  -3.657   2.276
  200    HB3  GLU  27           1HB      GLU  27  -7.177  -3.472   1.274
  201    HG2  GLU  27           2HG      GLU  27  -6.759  -4.928   3.171
  202    HG3  GLU  27           1HG      GLU  27  -5.742  -3.487   3.211
  203    H    SER  28           H        SER  28  -5.992  -1.428   4.145
  204    HA   SER  28           HA       SER  28  -3.957  -0.413   2.271
  205    HG   SER  28           HG       SER  28  -5.026   1.585   3.213
  206    HB2  SER  28           2HB      SER  28  -4.505   0.238   5.123
  207    HB3  SER  28           1HB      SER  28  -2.855   0.339   4.547
  208    H    THR  29           H        THR  29  -1.872  -1.268   2.442
  209    HA   THR  29           HA       THR  29  -1.534  -3.657   4.097
  210    HB   THR  29           HB       THR  29  -0.373  -4.650   1.982
  211    HG1  THR  29           1HG      THR  29  -1.100  -2.431   0.943
  212   HG21  THR  29          3HG2      THR  29  -2.285  -5.670   2.987
  213   HG22  THR  29          1HG2      THR  29  -2.519  -5.628   1.233
  214   HG23  THR  29          2HG2      THR  29  -3.353  -4.462   2.263
  215    H    TRP  30           H        TRP  30   0.509  -3.804   4.916
  216    HA   TRP  30           HA       TRP  30   2.182  -1.520   4.403
  217    HD1  TRP  30           HD       TRP  30   0.712  -2.117   8.006
  218    HE1  TRP  30           1HE      TRP  30   1.005   0.249   8.982
  219    HE3  TRP  30           3HE      TRP  30   4.871  -0.667   5.402
  220    HZ2  TRP  30           2HZ      TRP  30   2.747   2.490   8.623
  221    HZ3  TRP  30           3HZ      TRP  30   5.785   1.583   5.777
  222    HH2  TRP  30           HH       TRP  30   4.759   3.116   7.369
  223    HB2  TRP  30           2HB      TRP  30   2.155  -3.647   6.442
  224    HB3  TRP  30           1HB      TRP  30   3.759  -3.046   6.003
  225    H    GLU  31           H        GLU  31   3.405  -4.859   4.561
  226    HA   GLU  31           HA       GLU  31   4.699  -4.252   2.005
  227    HB2  GLU  31           2HB      GLU  31   5.473  -6.224   4.141
  228    HB3  GLU  31           1HB      GLU  31   6.194  -6.179   2.539
  229    HG2  GLU  31           2HG      GLU  31   6.782  -3.768   3.004
  230    HG3  GLU  31           1HG      GLU  31   6.320  -4.078   4.677
  231    H    LYS  32           H        LYS  32   5.283  -6.425   0.900
  232    HA   LYS  32           HA       LYS  32   3.646  -7.288  -0.818
  233    HB2  LYS  32           2HB      LYS  32   5.269  -9.170   0.886
  234    HB3  LYS  32           1HB      LYS  32   4.538  -9.619  -0.651
  235    HG2  LYS  32           2HG      LYS  32   5.947  -8.267  -1.876
  236    HG3  LYS  32           1HG      LYS  32   6.329  -7.240  -0.493
  237    HD2  LYS  32           2HD      LYS  32   7.167 -10.124  -0.662
  238    HD3  LYS  32           1HD      LYS  32   8.171  -8.800  -1.252
  239    HE2  LYS  32           2HE      LYS  32   7.121  -9.024   1.569
  240    HE3  LYS  32           1HE      LYS  32   8.726  -9.547   1.062
  241    HZ1  LYS  32           3HZ      LYS  32   7.778  -6.768   0.652
  242    HZ2  LYS  32           1HZ      LYS  32   9.365  -7.355   0.602
  243    HZ3  LYS  32           2HZ      LYS  32   8.545  -7.252   2.084
  244    HA   PRO  33           HA       PRO  33  -0.253  -8.564   1.213
  245    HB2  PRO  33           2HB      PRO  33  -0.756  -8.393  -1.733
  246    HB3  PRO  33           1HB      PRO  33  -1.792  -7.879  -0.386
  247    HG2  PRO  33           2HG      PRO  33  -0.454  -6.071  -1.757
  248    HG3  PRO  33           1HG      PRO  33  -0.506  -5.966   0.015
  249    HD2  PRO  33           2HD      PRO  33   1.699  -6.929  -1.764
  250    HD3  PRO  33           1HD      PRO  33   1.788  -5.943  -0.289
  251    H    GLN  34           H        GLN  34  -1.650 -10.419   0.645
  252    HA   GLN  34           HA       GLN  34  -0.334 -12.829   0.426
  253    HB2  GLN  34           2HB      GLN  34  -2.835 -12.130   1.040
  254    HB3  GLN  34           1HB      GLN  34  -3.120 -12.636  -0.618
  255    HG2  GLN  34           2HG      GLN  34  -2.112 -14.267   1.677
  256    HG3  GLN  34           1HG      GLN  34  -3.598 -14.481   0.761
  257   HE21  GLN  34          1HE2      GLN  34  -3.416 -15.245  -1.438
  258   HE22  GLN  34          2HE2      GLN  34  -2.057 -16.218  -1.899
  259    H    GLU  35           H        GLU  35  -2.232 -11.200  -2.135
  260    HA   GLU  35           HA       GLU  35  -1.404 -13.154  -4.084
  261    HB2  GLU  35           2HB      GLU  35  -2.976 -10.605  -4.510
  262    HB3  GLU  35           1HB      GLU  35  -2.855 -11.965  -5.615
  263    HG2  GLU  35           2HG      GLU  35  -4.204 -11.947  -2.923
  264    HG3  GLU  35           1HG      GLU  35  -4.982 -12.007  -4.501
  265    H    LEU  36           H        LEU  36   0.293 -10.832  -2.750
  266    HA   LEU  36           HA       LEU  36   1.474  -9.685  -5.165
  267    HG   LEU  36           HG       LEU  36   3.109  -7.134  -3.162
  268    HB2  LEU  36           2HB      LEU  36   1.049  -8.582  -2.805
  269    HB3  LEU  36           1HB      LEU  36   2.634  -9.243  -2.479
  270   HD11  LEU  36          1HD1      LEU  36   3.097  -8.692  -5.702
  271   HD12  LEU  36          2HD1      LEU  36   4.390  -8.638  -4.506
  272   HD13  LEU  36          3HD1      LEU  36   3.990  -7.194  -5.441
  273   HD21  LEU  36          3HD2      LEU  36   0.925  -7.309  -5.215
  274   HD22  LEU  36          1HD2      LEU  36   1.984  -5.918  -4.965
  275   HD23  LEU  36          2HD2      LEU  36   0.867  -6.412  -3.688
  276    H    LYS  37           H        LYS  37   2.524 -11.352  -6.156
  277    HA   LYS  37           HA       LYS  37   4.545 -12.778  -4.566
  278    HB2  LYS  37           2HB      LYS  37   2.747 -14.230  -5.528
  279    HB3  LYS  37           1HB      LYS  37   3.256 -13.724  -7.134
  280    HG2  LYS  37           2HG      LYS  37   5.492 -14.673  -6.683
  281    HG3  LYS  37           1HG      LYS  37   4.896 -15.252  -5.126
  282    HD2  LYS  37           2HD      LYS  37   3.185 -16.578  -6.322
  283    HD3  LYS  37           1HD      LYS  37   3.881 -16.047  -7.854
  284    HE2  LYS  37           2HE      LYS  37   5.284 -17.648  -5.715
  285    HE3  LYS  37           1HE      LYS  37   4.686 -18.266  -7.254
  286    HZ1  LYS  37           3HZ      LYS  37   6.234 -16.788  -8.397
  287    HZ2  LYS  37           1HZ      LYS  37   7.053 -17.845  -7.354
  288    HZ3  LYS  37           2HZ      LYS  37   6.826 -16.229  -6.907
  289    H1   GLY 101           1HT      GLY 101  -0.334  18.762  -7.045
  290    H2   GLY 101           2HT      GLY 101   0.556  20.186  -6.839
  291    H3   GLY 101           3HT      GLY 101   0.594  18.989  -5.644
  292    HA2  GLY 101           1HA      GLY 101   1.666  18.725  -8.398
  293    HA3  GLY 101           2HA      GLY 101   2.627  18.945  -6.940
  294    HA   PRO 102           HA       PRO 102   2.504  14.463  -6.829
  295    HB2  PRO 102           2HB      PRO 102   4.064  14.132  -4.645
  296    HB3  PRO 102           1HB      PRO 102   4.742  14.563  -6.221
  297    HG2  PRO 102           2HG      PRO 102   4.169  16.302  -3.857
  298    HG3  PRO 102           1HG      PRO 102   5.564  16.323  -4.949
  299    HD2  PRO 102           2HD      PRO 102   3.464  18.066  -5.134
  300    HD3  PRO 102           1HD      PRO 102   4.470  17.596  -6.517
  301    HA   PRO 103           HA       PRO 103  -0.680  13.979  -3.765
  302    HB2  PRO 103           2HB      PRO 103  -0.913  11.290  -3.794
  303    HB3  PRO 103           1HB      PRO 103  -1.496  12.308  -5.110
  304    HG2  PRO 103           2HG      PRO 103   0.966  10.640  -4.958
  305    HG3  PRO 103           1HG      PRO 103  -0.081  10.977  -6.346
  306    HD2  PRO 103           2HD      PRO 103   2.345  12.214  -5.852
  307    HD3  PRO 103           1HD      PRO 103   1.061  12.861  -6.890
  308    H    LEU 104           H        LEU 104  -0.859  13.607  -1.597
  309    HA   LEU 104           HA       LEU 104   1.410  12.574  -0.146
  310    HG   LEU 104           HG       LEU 104  -2.125  12.326   1.021
  311    HB2  LEU 104           2HB      LEU 104   0.167  13.049   1.859
  312    HB3  LEU 104           1HB      LEU 104   0.034  14.415   0.774
  313   HD11  LEU 104          1HD1      LEU 104  -1.857  14.938   2.505
  314   HD12  LEU 104          2HD1      LEU 104  -1.753  13.322   3.209
  315   HD13  LEU 104          3HD1      LEU 104  -3.274  13.885   2.514
  316   HD21  LEU 104          3HD2      LEU 104  -3.541  14.098   0.095
  317   HD22  LEU 104          1HD2      LEU 104  -2.218  13.688  -0.995
  318   HD23  LEU 104          2HD2      LEU 104  -2.135  15.157  -0.024
  319    H    ILE 105           H        ILE 105   1.477  10.644   1.012
  320    HA   ILE 105           HA       ILE 105  -0.168   8.514  -0.007
  321    HB   ILE 105           HB       ILE 105   1.757   8.159   2.320
  322   HG12  ILE 105          2HG1      ILE 105   3.398   7.498   0.402
  323   HG13  ILE 105          1HG1      ILE 105   2.380   8.518  -0.603
  324   HG21  ILE 105          1HG2      ILE 105   0.889   6.336   0.105
  325   HG22  ILE 105          2HG2      ILE 105   0.335   6.292   1.780
  326   HG23  ILE 105          3HG2      ILE 105   2.022   5.936   1.396
  327   HD11  ILE 105          3HD1      ILE 105   4.375   9.673   0.225
  328   HD12  ILE 105          1HD1      ILE 105   3.797   9.445   1.875
  329   HD13  ILE 105          2HD1      ILE 105   2.872  10.434   0.743
  330    HA   PRO 106           HA       PRO 106  -2.993   8.490   3.546
  331    HB2  PRO 106           2HB      PRO 106  -3.383   5.635   3.018
  332    HB3  PRO 106           1HB      PRO 106  -4.559   6.934   2.856
  333    HG2  PRO 106           2HG      PRO 106  -3.527   5.578   0.744
  334    HG3  PRO 106           1HG      PRO 106  -4.090   7.252   0.639
  335    HD2  PRO 106           2HD      PRO 106  -1.314   6.184   0.816
  336    HD3  PRO 106           1HD      PRO 106  -1.929   7.582  -0.085
  337    HA   PRO 107           HA       PRO 107  -0.093   6.257   6.152
  338    HB2  PRO 107           2HB      PRO 107  -1.879   6.209   8.405
  339    HB3  PRO 107           1HB      PRO 107  -0.468   7.234   8.163
  340    HG2  PRO 107           2HG      PRO 107  -3.093   8.122   8.218
  341    HG3  PRO 107           1HG      PRO 107  -1.732   9.004   7.502
  342    HD2  PRO 107           2HD      PRO 107  -3.862   7.394   6.180
  343    HD3  PRO 107           1HD      PRO 107  -3.004   8.835   5.591
  344    HA   PRO 108           HA       PRO 108  -2.011   2.202   6.075
  345    HB2  PRO 108           2HB      PRO 108   0.429   1.021   7.018
  346    HB3  PRO 108           1HB      PRO 108  -0.225   1.019   5.368
  347    HG2  PRO 108           2HG      PRO 108   2.063   2.349   6.152
  348    HG3  PRO 108           1HG      PRO 108   1.082   2.752   4.720
  349    HD2  PRO 108           2HD      PRO 108   1.153   4.061   7.394
  350    HD3  PRO 108           1HD      PRO 108   1.005   4.739   5.755
  351    HA   PRO 109           HA       PRO 109  -3.176   1.680  10.304
  352    HB2  PRO 109           2HB      PRO 109  -4.187  -0.835  10.151
  353    HB3  PRO 109           1HB      PRO 109  -4.997   0.559   9.433
  354    HG2  PRO 109           2HG      PRO 109  -3.248  -1.497   8.106
  355    HG3  PRO 109           1HG      PRO 109  -4.788  -0.803   7.551
  356    HD2  PRO 109           2HD      PRO 109  -2.373   0.005   6.648
  357    HD3  PRO 109           1HD      PRO 109  -3.768   1.092   6.768
  Start of MODEL    7
    1    H1   GLY   1           1HT      GLY   1 -14.376 -18.718 -11.879
    2    H2   GLY   1           2HT      GLY   1 -12.891 -18.787 -11.073
    3    H3   GLY   1           3HT      GLY   1 -13.162 -19.762 -12.434
    4    HA2  GLY   1           1HA      GLY   1 -13.317 -17.805 -13.841
    5    HA3  GLY   1           2HA      GLY   1 -13.049 -16.797 -12.429
    6    H    ALA   2           H        ALA   2 -11.015 -16.344 -11.821
    7    HA   ALA   2           HA       ALA   2  -8.797 -18.009 -12.629
    8    HB1  ALA   2           1HB      ALA   2  -9.061 -15.209 -13.725
    9    HB2  ALA   2           2HB      ALA   2  -9.124 -16.706 -14.654
   10    HB3  ALA   2           3HB      ALA   2  -7.627 -16.226 -13.854
   11    H    THR   3           H        THR   3  -6.672 -16.657 -12.036
   12    HA   THR   3           HA       THR   3  -6.742 -16.246  -9.259
   13    HB   THR   3           HB       THR   3  -4.616 -15.341 -11.208
   14    HG1  THR   3           1HG      THR   3  -5.208 -17.843  -9.998
   15   HG21  THR   3          3HG2      THR   3  -3.101 -15.544  -9.310
   16   HG22  THR   3          1HG2      THR   3  -4.437 -16.052  -8.277
   17   HG23  THR   3          2HG2      THR   3  -4.399 -14.413  -8.925
   18    H    ALA   4           H        ALA   4  -7.507 -14.568  -8.184
   19    HA   ALA   4           HA       ALA   4  -7.978 -12.060  -9.588
   20    HB1  ALA   4           1HB      ALA   4  -9.839 -13.063  -8.390
   21    HB2  ALA   4           2HB      ALA   4  -9.404 -11.509  -7.678
   22    HB3  ALA   4           3HB      ALA   4  -8.917 -13.011  -6.889
   23    H    VAL   5           H        VAL   5  -6.830 -10.301  -9.271
   24    HA   VAL   5           HA       VAL   5  -5.203 -10.046  -6.852
   25    HB   VAL   5           HB       VAL   5  -3.629 -10.278  -8.595
   26   HG11  VAL   5          1HG1      VAL   5  -3.771  -9.086 -10.696
   27   HG12  VAL   5          2HG1      VAL   5  -5.254  -8.300 -10.154
   28   HG13  VAL   5          3HG1      VAL   5  -5.223 -10.043 -10.403
   29   HG21  VAL   5          3HG2      VAL   5  -2.943  -8.434  -7.220
   30   HG22  VAL   5          1HG2      VAL   5  -4.073  -7.345  -8.036
   31   HG23  VAL   5          2HG2      VAL   5  -2.667  -7.965  -8.899
   32    H    SER   6           H        SER   6  -5.581  -8.230  -5.635
   33    HA   SER   6           HA       SER   6  -7.678  -6.445  -6.456
   34    HG   SER   6           HG       SER   6  -7.037  -7.933  -3.426
   35    HB2  SER   6           2HB      SER   6  -5.955  -6.244  -4.037
   36    HB3  SER   6           1HB      SER   6  -7.472  -5.396  -4.328
   37    H    GLU   7           H        GLU   7  -7.371  -4.060  -6.107
   38    HA   GLU   7           HA       GLU   7  -5.338  -3.253  -7.934
   39    HB2  GLU   7           2HB      GLU   7  -7.086  -1.473  -6.217
   40    HB3  GLU   7           1HB      GLU   7  -6.240  -1.034  -7.692
   41    HG2  GLU   7           2HG      GLU   7  -8.477  -3.045  -7.561
   42    HG3  GLU   7           1HG      GLU   7  -8.684  -1.345  -7.974
   43    H    TRP   8           H        TRP   8  -3.365  -3.268  -7.304
   44    HA   TRP   8           HA       TRP   8  -2.679  -2.476  -4.542
   45    HD1  TRP   8           HD       TRP   8  -1.508  -6.793  -6.420
   46    HE1  TRP   8           1HE      TRP   8  -3.051  -8.383  -5.091
   47    HE3  TRP   8           3HE      TRP   8  -3.293  -3.484  -3.078
   48    HZ2  TRP   8           2HZ      TRP   8  -4.847  -8.202  -2.905
   49    HZ3  TRP   8           3HZ      TRP   8  -4.994  -4.216  -1.494
   50    HH2  TRP   8           HH       TRP   8  -5.744  -6.497  -1.347
   51    HB2  TRP   8           2HB      TRP   8  -1.096  -4.244  -6.451
   52    HB3  TRP   8           1HB      TRP   8  -0.676  -3.889  -4.787
   53    H    THR   9           H        THR   9  -1.640  -0.561  -4.446
   54    HA   THR   9           HA       THR   9   0.003   0.191  -6.763
   55    HB   THR   9           HB       THR   9  -1.483   1.874  -6.797
   56    HG1  THR   9           1HG      THR   9   0.399   2.871  -4.961
   57   HG21  THR   9          3HG2      THR   9  -2.854   1.220  -4.892
   58   HG22  THR   9          1HG2      THR   9  -2.545   2.957  -4.844
   59   HG23  THR   9          2HG2      THR   9  -1.634   1.871  -3.791
   60    H    GLU  10           H        GLU  10   1.551   1.822  -6.241
   61    HA   GLU  10           HA       GLU  10   3.154   0.923  -3.914
   62    HB2  GLU  10           2HB      GLU  10   4.005   2.319  -6.443
   63    HB3  GLU  10           1HB      GLU  10   5.081   1.990  -5.107
   64    HG2  GLU  10           2HG      GLU  10   3.631  -0.302  -6.309
   65    HG3  GLU  10           1HG      GLU  10   4.956   0.418  -7.223
   66    H    TYR  11           H        TYR  11   2.735   2.188  -2.308
   67    HA   TYR  11           HA       TYR  11   2.653   5.093  -2.734
   68    HD1  TYR  11           1HD      TYR  11   1.804   6.817  -2.207
   69    HD2  TYR  11           2HD      TYR  11  -1.564   4.229  -2.319
   70    HE1  TYR  11           1HE      TYR  11   0.476   8.624  -3.204
   71    HE2  TYR  11           2HE      TYR  11  -2.907   6.016  -3.345
   72    HH   TYR  11           HH       TYR  11  -2.852   8.556  -3.373
   73    HB2  TYR  11           2HB      TYR  11   0.570   3.372  -1.730
   74    HB3  TYR  11           1HB      TYR  11   1.063   4.505  -0.477
   75    H    LYS  12           H        LYS  12   4.761   5.335  -2.095
   76    HA   LYS  12           HA       LYS  12   5.533   4.231   0.488
   77    HB2  LYS  12           2HB      LYS  12   7.157   5.581  -1.693
   78    HB3  LYS  12           1HB      LYS  12   7.836   4.970  -0.188
   79    HG2  LYS  12           2HG      LYS  12   7.405   2.743  -0.759
   80    HG3  LYS  12           1HG      LYS  12   6.265   3.195  -2.021
   81    HD2  LYS  12           2HD      LYS  12   8.307   2.392  -3.021
   82    HD3  LYS  12           1HD      LYS  12   8.132   4.115  -3.341
   83    HE2  LYS  12           2HE      LYS  12   9.658   3.395  -0.923
   84    HE3  LYS  12           1HE      LYS  12  10.401   2.965  -2.463
   85    HZ1  LYS  12           3HZ      LYS  12   9.749   5.417  -3.043
   86    HZ2  LYS  12           1HZ      LYS  12  11.176   5.072  -2.195
   87    HZ3  LYS  12           2HZ      LYS  12   9.806   5.613  -1.355
   88    H    THR  13           H        THR  13   5.614   5.390   2.268
   89    HA   THR  13           HA       THR  13   4.559   8.070   2.128
   90    HB   THR  13           HB       THR  13   4.474   7.878   4.612
   91    HG1  THR  13           1HG      THR  13   5.409   6.237   5.611
   92   HG21  THR  13          3HG2      THR  13   2.575   7.152   3.263
   93   HG22  THR  13          1HG2      THR  13   2.766   6.119   4.679
   94   HG23  THR  13          2HG2      THR  13   3.292   5.550   3.095
   95    H    ALA  14           H        ALA  14   5.502   9.517   4.075
   96    HA   ALA  14           HA       ALA  14   8.081  10.358   3.208
   97    HB1  ALA  14           1HB      ALA  14   7.885  12.059   4.962
   98    HB2  ALA  14           2HB      ALA  14   6.470  11.231   5.609
   99    HB3  ALA  14           3HB      ALA  14   6.411  11.952   4.001
  100    H    ASP  15           H        ASP  15   7.073   7.965   5.318
  101    HA   ASP  15           HA       ASP  15   9.226   8.020   7.193
  102    HB2  ASP  15           2HB      ASP  15   7.546   5.619   6.411
  103    HB3  ASP  15           1HB      ASP  15   8.430   5.860   7.914
  104    H    GLY  16           H        GLY  16   8.881   7.093   3.949
  105    HA2  GLY  16           2HA      GLY  16  10.514   6.450   2.452
  106    HA3  GLY  16           1HA      GLY  16  11.641   6.285   3.792
  107    H    LYS  17           H        LYS  17   8.546   4.676   3.770
  108    HA   LYS  17           HA       LYS  17   9.957   2.135   3.324
  109    HB2  LYS  17           2HB      LYS  17   7.584   2.739   5.084
  110    HB3  LYS  17           1HB      LYS  17   8.034   1.104   4.623
  111    HG2  LYS  17           2HG      LYS  17  10.316   1.606   5.624
  112    HG3  LYS  17           1HG      LYS  17   9.566   3.046   6.324
  113    HD2  LYS  17           2HD      LYS  17   7.945   1.681   7.492
  114    HD3  LYS  17           1HD      LYS  17   8.562   0.225   6.712
  115    HE2  LYS  17           2HE      LYS  17  10.774   0.693   7.801
  116    HE3  LYS  17           1HE      LYS  17   9.982   1.978   8.710
  117    HZ1  LYS  17           3HZ      LYS  17   8.479   0.335   9.664
  118    HZ2  LYS  17           1HZ      LYS  17  10.095  -0.084   9.978
  119    HZ3  LYS  17           2HZ      LYS  17   9.229  -0.898   8.772
  120    H    THR  18           H        THR  18   8.731   0.441   2.286
  121    HA   THR  18           HA       THR  18   7.124   1.486   0.101
  122    HB   THR  18           HB       THR  18   8.048  -1.348   0.651
  123    HG1  THR  18           1HG      THR  18   9.704   0.305   0.218
  124   HG21  THR  18          3HG2      THR  18   7.525  -1.728  -1.725
  125   HG22  THR  18          1HG2      THR  18   6.876  -0.091  -1.836
  126   HG23  THR  18          2HG2      THR  18   6.090  -1.284  -0.803
  127    H    TYR  19           H        TYR  19   5.059   1.788   0.467
  128    HA   TYR  19           HA       TYR  19   3.550  -0.235   1.964
  129    HD1  TYR  19           2HD      TYR  19   0.917   0.265   2.513
  130    HD2  TYR  19           1HD      TYR  19   2.157   4.345   2.768
  131    HE1  TYR  19           2HE      TYR  19  -1.411   0.971   2.752
  132    HE2  TYR  19           1HE      TYR  19  -0.115   4.992   3.018
  133    HH   TYR  19           HH       TYR  19  -2.663   2.870   3.670
  134    HB2  TYR  19           2HB      TYR  19   3.509   1.521   3.432
  135    HB3  TYR  19           1HB      TYR  19   3.736   2.721   2.180
  136    H    TYR  20           H        TYR  20   1.664  -0.987   1.007
  137    HA   TYR  20           HA       TYR  20   1.007   0.139  -1.652
  138    HD1  TYR  20           1HD      TYR  20   2.501  -3.148   0.253
  139    HD2  TYR  20           2HD      TYR  20   1.517  -2.291  -3.803
  140    HE1  TYR  20           1HE      TYR  20   4.550  -4.264  -0.479
  141    HE2  TYR  20           2HE      TYR  20   3.568  -3.413  -4.538
  142    HH   TYR  20           HH       TYR  20   5.792  -3.966  -3.611
  143    HB2  TYR  20           2HB      TYR  20   0.083  -2.556  -0.561
  144    HB3  TYR  20           1HB      TYR  20  -0.080  -1.942  -2.190
  145    H    TYR  21           H        TYR  21  -1.106   0.827  -2.057
  146    HA   TYR  21           HA       TYR  21  -2.909   0.731   0.265
  147    HD1  TYR  21           2HD      TYR  21  -5.269   2.653  -2.370
  148    HD2  TYR  21           1HD      TYR  21  -3.778   3.501   1.546
  149    HE1  TYR  21           2HE      TYR  21  -7.490   3.447  -1.691
  150    HE2  TYR  21           1HE      TYR  21  -6.002   4.292   2.208
  151    HH   TYR  21           HH       TYR  21  -8.790   3.784   0.317
  152    HB2  TYR  21           2HB      TYR  21  -2.246   3.035  -0.311
  153    HB3  TYR  21           1HB      TYR  21  -2.847   2.802  -1.947
  154    H    ASN  22           H        ASN  22  -4.546  -0.495   0.061
  155    HA   ASN  22           HA       ASN  22  -5.008  -1.922  -2.392
  156    HB2  ASN  22           2HB      ASN  22  -4.993  -3.343  -0.566
  157    HB3  ASN  22           1HB      ASN  22  -5.726  -2.165   0.499
  158   HD21  ASN  22          1HD2      ASN  22  -6.219  -5.033  -0.113
  159   HD22  ASN  22          2HD2      ASN  22  -7.922  -5.123  -0.405
  160    H    ASN  23           H        ASN  23  -6.441  -1.318  -3.861
  161    HA   ASN  23           HA       ASN  23  -8.664   0.425  -3.073
  162    HB2  ASN  23           2HB      ASN  23  -7.167   1.065  -4.997
  163    HB3  ASN  23           1HB      ASN  23  -7.783  -0.328  -5.870
  164   HD21  ASN  23          1HD2      ASN  23  -8.605   0.964  -7.504
  165   HD22  ASN  23          2HD2      ASN  23 -10.024   1.928  -7.292
  166    H    ARG  24           H        ARG  24  -8.269  -2.597  -2.752
  167    HA   ARG  24           HA       ARG  24 -10.334  -3.862  -4.231
  168    HE   ARG  24           HE       ARG  24 -10.731  -6.355   0.038
  169    HB2  ARG  24           2HB      ARG  24  -8.530  -5.130  -3.132
  170    HB3  ARG  24           1HB      ARG  24  -9.173  -4.661  -1.564
  171    HG2  ARG  24           2HG      ARG  24 -11.331  -5.807  -2.291
  172    HG3  ARG  24           1HG      ARG  24 -10.383  -6.489  -3.615
  173    HD2  ARG  24           2HD      ARG  24 -10.438  -8.080  -1.814
  174    HD3  ARG  24           1HD      ARG  24  -8.809  -7.416  -1.928
  175   HH11  ARG  24          1HH1      ARG  24  -7.670  -7.937  -0.671
  176   HH12  ARG  24          2HH1      ARG  24  -7.048  -7.706   0.937
  177   HH21  ARG  24          1HH2      ARG  24  -9.932  -6.112   2.150
  178   HH22  ARG  24          2HH2      ARG  24  -8.324  -6.662   2.540
  179    H    THR  25           H        THR  25 -10.375  -3.778  -0.735
  180    HA   THR  25           HA       THR  25 -13.117  -2.736  -0.725
  181    HB   THR  25           HB       THR  25 -12.963  -3.548   1.735
  182    HG1  THR  25           1HG      THR  25 -11.132  -4.454   2.255
  183   HG21  THR  25          3HG2      THR  25 -14.376  -4.638   0.097
  184   HG22  THR  25          1HG2      THR  25 -13.540  -5.858   1.053
  185   HG23  THR  25          2HG2      THR  25 -12.987  -5.489  -0.581
  186    H    LEU  26           H        LEU  26 -10.448  -1.270  -0.917
  187    HA   LEU  26           HA       LEU  26  -9.376   0.545  -0.119
  188    HG   LEU  26           HG       LEU  26 -12.218   1.338  -0.945
  189    HB2  LEU  26           2HB      LEU  26 -11.926   0.934   1.433
  190    HB3  LEU  26           1HB      LEU  26 -10.587   2.066   1.488
  191   HD11  LEU  26          1HD1      LEU  26 -12.909   3.673  -0.879
  192   HD12  LEU  26          2HD1      LEU  26 -11.969   3.914   0.594
  193   HD13  LEU  26          3HD1      LEU  26 -13.360   2.831   0.605
  194   HD21  LEU  26          3HD2      LEU  26  -9.858   1.677  -1.520
  195   HD22  LEU  26          1HD2      LEU  26  -9.882   3.238  -0.696
  196   HD23  LEU  26          2HD2      LEU  26 -10.869   2.982  -2.142
  197    H    GLU  27           H        GLU  27  -8.409  -1.590   0.752
  198    HA   GLU  27           HA       GLU  27  -8.051  -1.431   3.657
  199    HB2  GLU  27           2HB      GLU  27  -8.365  -3.667   3.251
  200    HB3  GLU  27           1HB      GLU  27  -7.838  -3.545   1.585
  201    HG2  GLU  27           2HG      GLU  27  -5.483  -3.458   2.427
  202    HG3  GLU  27           1HG      GLU  27  -6.115  -3.813   4.026
  203    H    SER  28           H        SER  28  -5.778  -1.374   4.466
  204    HA   SER  28           HA       SER  28  -3.960  -0.216   2.537
  205    HG   SER  28           HG       SER  28  -4.559   1.713   3.375
  206    HB2  SER  28           2HB      SER  28  -4.742   0.221   5.301
  207    HB3  SER  28           1HB      SER  28  -3.032   0.111   5.082
  208    H    THR  29           H        THR  29  -1.813  -1.081   2.439
  209    HA   THR  29           HA       THR  29  -1.329  -3.537   3.962
  210    HB   THR  29           HB       THR  29  -0.269  -4.397   1.730
  211    HG1  THR  29           1HG      THR  29  -1.142  -2.151   0.851
  212   HG21  THR  29          3HG2      THR  29  -3.236  -4.310   2.177
  213   HG22  THR  29          1HG2      THR  29  -2.101  -5.494   2.834
  214   HG23  THR  29          2HG2      THR  29  -2.407  -5.430   1.088
  215    H    TRP  30           H        TRP  30   0.692  -3.636   4.745
  216    HA   TRP  30           HA       TRP  30   2.352  -1.362   4.254
  217    HD1  TRP  30           HD       TRP  30   1.010  -2.045   7.914
  218    HE1  TRP  30           1HE      TRP  30   1.349   0.312   8.920
  219    HE3  TRP  30           3HE      TRP  30   5.064  -0.589   5.157
  220    HZ2  TRP  30           2HZ      TRP  30   3.098   2.540   8.510
  221    HZ3  TRP  30           3HZ      TRP  30   6.009   1.649   5.524
  222    HH2  TRP  30           HH       TRP  30   5.057   3.168   7.180
  223    HB2  TRP  30           2HB      TRP  30   2.360  -3.548   6.228
  224    HB3  TRP  30           1HB      TRP  30   3.963  -2.963   5.766
  225    H    GLU  31           H        GLU  31   3.543  -4.746   4.209
  226    HA   GLU  31           HA       GLU  31   4.914  -3.996   1.734
  227    HB2  GLU  31           2HB      GLU  31   6.453  -5.717   2.059
  228    HB3  GLU  31           1HB      GLU  31   6.248  -4.986   3.641
  229    HG2  GLU  31           2HG      GLU  31   5.074  -6.817   4.467
  230    HG3  GLU  31           1HG      GLU  31   4.705  -7.419   2.845
  231    H    LYS  32           H        LYS  32   5.322  -6.469   0.689
  232    HA   LYS  32           HA       LYS  32   3.433  -6.713  -1.189
  233    HB2  LYS  32           2HB      LYS  32   5.140  -8.858   0.025
  234    HB3  LYS  32           1HB      LYS  32   4.150  -9.140  -1.400
  235    HG2  LYS  32           2HG      LYS  32   5.353  -7.243  -2.502
  236    HG3  LYS  32           1HG      LYS  32   6.445  -7.213  -1.113
  237    HD2  LYS  32           2HD      LYS  32   7.161  -9.452  -1.538
  238    HD3  LYS  32           1HD      LYS  32   5.922  -9.665  -2.779
  239    HE2  LYS  32           2HE      LYS  32   7.023  -7.864  -4.092
  240    HE3  LYS  32           1HE      LYS  32   8.311  -7.825  -2.886
  241    HZ1  LYS  32           3HZ      LYS  32   8.824 -10.110  -3.379
  242    HZ2  LYS  32           1HZ      LYS  32   8.882  -9.195  -4.807
  243    HZ3  LYS  32           2HZ      LYS  32   7.546 -10.204  -4.497
  244    HA   PRO  33           HA       PRO  33  -0.389  -8.150   0.726
  245    HB2  PRO  33           2HB      PRO  33  -0.783  -8.503  -2.222
  246    HB3  PRO  33           1HB      PRO  33  -1.889  -7.826  -1.015
  247    HG2  PRO  33           2HG      PRO  33  -0.587  -6.197  -2.618
  248    HG3  PRO  33           1HG      PRO  33  -0.698  -5.815  -0.886
  249    HD2  PRO  33           2HD      PRO  33   1.598  -6.963  -2.429
  250    HD3  PRO  33           1HD      PRO  33   1.609  -5.740  -1.141
  251    H    GLN  34           H        GLN  34  -1.502 -10.170   0.733
  252    HA   GLN  34           HA       GLN  34   0.119 -12.435   0.747
  253    HB2  GLN  34           2HB      GLN  34  -2.888 -12.247   0.550
  254    HB3  GLN  34           1HB      GLN  34  -2.001 -13.714   0.942
  255    HG2  GLN  34           2HG      GLN  34  -1.081 -12.603   2.929
  256    HG3  GLN  34           1HG      GLN  34  -2.035 -11.169   2.544
  257   HE21  GLN  34          1HE2      GLN  34  -4.308 -12.753   1.603
  258   HE22  GLN  34          2HE2      GLN  34  -5.077 -13.380   3.020
  259    H    GLU  35           H        GLU  35  -2.113 -11.291  -1.735
  260    HA   GLU  35           HA       GLU  35  -1.693 -13.452  -3.550
  261    HB2  GLU  35           2HB      GLU  35  -2.417 -10.720  -4.528
  262    HB3  GLU  35           1HB      GLU  35  -3.073 -12.280  -4.995
  263    HG2  GLU  35           2HG      GLU  35  -4.385 -12.399  -3.001
  264    HG3  GLU  35           1HG      GLU  35  -3.623 -10.945  -2.357
  265    H    LEU  36           H        LEU  36  -0.476 -10.181  -3.257
  266    HA   LEU  36           HA       LEU  36   1.182 -10.420  -5.598
  267    HG   LEU  36           HG       LEU  36   2.513  -7.540  -4.828
  268    HB2  LEU  36           2HB      LEU  36  -0.287  -8.532  -5.229
  269    HB3  LEU  36           1HB      LEU  36   0.489  -8.204  -3.713
  270   HD11  LEU  36          1HD1      LEU  36   2.501  -7.350  -7.284
  271   HD12  LEU  36          2HD1      LEU  36   0.942  -8.174  -7.314
  272   HD13  LEU  36          3HD1      LEU  36   2.377  -9.020  -6.739
  273   HD21  LEU  36          3HD2      LEU  36  -0.033  -6.311  -5.879
  274   HD22  LEU  36          1HD2      LEU  36   1.554  -5.517  -5.866
  275   HD23  LEU  36          2HD2      LEU  36   0.752  -5.929  -4.342
  276    H    LYS  37           H        LYS  37   2.478 -12.100  -4.251
  277    HA   LYS  37           HA       LYS  37   4.561 -10.689  -2.726
  278    HB2  LYS  37           2HB      LYS  37   3.505 -12.414  -1.393
  279    HB3  LYS  37           1HB      LYS  37   3.755 -13.604  -2.665
  280    HG2  LYS  37           2HG      LYS  37   6.194 -13.341  -2.380
  281    HG3  LYS  37           1HG      LYS  37   5.891 -12.241  -1.037
  282    HD2  LYS  37           2HD      LYS  37   4.902 -13.969   0.265
  283    HD3  LYS  37           1HD      LYS  37   4.846 -15.063  -1.121
  284    HE2  LYS  37           2HE      LYS  37   7.374 -14.007   0.141
  285    HE3  LYS  37           1HE      LYS  37   6.675 -15.595   0.460
  286    HZ1  LYS  37           3HZ      LYS  37   8.443 -15.714  -1.192
  287    HZ2  LYS  37           1HZ      LYS  37   7.609 -14.625  -2.195
  288    HZ3  LYS  37           2HZ      LYS  37   6.953 -16.151  -1.873
  289    H1   GLY 101           1HT      GLY 101   2.907  17.906 -10.399
  290    H2   GLY 101           2HT      GLY 101   1.528  16.928 -10.295
  291    H3   GLY 101           3HT      GLY 101   3.039  16.232 -10.612
  292    HA2  GLY 101           1HA      GLY 101   3.840  16.846  -8.440
  293    HA3  GLY 101           2HA      GLY 101   2.299  17.624  -8.100
  294    HA   PRO 102           HA       PRO 102   2.193  12.898  -7.384
  295    HB2  PRO 102           2HB      PRO 102   3.597  12.957  -4.860
  296    HB3  PRO 102           1HB      PRO 102   4.026  12.083  -6.331
  297    HG2  PRO 102           2HG      PRO 102   5.464  14.189  -5.323
  298    HG3  PRO 102           1HG      PRO 102   5.463  13.709  -7.029
  299    HD2  PRO 102           2HD      PRO 102   3.972  15.921  -5.677
  300    HD3  PRO 102           1HD      PRO 102   4.755  15.894  -7.273
  301    HA   PRO 103           HA       PRO 103  -1.038  13.653  -4.365
  302    HB2  PRO 103           2HB      PRO 103  -1.943  11.123  -4.128
  303    HB3  PRO 103           1HB      PRO 103  -2.256  12.100  -5.563
  304    HG2  PRO 103           2HG      PRO 103  -0.237   9.938  -5.155
  305    HG3  PRO 103           1HG      PRO 103  -1.249  10.280  -6.570
  306    HD2  PRO 103           2HD      PRO 103   1.385  11.020  -6.358
  307    HD3  PRO 103           1HD      PRO 103   0.198  11.849  -7.382
  308    H    LEU 104           H        LEU 104  -1.269  13.417  -2.105
  309    HA   LEU 104           HA       LEU 104   1.039  12.367  -0.753
  310    HG   LEU 104           HG       LEU 104   0.029  15.294   1.275
  311    HB2  LEU 104           2HB      LEU 104  -1.495  13.684   0.179
  312    HB3  LEU 104           1HB      LEU 104  -0.403  12.929   1.320
  313   HD11  LEU 104          1HD1      LEU 104   2.183  13.749  -0.146
  314   HD12  LEU 104          2HD1      LEU 104   1.961  13.901   1.598
  315   HD13  LEU 104          3HD1      LEU 104   2.406  15.311   0.637
  316   HD21  LEU 104          3HD2      LEU 104   0.781  16.447  -0.757
  317   HD22  LEU 104          1HD2      LEU 104  -0.872  15.845  -0.913
  318   HD23  LEU 104          2HD2      LEU 104   0.458  14.990  -1.696
  319    H    ILE 105           H        ILE 105   1.123  10.639   0.633
  320    HA   ILE 105           HA       ILE 105  -0.658   8.490  -0.045
  321    HB   ILE 105           HB       ILE 105   1.611   8.266   1.960
  322   HG12  ILE 105          2HG1      ILE 105   2.839   7.423  -0.199
  323   HG13  ILE 105          1HG1      ILE 105   1.671   8.431  -1.038
  324   HG21  ILE 105          1HG2      ILE 105   0.095   6.391   1.802
  325   HG22  ILE 105          2HG2      ILE 105   1.694   5.981   1.185
  326   HG23  ILE 105          3HG2      ILE 105   0.370   6.303   0.066
  327   HD11  ILE 105          3HD1      ILE 105   3.848   9.262   0.833
  328   HD12  ILE 105          1HD1      ILE 105   2.492  10.325   0.437
  329   HD13  ILE 105          2HD1      ILE 105   3.556   9.746  -0.843
  330    HA   PRO 106           HA       PRO 106  -2.991   8.550   3.857
  331    HB2  PRO 106           2HB      PRO 106  -3.401   5.684   3.343
  332    HB3  PRO 106           1HB      PRO 106  -4.612   6.953   3.425
  333    HG2  PRO 106           2HG      PRO 106  -3.995   5.722   1.123
  334    HG3  PRO 106           1HG      PRO 106  -4.461   7.432   1.179
  335    HD2  PRO 106           2HD      PRO 106  -1.734   6.221   0.935
  336    HD3  PRO 106           1HD      PRO 106  -2.419   7.636   0.104
  337    HA   PRO 107           HA       PRO 107   0.246   6.299   6.079
  338    HB2  PRO 107           2HB      PRO 107  -0.745   6.269   8.600
  339    HB3  PRO 107           1HB      PRO 107  -0.057   7.729   7.883
  340    HG2  PRO 107           2HG      PRO 107  -2.925   6.950   8.218
  341    HG3  PRO 107           1HG      PRO 107  -2.167   8.536   8.437
  342    HD2  PRO 107           2HD      PRO 107  -3.569   7.794   6.195
  343    HD3  PRO 107           1HD      PRO 107  -2.296   9.032   6.202
  344    HA   PRO 108           HA       PRO 108  -1.714   2.270   6.220
  345    HB2  PRO 108           2HB      PRO 108   0.773   1.027   6.876
  346    HB3  PRO 108           1HB      PRO 108  -0.006   1.088   5.284
  347    HG2  PRO 108           2HG      PRO 108   2.355   2.356   5.941
  348    HG3  PRO 108           1HG      PRO 108   1.286   2.804   4.586
  349    HD2  PRO 108           2HD      PRO 108   1.578   4.064   7.271
  350    HD3  PRO 108           1HD      PRO 108   1.302   4.780   5.664
  351    HA   PRO 109           HA       PRO 109  -2.236   1.714  10.600
  352    HB2  PRO 109           2HB      PRO 109  -3.493  -0.663  10.608
  353    HB3  PRO 109           1HB      PRO 109  -4.272   0.794   9.979
  354    HG2  PRO 109           2HG      PRO 109  -2.913  -1.422   8.474
  355    HG3  PRO 109           1HG      PRO 109  -4.452  -0.610   8.123
  356    HD2  PRO 109           2HD      PRO 109  -2.103  -0.003   6.886
  357    HD3  PRO 109           1HD      PRO 109  -3.411   1.171   7.124
  Start of MODEL    8
    1    H1   GLY   1           1HT      GLY   1  -6.773 -21.856 -14.504
    2    H2   GLY   1           2HT      GLY   1  -6.622 -23.020 -13.279
    3    H3   GLY   1           3HT      GLY   1  -5.393 -21.873 -13.519
    4    HA2  GLY   1           1HA      GLY   1  -8.157 -21.324 -12.583
    5    HA3  GLY   1           2HA      GLY   1  -6.703 -21.280 -11.592
    6    H    ALA   2           H        ALA   2  -8.623 -19.132 -12.110
    7    HA   ALA   2           HA       ALA   2  -7.275 -17.247 -13.830
    8    HB1  ALA   2           1HB      ALA   2  -9.552 -16.808 -11.904
    9    HB2  ALA   2           2HB      ALA   2  -9.722 -17.247 -13.602
   10    HB3  ALA   2           3HB      ALA   2  -9.016 -15.691 -13.160
   11    H    THR   3           H        THR   3  -5.219 -17.501 -12.653
   12    HA   THR   3           HA       THR   3  -4.975 -16.561  -9.971
   13    HB   THR   3           HB       THR   3  -2.726 -16.826 -11.962
   14    HG1  THR   3           1HG      THR   3  -3.068 -18.912 -12.011
   15   HG21  THR   3          3HG2      THR   3  -1.446 -17.460  -9.964
   16   HG22  THR   3          1HG2      THR   3  -2.887 -17.228  -8.973
   17   HG23  THR   3          2HG2      THR   3  -2.153 -15.853  -9.801
   18    H    ALA   4           H        ALA   4  -5.261 -14.509  -9.474
   19    HA   ALA   4           HA       ALA   4  -3.704 -12.456 -10.833
   20    HB1  ALA   4           1HB      ALA   4  -5.839 -12.425 -12.030
   21    HB2  ALA   4           2HB      ALA   4  -5.616 -10.957 -11.080
   22    HB3  ALA   4           3HB      ALA   4  -6.697 -12.225 -10.501
   23    H    VAL   5           H        VAL   5  -4.026 -10.316  -9.575
   24    HA   VAL   5           HA       VAL   5  -4.404 -10.935  -6.720
   25    HB   VAL   5           HB       VAL   5  -2.735  -9.212  -6.177
   26   HG11  VAL   5          1HG1      VAL   5  -1.736 -11.360  -8.036
   27   HG12  VAL   5          2HG1      VAL   5  -1.972 -11.488  -6.293
   28   HG13  VAL   5          3HG1      VAL   5  -0.726 -10.422  -6.937
   29   HG21  VAL   5          3HG2      VAL   5  -3.045  -7.900  -8.290
   30   HG22  VAL   5          1HG2      VAL   5  -2.060  -9.116  -9.110
   31   HG23  VAL   5          2HG2      VAL   5  -1.364  -8.148  -7.799
   32    H    SER   6           H        SER   6  -4.860  -8.887  -5.421
   33    HA   SER   6           HA       SER   6  -6.999  -7.419  -6.601
   34    HG   SER   6           HG       SER   6  -6.448  -9.083  -4.242
   35    HB2  SER   6           2HB      SER   6  -5.661  -6.884  -4.001
   36    HB3  SER   6           1HB      SER   6  -7.271  -6.370  -4.503
   37    H    GLU   7           H        GLU   7  -7.013  -4.965  -6.149
   38    HA   GLU   7           HA       GLU   7  -5.000  -3.970  -7.902
   39    HB2  GLU   7           2HB      GLU   7  -7.102  -2.465  -6.332
   40    HB3  GLU   7           1HB      GLU   7  -6.138  -1.812  -7.649
   41    HG2  GLU   7           2HG      GLU   7  -8.024  -2.304  -8.790
   42    HG3  GLU   7           1HG      GLU   7  -7.196  -3.849  -8.953
   43    H    TRP   8           H        TRP   8  -3.067  -3.741  -7.227
   44    HA   TRP   8           HA       TRP   8  -2.563  -2.812  -4.465
   45    HD1  TRP   8           HD       TRP   8  -0.889  -7.069  -6.091
   46    HE1  TRP   8           1HE      TRP   8  -2.376  -8.727  -4.806
   47    HE3  TRP   8           3HE      TRP   8  -3.234  -3.798  -3.110
   48    HZ2  TRP   8           2HZ      TRP   8  -4.337  -8.614  -2.785
   49    HZ3  TRP   8           3HZ      TRP   8  -4.968  -4.595  -1.613
   50    HH2  TRP   8           HH       TRP   8  -5.559  -6.905  -1.407
   51    HB2  TRP   8           2HB      TRP   8  -0.741  -4.486  -6.247
   52    HB3  TRP   8           1HB      TRP   8  -0.439  -4.050  -4.576
   53    H    THR   9           H        THR   9  -1.985  -0.710  -4.572
   54    HA   THR   9           HA       THR   9  -0.295   0.166  -6.777
   55    HB   THR   9           HB       THR   9  -1.697   1.883  -6.659
   56    HG1  THR   9           1HG      THR   9  -0.832   3.602  -5.677
   57   HG21  THR   9          3HG2      THR   9  -3.191   0.884  -5.015
   58   HG22  THR   9          1HG2      THR   9  -2.969   2.599  -4.670
   59   HG23  THR   9          2HG2      THR   9  -2.106   1.390  -3.715
   60    H    GLU  10           H        GLU  10   1.330   1.753  -6.222
   61    HA   GLU  10           HA       GLU  10   2.957   0.595  -4.059
   62    HB2  GLU  10           2HB      GLU  10   4.932   1.125  -5.422
   63    HB3  GLU  10           1HB      GLU  10   3.817   0.044  -6.242
   64    HG2  GLU  10           2HG      GLU  10   2.972   1.894  -7.570
   65    HG3  GLU  10           1HG      GLU  10   4.089   2.991  -6.756
   66    H    TYR  11           H        TYR  11   3.101   1.858  -2.421
   67    HA   TYR  11           HA       TYR  11   3.697   4.711  -2.804
   68    HD1  TYR  11           2HD      TYR  11   2.422   6.945  -1.892
   69    HD2  TYR  11           1HD      TYR  11  -0.236   3.737  -2.668
   70    HE1  TYR  11           2HE      TYR  11   0.940   8.495  -3.053
   71    HE2  TYR  11           1HE      TYR  11  -1.748   5.271  -3.858
   72    HH   TYR  11           HH       TYR  11  -2.200   7.868  -3.736
   73    HB2  TYR  11           2HB      TYR  11   1.543   3.423  -1.198
   74    HB3  TYR  11           1HB      TYR  11   2.358   4.809  -0.491
   75    H    LYS  12           H        LYS  12   5.204   5.525  -1.237
   76    HA   LYS  12           HA       LYS  12   5.817   3.640   0.905
   77    HB2  LYS  12           2HB      LYS  12   8.237   4.173   0.735
   78    HB3  LYS  12           1HB      LYS  12   7.623   3.359  -0.694
   79    HG2  LYS  12           2HG      LYS  12   7.542   5.467  -1.896
   80    HG3  LYS  12           1HG      LYS  12   8.083   6.327  -0.455
   81    HD2  LYS  12           2HD      LYS  12  10.181   5.000  -0.498
   82    HD3  LYS  12           1HD      LYS  12   9.641   4.254  -2.004
   83    HE2  LYS  12           2HE      LYS  12  10.022   7.221  -1.605
   84    HE3  LYS  12           1HE      LYS  12  11.221   6.151  -2.325
   85    HZ1  LYS  12           3HZ      LYS  12   9.695   7.432  -3.876
   86    HZ2  LYS  12           1HZ      LYS  12   8.484   6.344  -3.416
   87    HZ3  LYS  12           2HZ      LYS  12   9.885   5.774  -4.177
   88    H    THR  13           H        THR  13   5.957   4.438   2.854
   89    HA   THR  13           HA       THR  13   5.569   7.324   3.095
   90    HB   THR  13           HB       THR  13   4.786   6.794   5.401
   91    HG1  THR  13           1HG      THR  13   5.261   4.887   6.161
   92   HG21  THR  13          3HG2      THR  13   2.680   5.718   4.719
   93   HG22  THR  13          1HG2      THR  13   3.413   5.292   3.173
   94   HG23  THR  13          2HG2      THR  13   3.170   6.987   3.597
   95    H    ALA  14           H        ALA  14   6.451   8.026   5.470
   96    HA   ALA  14           HA       ALA  14   9.176   8.395   4.956
   97    HB1  ALA  14           1HB      ALA  14   7.705   8.926   7.527
   98    HB2  ALA  14           2HB      ALA  14   7.784  10.011   6.138
   99    HB3  ALA  14           3HB      ALA  14   9.249   9.622   7.037
  100    H    ASP  15           H        ASP  15   7.687   5.769   6.564
  101    HA   ASP  15           HA       ASP  15   9.853   5.204   8.355
  102    HB2  ASP  15           2HB      ASP  15   7.483   4.397   8.663
  103    HB3  ASP  15           1HB      ASP  15   7.778   3.240   7.369
  104    H    GLY  16           H        GLY  16   9.474   4.884   5.033
  105    HA2  GLY  16           2HA      GLY  16  11.018   4.094   3.493
  106    HA3  GLY  16           1HA      GLY  16  11.965   3.443   4.824
  107    H    LYS  17           H        LYS  17   8.589   2.847   4.104
  108    HA   LYS  17           HA       LYS  17   9.236   0.033   3.525
  109    HB2  LYS  17           2HB      LYS  17   6.816   1.183   4.925
  110    HB3  LYS  17           1HB      LYS  17   6.972  -0.494   4.441
  111    HG2  LYS  17           2HG      LYS  17   8.802   0.905   6.384
  112    HG3  LYS  17           1HG      LYS  17   7.416  -0.089   6.841
  113    HD2  LYS  17           2HD      LYS  17   8.475  -1.978   5.577
  114    HD3  LYS  17           1HD      LYS  17   9.907  -0.961   5.380
  115    HE2  LYS  17           2HE      LYS  17   8.684  -1.798   8.009
  116    HE3  LYS  17           1HE      LYS  17  10.116  -2.516   7.275
  117    HZ1  LYS  17           3HZ      LYS  17  11.236  -0.378   7.458
  118    HZ2  LYS  17           1HZ      LYS  17  10.705  -0.918   8.973
  119    HZ3  LYS  17           2HZ      LYS  17   9.855   0.314   8.174
  120    H    THR  18           H        THR  18   8.205  -0.904   1.791
  121    HA   THR  18           HA       THR  18   6.912   0.896  -0.067
  122    HB   THR  18           HB       THR  18   7.465  -2.071  -0.350
  123    HG1  THR  18           1HG      THR  18   9.394  -1.510  -1.175
  124   HG21  THR  18          3HG2      THR  18   7.199  -1.644  -2.757
  125   HG22  THR  18          1HG2      THR  18   6.777   0.034  -2.410
  126   HG23  THR  18          2HG2      THR  18   5.722  -1.272  -1.870
  127    H    TYR  19           H        TYR  19   5.105   1.382   1.089
  128    HA   TYR  19           HA       TYR  19   3.283  -0.657   2.003
  129    HD1  TYR  19           1HD      TYR  19   0.621   0.066   2.429
  130    HD2  TYR  19           2HD      TYR  19   2.233   4.016   2.898
  131    HE1  TYR  19           1HE      TYR  19  -1.635   1.004   2.532
  132    HE2  TYR  19           2HE      TYR  19   0.052   4.876   2.960
  133    HH   TYR  19           HH       TYR  19  -2.780   2.976   3.315
  134    HB2  TYR  19           2HB      TYR  19   3.268   1.014   3.547
  135    HB3  TYR  19           1HB      TYR  19   3.707   2.245   2.381
  136    H    TYR  20           H        TYR  20   1.517  -1.318   0.983
  137    HA   TYR  20           HA       TYR  20   0.954  -0.152  -1.665
  138    HD1  TYR  20           2HD      TYR  20   2.422  -3.491   0.308
  139    HD2  TYR  20           1HD      TYR  20   1.632  -2.486  -3.782
  140    HE1  TYR  20           2HE      TYR  20   4.504  -4.564  -0.379
  141    HE2  TYR  20           1HE      TYR  20   3.732  -3.564  -4.448
  142    HH   TYR  20           HH       TYR  20   5.504  -5.574  -2.380
  143    HB2  TYR  20           2HB      TYR  20   0.060  -2.849  -0.561
  144    HB3  TYR  20           1HB      TYR  20  -0.101  -2.275  -2.210
  145    H    TYR  21           H        TYR  21  -1.225   0.444  -2.142
  146    HA   TYR  21           HA       TYR  21  -2.984   0.441   0.218
  147    HD1  TYR  21           2HD      TYR  21  -5.404   2.085  -2.481
  148    HD2  TYR  21           1HD      TYR  21  -3.924   3.401   1.311
  149    HE1  TYR  21           2HE      TYR  21  -7.645   2.884  -1.875
  150    HE2  TYR  21           1HE      TYR  21  -6.169   4.180   1.904
  151    HH   TYR  21           HH       TYR  21  -8.950   3.383   0.116
  152    HB2  TYR  21           2HB      TYR  21  -2.379   2.726  -0.486
  153    HB3  TYR  21           1HB      TYR  21  -2.976   2.396  -2.105
  154    H    ASN  22           H        ASN  22  -4.222  -1.159   0.072
  155    HA   ASN  22           HA       ASN  22  -4.859  -2.635  -2.220
  156    HB2  ASN  22           2HB      ASN  22  -4.834  -3.687  -0.088
  157    HB3  ASN  22           1HB      ASN  22  -5.916  -2.502   0.610
  158   HD21  ASN  22          1HD2      ASN  22  -5.936  -5.447   0.484
  159   HD22  ASN  22          2HD2      ASN  22  -7.486  -5.869  -0.147
  160    H    ASN  23           H        ASN  23  -5.964  -1.713  -3.849
  161    HA   ASN  23           HA       ASN  23  -8.230   0.011  -3.315
  162    HB2  ASN  23           2HB      ASN  23  -6.942  -0.936  -5.870
  163    HB3  ASN  23           1HB      ASN  23  -8.425   0.008  -5.852
  164   HD21  ASN  23          1HD2      ASN  23  -5.847   0.657  -6.995
  165   HD22  ASN  23          2HD2      ASN  23  -5.340   2.126  -6.230
  166    H    ARG  24           H        ARG  24  -7.798  -3.222  -3.232
  167    HA   ARG  24           HA       ARG  24  -9.911  -4.291  -4.705
  168    HE   ARG  24           HE       ARG  24 -11.536  -8.649  -2.963
  169    HB2  ARG  24           2HB      ARG  24  -8.224  -5.735  -3.716
  170    HB3  ARG  24           1HB      ARG  24  -8.804  -5.320  -2.105
  171    HG2  ARG  24           2HG      ARG  24 -11.004  -6.285  -2.685
  172    HG3  ARG  24           1HG      ARG  24 -10.355  -6.773  -4.247
  173    HD2  ARG  24           2HD      ARG  24  -8.770  -8.244  -3.164
  174    HD3  ARG  24           1HD      ARG  24  -9.299  -7.690  -1.575
  175   HH11  ARG  24          1HH1      ARG  24  -8.539  -9.922  -1.682
  176   HH12  ARG  24          2HH1      ARG  24  -9.222 -11.463  -1.264
  177   HH21  ARG  24          1HH2      ARG  24 -12.439 -10.668  -2.424
  178   HH22  ARG  24          2HH2      ARG  24 -11.450 -11.893  -1.692
  179    H    THR  25           H        THR  25  -9.914  -4.090  -1.183
  180    HA   THR  25           HA       THR  25 -12.785  -3.537  -1.219
  181    HB   THR  25           HB       THR  25 -12.226  -5.522   0.019
  182    HG1  THR  25           1HG      THR  25 -13.041  -3.253   1.501
  183   HG21  THR  25          3HG2      THR  25 -10.397  -3.730   1.580
  184   HG22  THR  25          1HG2      THR  25  -9.914  -4.980   0.442
  185   HG23  THR  25          2HG2      THR  25 -10.726  -5.425   1.945
  186    H    LEU  26           H        LEU  26 -10.283  -1.701  -1.413
  187    HA   LEU  26           HA       LEU  26  -9.488   0.263  -0.652
  188    HG   LEU  26           HG       LEU  26 -12.220   0.706  -1.825
  189    HB2  LEU  26           2HB      LEU  26 -12.214   0.425   0.619
  190    HB3  LEU  26           1HB      LEU  26 -11.025   1.703   0.763
  191   HD11  LEU  26          1HD1      LEU  26 -13.796   1.980  -0.445
  192   HD12  LEU  26          2HD1      LEU  26 -13.335   2.865  -1.898
  193   HD13  LEU  26          3HD1      LEU  26 -12.627   3.299  -0.343
  194   HD21  LEU  26          3HD2      LEU  26  -9.920   1.455  -2.111
  195   HD22  LEU  26          1HD2      LEU  26 -10.298   2.965  -1.285
  196   HD23  LEU  26          2HD2      LEU  26 -11.048   2.600  -2.838
  197    H    GLU  27           H        GLU  27  -8.116  -1.312   0.376
  198    HA   GLU  27           HA       GLU  27  -8.184  -1.153   3.319
  199    HB2  GLU  27           2HB      GLU  27  -8.586  -3.463   2.493
  200    HB3  GLU  27           1HB      GLU  27  -7.142  -3.360   1.517
  201    HG2  GLU  27           2HG      GLU  27  -6.863  -4.714   3.540
  202    HG3  GLU  27           1HG      GLU  27  -5.739  -3.353   3.437
  203    H    SER  28           H        SER  28  -5.911  -1.296   4.231
  204    HA   SER  28           HA       SER  28  -3.924  -0.280   2.317
  205    HG   SER  28           HG       SER  28  -4.895   1.693   3.229
  206    HB2  SER  28           2HB      SER  28  -4.417   0.336   5.177
  207    HB3  SER  28           1HB      SER  28  -2.767   0.417   4.598
  208    H    THR  29           H        THR  29  -1.808  -1.125   2.470
  209    HA   THR  29           HA       THR  29  -1.494  -3.570   4.046
  210    HB   THR  29           HB       THR  29  -0.292  -4.477   1.896
  211    HG1  THR  29           1HG      THR  29  -1.029  -2.270   0.888
  212   HG21  THR  29          3HG2      THR  29  -2.157  -5.540   2.914
  213   HG22  THR  29          1HG2      THR  29  -2.444  -5.469   1.163
  214   HG23  THR  29          2HG2      THR  29  -3.267  -4.334   2.247
  215    H    TRP  30           H        TRP  30   0.285  -3.456   5.142
  216    HA   TRP  30           HA       TRP  30   2.067  -1.246   4.747
  217    HD1  TRP  30           HD       TRP  30   0.518  -1.733   8.479
  218    HE1  TRP  30           1HE      TRP  30   0.904   0.651   9.376
  219    HE3  TRP  30           3HE      TRP  30   4.608  -0.476   5.676
  220    HZ2  TRP  30           2HZ      TRP  30   2.685   2.816   8.893
  221    HZ3  TRP  30           3HZ      TRP  30   5.602   1.762   5.967
  222    HH2  TRP  30           HH       TRP  30   4.665   3.357   7.558
  223    HB2  TRP  30           2HB      TRP  30   1.708  -3.292   6.818
  224    HB3  TRP  30           1HB      TRP  30   3.401  -2.896   6.525
  225    H    GLU  31           H        GLU  31   2.535  -4.744   4.641
  226    HA   GLU  31           HA       GLU  31   4.596  -4.259   2.614
  227    HB2  GLU  31           2HB      GLU  31   4.187  -6.481   4.564
  228    HB3  GLU  31           1HB      GLU  31   5.089  -6.753   3.083
  229    HG2  GLU  31           2HG      GLU  31   6.502  -4.797   3.707
  230    HG3  GLU  31           1HG      GLU  31   5.717  -4.828   5.290
  231    H    LYS  32           H        LYS  32   4.714  -6.456   1.262
  232    HA   LYS  32           HA       LYS  32   2.790  -6.616  -0.606
  233    HB2  LYS  32           2HB      LYS  32   3.586  -8.985  -0.945
  234    HB3  LYS  32           1HB      LYS  32   4.857  -7.769  -0.885
  235    HG2  LYS  32           2HG      LYS  32   5.352  -8.357   1.414
  236    HG3  LYS  32           1HG      LYS  32   4.027  -9.521   1.421
  237    HD2  LYS  32           2HD      LYS  32   5.186 -10.760  -0.392
  238    HD3  LYS  32           1HD      LYS  32   6.543  -9.643  -0.233
  239    HE2  LYS  32           2HE      LYS  32   6.952 -10.344   2.005
  240    HE3  LYS  32           1HE      LYS  32   5.468 -11.292   2.043
  241    HZ1  LYS  32           3HZ      LYS  32   6.421 -12.694   0.272
  242    HZ2  LYS  32           1HZ      LYS  32   7.318 -12.744   1.719
  243    HZ3  LYS  32           2HZ      LYS  32   7.876 -11.833   0.407
  244    HA   PRO  33           HA       PRO  33  -0.943  -8.243   1.389
  245    HB2  PRO  33           2HB      PRO  33  -1.911  -8.896  -1.181
  246    HB3  PRO  33           1HB      PRO  33  -2.291  -7.446  -0.259
  247    HG2  PRO  33           2HG      PRO  33  -0.326  -7.842  -2.439
  248    HG3  PRO  33           1HG      PRO  33  -1.278  -6.406  -2.021
  249    HD2  PRO  33           2HD      PRO  33   1.336  -6.558  -1.478
  250    HD3  PRO  33           1HD      PRO  33   0.207  -5.754  -0.365
  251    H    GLN  34           H        GLN  34  -2.102 -10.336   1.159
  252    HA   GLN  34           HA       GLN  34  -0.264 -12.461   1.392
  253    HB2  GLN  34           2HB      GLN  34  -3.255 -12.690   1.073
  254    HB3  GLN  34           1HB      GLN  34  -2.176 -13.858   1.817
  255    HG2  GLN  34           2HG      GLN  34  -1.680 -12.260   3.601
  256    HG3  GLN  34           1HG      GLN  34  -2.782 -11.105   2.854
  257   HE21  GLN  34          1HE2      GLN  34  -3.310 -14.562   3.053
  258   HE22  GLN  34          2HE2      GLN  34  -4.662 -14.480   4.128
  259    H    GLU  35           H        GLU  35  -1.896 -11.172  -1.330
  260    HA   GLU  35           HA       GLU  35  -1.654 -13.595  -2.920
  261    HB2  GLU  35           2HB      GLU  35  -2.422 -10.812  -3.802
  262    HB3  GLU  35           1HB      GLU  35  -2.638 -12.297  -4.711
  263    HG2  GLU  35           2HG      GLU  35  -4.240 -13.083  -3.044
  264    HG3  GLU  35           1HG      GLU  35  -4.037 -11.581  -2.142
  265    H    LEU  36           H        LEU  36   0.178 -10.799  -2.156
  266    HA   LEU  36           HA       LEU  36   1.683 -10.910  -4.645
  267    HG   LEU  36           HG       LEU  36   0.252  -8.681  -4.896
  268    HB2  LEU  36           2HB      LEU  36   1.086  -8.882  -2.628
  269    HB3  LEU  36           1HB      LEU  36   2.741  -8.832  -3.202
  270   HD11  LEU  36          1HD1      LEU  36   2.222  -6.525  -4.139
  271   HD12  LEU  36          2HD1      LEU  36   0.563  -6.678  -3.531
  272   HD13  LEU  36          3HD1      LEU  36   0.852  -6.362  -5.248
  273   HD21  LEU  36          3HD2      LEU  36   2.120  -9.734  -6.016
  274   HD22  LEU  36          1HD2      LEU  36   3.145  -8.367  -5.602
  275   HD23  LEU  36          2HD2      LEU  36   1.781  -8.142  -6.698
  276    H    LYS  37           H        LYS  37   2.645 -12.951  -4.079
  277    HA   LYS  37           HA       LYS  37   4.536 -14.127  -3.748
  278    HB2  LYS  37           2HB      LYS  37   5.673 -11.392  -3.200
  279    HB3  LYS  37           1HB      LYS  37   6.648 -12.856  -3.261
  280    HG2  LYS  37           2HG      LYS  37   5.004 -11.698  -5.499
  281    HG3  LYS  37           1HG      LYS  37   6.766 -11.718  -5.379
  282    HD2  LYS  37           2HD      LYS  37   6.747 -14.162  -5.447
  283    HD3  LYS  37           1HD      LYS  37   4.986 -14.155  -5.544
  284    HE2  LYS  37           2HE      LYS  37   5.128 -12.936  -7.674
  285    HE3  LYS  37           1HE      LYS  37   6.887 -12.993  -7.578
  286    HZ1  LYS  37           3HZ      LYS  37   5.049 -15.310  -7.824
  287    HZ2  LYS  37           1HZ      LYS  37   6.718 -15.441  -7.558
  288    HZ3  LYS  37           2HZ      LYS  37   6.139 -14.744  -8.993
  289    H1   GLY 101           1HT      GLY 101  -0.284  17.627  -9.334
  290    H2   GLY 101           2HT      GLY 101   0.076  19.128  -8.626
  291    H3   GLY 101           3HT      GLY 101  -0.750  17.947  -7.737
  292    HA2  GLY 101           1HA      GLY 101   2.022  17.654  -8.747
  293    HA3  GLY 101           2HA      GLY 101   1.602  18.127  -7.105
  294    HA   PRO 102           HA       PRO 102   1.733  13.521  -7.084
  295    HB2  PRO 102           2HB      PRO 102   3.369  13.239  -4.962
  296    HB3  PRO 102           1HB      PRO 102   3.997  13.510  -6.592
  297    HG2  PRO 102           2HG      PRO 102   3.655  15.460  -4.346
  298    HG3  PRO 102           1HG      PRO 102   5.000  15.290  -5.488
  299    HD2  PRO 102           2HD      PRO 102   3.013  17.162  -5.730
  300    HD3  PRO 102           1HD      PRO 102   3.941  16.524  -7.102
  301    HA   PRO 103           HA       PRO 103  -1.349  13.531  -3.867
  302    HB2  PRO 103           2HB      PRO 103  -1.723  10.871  -3.618
  303    HB3  PRO 103           1HB      PRO 103  -2.298  11.773  -5.023
  304    HG2  PRO 103           2HG      PRO 103   0.121  10.053  -4.727
  305    HG3  PRO 103           1HG      PRO 103  -0.984  10.199  -6.105
  306    HD2  PRO 103           2HD      PRO 103   1.470  11.418  -5.955
  307    HD3  PRO 103           1HD      PRO 103   0.123  12.017  -6.943
  308    H    LEU 104           H        LEU 104  -1.407  13.395  -1.633
  309    HA   LEU 104           HA       LEU 104   0.879  12.325  -0.247
  310    HG   LEU 104           HG       LEU 104   1.112  14.420   1.028
  311    HB2  LEU 104           2HB      LEU 104  -1.739  13.494   0.689
  312    HB3  LEU 104           1HB      LEU 104  -0.615  12.751   1.806
  313   HD11  LEU 104          1HD1      LEU 104   0.261  16.484  -0.003
  314   HD12  LEU 104          2HD1      LEU 104  -1.294  15.691  -0.263
  315   HD13  LEU 104          3HD1      LEU 104   0.152  15.087  -1.072
  316   HD21  LEU 104          3HD2      LEU 104  -1.384  15.513   2.312
  317   HD22  LEU 104          1HD2      LEU 104   0.231  16.217   2.409
  318   HD23  LEU 104          2HD2      LEU 104  -0.091  14.644   3.138
  319    H    ILE 105           H        ILE 105   0.926  10.462   0.991
  320    HA   ILE 105           HA       ILE 105  -0.874   8.406   0.115
  321    HB   ILE 105           HB       ILE 105   1.212   7.876   2.235
  322   HG12  ILE 105          2HG1      ILE 105   1.690   8.403  -0.716
  323   HG13  ILE 105          1HG1      ILE 105   2.322   9.355   0.613
  324   HG21  ILE 105          1HG2      ILE 105   1.426   5.802   1.016
  325   HG22  ILE 105          2HG2      ILE 105   0.250   6.357  -0.178
  326   HG23  ILE 105          3HG2      ILE 105  -0.246   6.088   1.494
  327   HD11  ILE 105          3HD1      ILE 105   3.632   7.402   1.337
  328   HD12  ILE 105          1HD1      ILE 105   4.034   7.965  -0.287
  329   HD13  ILE 105          2HD1      ILE 105   3.036   6.528  -0.079
  330    HA   PRO 106           HA       PRO 106  -3.341   8.299   3.901
  331    HB2  PRO 106           2HB      PRO 106  -3.729   5.458   3.233
  332    HB3  PRO 106           1HB      PRO 106  -4.945   6.716   3.344
  333    HG2  PRO 106           2HG      PRO 106  -4.260   5.620   0.999
  334    HG3  PRO 106           1HG      PRO 106  -4.719   7.328   1.132
  335    HD2  PRO 106           2HD      PRO 106  -1.999   6.111   0.917
  336    HD3  PRO 106           1HD      PRO 106  -2.642   7.575   0.146
  337    HA   PRO 107           HA       PRO 107  -0.134   6.057   6.112
  338    HB2  PRO 107           2HB      PRO 107  -1.716   5.938   8.538
  339    HB3  PRO 107           1HB      PRO 107  -0.307   6.946   8.200
  340    HG2  PRO 107           2HG      PRO 107  -2.864   7.917   8.515
  341    HG3  PRO 107           1HG      PRO 107  -1.588   8.745   7.608
  342    HD2  PRO 107           2HD      PRO 107  -3.883   7.120   6.608
  343    HD3  PRO 107           1HD      PRO 107  -3.136   8.573   5.909
  344    HA   PRO 108           HA       PRO 108  -1.992   1.983   6.111
  345    HB2  PRO 108           2HB      PRO 108   0.468   0.738   6.812
  346    HB3  PRO 108           1HB      PRO 108  -0.254   0.872   5.197
  347    HG2  PRO 108           2HG      PRO 108   2.082   2.126   6.039
  348    HG3  PRO 108           1HG      PRO 108   1.125   2.565   4.609
  349    HD2  PRO 108           2HD      PRO 108   1.250   3.860   7.277
  350    HD3  PRO 108           1HD      PRO 108   0.999   4.539   5.650
  351    HA   PRO 109           HA       PRO 109  -2.659   1.233  10.431
  352    HB2  PRO 109           2HB      PRO 109  -3.876  -1.190  10.193
  353    HB3  PRO 109           1HB      PRO 109  -4.678   0.336   9.798
  354    HG2  PRO 109           2HG      PRO 109  -3.448  -1.687   7.964
  355    HG3  PRO 109           1HG      PRO 109  -4.916  -0.717   7.757
  356    HD2  PRO 109           2HD      PRO 109  -2.505  -0.166   6.599
  357    HD3  PRO 109           1HD      PRO 109  -3.753   1.048   6.926
  Start of MODEL    9
    1    H1   GLY   1           1HT      GLY   1 -10.040 -22.524 -15.621
    2    H2   GLY   1           2HT      GLY   1  -8.383 -22.410 -15.275
    3    H3   GLY   1           3HT      GLY   1  -9.087 -21.358 -16.404
    4    HA2  GLY   1           1HA      GLY   1 -10.444 -20.363 -14.664
    5    HA3  GLY   1           2HA      GLY   1  -9.672 -21.428 -13.499
    6    H    ALA   2           H        ALA   2  -9.674 -18.379 -14.616
    7    HA   ALA   2           HA       ALA   2  -6.788 -18.000 -14.137
    8    HB1  ALA   2           1HB      ALA   2  -7.058 -15.838 -15.263
    9    HB2  ALA   2           2HB      ALA   2  -8.770 -16.188 -15.508
   10    HB3  ALA   2           3HB      ALA   2  -7.543 -17.180 -16.299
   11    H    THR   3           H        THR   3  -6.185 -16.125 -12.827
   12    HA   THR   3           HA       THR   3  -8.298 -15.318 -10.947
   13    HB   THR   3           HB       THR   3  -6.905 -17.141  -9.964
   14    HG1  THR   3           1HG      THR   3  -7.775 -15.827  -8.443
   15   HG21  THR   3          3HG2      THR   3  -4.774 -16.637 -11.038
   16   HG22  THR   3          1HG2      THR   3  -4.595 -16.637  -9.283
   17   HG23  THR   3          2HG2      THR   3  -4.677 -15.110 -10.160
   18    H    ALA   4           H        ALA   4  -8.012 -13.268  -9.980
   19    HA   ALA   4           HA       ALA   4  -5.854 -11.628 -11.103
   20    HB1  ALA   4           1HB      ALA   4  -7.932 -11.205 -12.360
   21    HB2  ALA   4           2HB      ALA   4  -7.393  -9.787 -11.462
   22    HB3  ALA   4           3HB      ALA   4  -8.735 -10.757 -10.856
   23    H    VAL   5           H        VAL   5  -4.920 -10.223  -9.690
   24    HA   VAL   5           HA       VAL   5  -5.648 -10.529  -6.897
   25    HB   VAL   5           HB       VAL   5  -3.585  -9.343  -6.380
   26   HG11  VAL   5          1HG1      VAL   5  -3.196 -11.403  -8.545
   27   HG12  VAL   5          2HG1      VAL   5  -3.452 -11.725  -6.831
   28   HG13  VAL   5          3HG1      VAL   5  -1.980 -10.913  -7.362
   29   HG21  VAL   5          3HG2      VAL   5  -3.694  -7.751  -8.301
   30   HG22  VAL   5          1HG2      VAL   5  -3.128  -9.054  -9.348
   31   HG23  VAL   5          2HG2      VAL   5  -2.096  -8.460  -8.034
   32    H    SER   6           H        SER   6  -5.372  -8.359  -5.574
   33    HA   SER   6           HA       SER   6  -7.349  -6.536  -6.562
   34    HG   SER   6           HG       SER   6  -7.669  -8.060  -4.740
   35    HB2  SER   6           2HB      SER   6  -5.728  -6.415  -4.049
   36    HB3  SER   6           1HB      SER   6  -7.139  -5.421  -4.420
   37    H    GLU   7           H        GLU   7  -6.953  -4.161  -6.373
   38    HA   GLU   7           HA       GLU   7  -4.711  -3.616  -8.052
   39    HB2  GLU   7           2HB      GLU   7  -6.616  -1.665  -6.732
   40    HB3  GLU   7           1HB      GLU   7  -5.498  -1.299  -8.043
   41    HG2  GLU   7           2HG      GLU   7  -6.762  -3.156  -9.321
   42    HG3  GLU   7           1HG      GLU   7  -8.011  -2.916  -8.105
   43    H    TRP   8           H        TRP   8  -2.846  -3.583  -7.300
   44    HA   TRP   8           HA       TRP   8  -2.333  -2.770  -4.511
   45    HD1  TRP   8           HD       TRP   8  -1.102  -7.004  -6.507
   46    HE1  TRP   8           1HE      TRP   8  -2.612  -8.701  -5.304
   47    HE3  TRP   8           3HE      TRP   8  -3.016  -3.974  -2.946
   48    HZ2  TRP   8           2HZ      TRP   8  -4.409  -8.735  -3.136
   49    HZ3  TRP   8           3HZ      TRP   8  -4.679  -4.874  -1.400
   50    HH2  TRP   8           HH       TRP   8  -5.368  -7.181  -1.439
   51    HB2  TRP   8           2HB      TRP   8  -0.607  -4.517  -6.294
   52    HB3  TRP   8           1HB      TRP   8  -0.356  -4.200  -4.592
   53    H    THR   9           H        THR   9  -1.745  -0.638  -4.687
   54    HA   THR   9           HA       THR   9   0.225   0.065  -6.720
   55    HB   THR   9           HB       THR   9  -1.276   1.755  -6.796
   56    HG1  THR   9           1HG      THR   9   0.050   3.110  -4.801
   57   HG21  THR   9          3HG2      THR   9  -2.703   1.069  -4.942
   58   HG22  THR   9          1HG2      THR   9  -2.412   2.808  -4.880
   59   HG23  THR   9          2HG2      THR   9  -1.527   1.726  -3.798
   60    H    GLU  10           H        GLU  10   1.730   1.655  -6.101
   61    HA   GLU  10           HA       GLU  10   3.199   0.723  -3.701
   62    HB2  GLU  10           2HB      GLU  10   4.350   2.150  -6.102
   63    HB3  GLU  10           1HB      GLU  10   5.252   1.424  -4.780
   64    HG2  GLU  10           2HG      GLU  10   4.468  -0.791  -5.483
   65    HG3  GLU  10           1HG      GLU  10   3.592  -0.045  -6.819
   66    H    TYR  11           H        TYR  11   2.636   2.042  -2.148
   67    HA   TYR  11           HA       TYR  11   2.712   4.935  -2.653
   68    HD1  TYR  11           1HD      TYR  11   1.913   6.774  -1.743
   69    HD2  TYR  11           2HD      TYR  11  -1.461   4.338  -2.586
   70    HE1  TYR  11           1HE      TYR  11   0.740   8.743  -2.623
   71    HE2  TYR  11           2HE      TYR  11  -2.652   6.288  -3.493
   72    HH   TYR  11           HH       TYR  11  -1.109   9.227  -4.187
   73    HB2  TYR  11           2HB      TYR  11   0.509   3.341  -1.832
   74    HB3  TYR  11           1HB      TYR  11   1.000   4.311  -0.447
   75    H    LYS  12           H        LYS  12   4.772   5.171  -1.887
   76    HA   LYS  12           HA       LYS  12   5.481   3.924   0.646
   77    HB2  LYS  12           2HB      LYS  12   7.134   5.539  -1.317
   78    HB3  LYS  12           1HB      LYS  12   7.769   4.730   0.109
   79    HG2  LYS  12           2HG      LYS  12   7.289   2.585  -0.793
   80    HG3  LYS  12           1HG      LYS  12   6.358   3.285  -2.114
   81    HD2  LYS  12           2HD      LYS  12   9.234   4.015  -1.788
   82    HD3  LYS  12           1HD      LYS  12   8.807   2.467  -2.514
   83    HE2  LYS  12           2HE      LYS  12   9.095   4.044  -4.286
   84    HE3  LYS  12           1HE      LYS  12   7.377   3.701  -4.142
   85    HZ1  LYS  12           3HZ      LYS  12   8.746   6.105  -3.053
   86    HZ2  LYS  12           1HZ      LYS  12   7.083   5.785  -2.962
   87    HZ3  LYS  12           2HZ      LYS  12   7.807   6.060  -4.465
   88    H    THR  13           H        THR  13   5.338   4.932   2.485
   89    HA   THR  13           HA       THR  13   4.532   7.671   2.619
   90    HB   THR  13           HB       THR  13   4.494   7.317   5.060
   91    HG1  THR  13           1HG      THR  13   5.503   5.654   5.956
   92   HG21  THR  13          3HG2      THR  13   2.575   6.636   3.687
   93   HG22  THR  13          1HG2      THR  13   2.760   5.615   5.115
   94   HG23  THR  13          2HG2      THR  13   3.271   5.023   3.533
   95    H    ALA  14           H        ALA  14   5.695   8.959   4.513
   96    HA   ALA  14           HA       ALA  14   8.238   9.645   3.448
   97    HB1  ALA  14           1HB      ALA  14   6.664  11.293   4.362
   98    HB2  ALA  14           2HB      ALA  14   8.251  11.389   5.125
   99    HB3  ALA  14           3HB      ALA  14   6.910  10.619   5.973
  100    H    ASP  15           H        ASP  15   7.467   7.117   5.341
  101    HA   ASP  15           HA       ASP  15   9.672   7.258   7.215
  102    HB2  ASP  15           2HB      ASP  15   7.903   4.896   6.557
  103    HB3  ASP  15           1HB      ASP  15   8.909   5.097   7.989
  104    H    GLY  16           H        GLY  16   9.326   6.520   3.986
  105    HA2  GLY  16           2HA      GLY  16  10.855   5.671   2.472
  106    HA3  GLY  16           1HA      GLY  16  11.963   5.400   3.813
  107    H    LYS  17           H        LYS  17   8.690   4.167   3.315
  108    HA   LYS  17           HA       LYS  17   9.772   1.443   3.126
  109    HB2  LYS  17           2HB      LYS  17   8.980   1.993   5.465
  110    HB3  LYS  17           1HB      LYS  17   7.370   2.213   4.797
  111    HG2  LYS  17           2HG      LYS  17   7.542   0.036   5.788
  112    HG3  LYS  17           1HG      LYS  17   7.402  -0.136   4.036
  113    HD2  LYS  17           2HD      LYS  17   9.811  -0.464   3.857
  114    HD3  LYS  17           1HD      LYS  17   9.986  -0.231   5.598
  115    HE2  LYS  17           2HE      LYS  17   8.648  -2.217   6.016
  116    HE3  LYS  17           1HE      LYS  17   8.402  -2.437   4.283
  117    HZ1  LYS  17           3HZ      LYS  17  10.152  -3.871   5.185
  118    HZ2  LYS  17           1HZ      LYS  17  11.040  -2.501   5.646
  119    HZ3  LYS  17           2HZ      LYS  17  10.747  -2.810   4.004
  120    H    THR  18           H        THR  18   8.568   0.071   1.781
  121    HA   THR  18           HA       THR  18   6.878   1.505  -0.089
  122    HB   THR  18           HB       THR  18   7.768  -1.382  -0.215
  123    HG1  THR  18           1HG      THR  18   9.497   0.241  -0.175
  124   HG21  THR  18          3HG2      THR  18   5.856  -0.854  -1.655
  125   HG22  THR  18          1HG2      THR  18   7.305  -1.136  -2.621
  126   HG23  THR  18          2HG2      THR  18   6.739   0.511  -2.338
  127    H    TYR  19           H        TYR  19   5.012   1.842   1.010
  128    HA   TYR  19           HA       TYR  19   3.540  -0.449   2.045
  129    HD1  TYR  19           2HD      TYR  19   0.730   0.052   2.598
  130    HD2  TYR  19           1HD      TYR  19   2.077   4.099   2.940
  131    HE1  TYR  19           2HE      TYR  19  -1.598   0.820   2.711
  132    HE2  TYR  19           1HE      TYR  19  -0.178   4.815   3.072
  133    HH   TYR  19           HH       TYR  19  -2.851   2.740   3.529
  134    HB2  TYR  19           2HB      TYR  19   3.288   1.130   3.649
  135    HB3  TYR  19           1HB      TYR  19   3.662   2.442   2.553
  136    H    TYR  20           H        TYR  20   1.588  -1.133   1.192
  137    HA   TYR  20           HA       TYR  20   1.011  -0.075  -1.498
  138    HD1  TYR  20           2HD      TYR  20   2.650  -3.055   0.486
  139    HD2  TYR  20           1HD      TYR  20   1.530  -2.692  -3.611
  140    HE1  TYR  20           2HE      TYR  20   4.752  -4.093  -0.179
  141    HE2  TYR  20           1HE      TYR  20   3.642  -3.741  -4.285
  142    HH   TYR  20           HH       TYR  20   5.881  -4.080  -3.412
  143    HB2  TYR  20           2HB      TYR  20   0.180  -2.755  -0.337
  144    HB3  TYR  20           1HB      TYR  20  -0.042  -2.215  -1.989
  145    H    TYR  21           H        TYR  21  -1.012   0.733  -1.932
  146    HA   TYR  21           HA       TYR  21  -2.974   0.534   0.256
  147    HD1  TYR  21           1HD      TYR  21  -5.163   2.447  -2.439
  148    HD2  TYR  21           2HD      TYR  21  -3.940   3.344   1.561
  149    HE1  TYR  21           1HE      TYR  21  -7.447   3.185  -1.902
  150    HE2  TYR  21           2HE      TYR  21  -6.222   4.068   2.082
  151    HH   TYR  21           HH       TYR  21  -8.212   4.919   0.883
  152    HB2  TYR  21           2HB      TYR  21  -2.286   2.868  -0.147
  153    HB3  TYR  21           1HB      TYR  21  -2.752   2.718  -1.837
  154    H    ASN  22           H        ASN  22  -4.732  -0.515  -0.153
  155    HA   ASN  22           HA       ASN  22  -4.846  -1.851  -2.738
  156    HB2  ASN  22           2HB      ASN  22  -6.539  -2.492  -0.339
  157    HB3  ASN  22           1HB      ASN  22  -6.027  -3.563  -1.636
  158   HD21  ASN  22          1HD2      ASN  22  -3.237  -2.544  -1.467
  159   HD22  ASN  22          2HD2      ASN  22  -2.567  -3.293  -0.056
  160    H    ASN  23           H        ASN  23  -6.303  -1.212  -4.228
  161    HA   ASN  23           HA       ASN  23  -8.595   0.363  -3.388
  162    HB2  ASN  23           2HB      ASN  23  -7.234   0.796  -5.520
  163    HB3  ASN  23           1HB      ASN  23  -8.041  -0.616  -6.192
  164   HD21  ASN  23          1HD2      ASN  23  -9.134   0.526  -7.761
  165   HD22  ASN  23          2HD2      ASN  23 -10.428   1.624  -7.387
  166    H    ARG  24           H        ARG  24  -8.041  -2.548  -2.809
  167    HA   ARG  24           HA       ARG  24  -9.891  -4.231  -4.073
  168    HE   ARG  24           HE       ARG  24  -9.765  -8.743  -1.772
  169    HB2  ARG  24           2HB      ARG  24  -7.983  -4.951  -2.648
  170    HB3  ARG  24           1HB      ARG  24  -8.828  -4.337  -1.242
  171    HG2  ARG  24           2HG      ARG  24 -10.602  -6.000  -1.600
  172    HG3  ARG  24           1HG      ARG  24  -9.704  -6.633  -2.985
  173    HD2  ARG  24           2HD      ARG  24  -7.769  -7.029  -1.450
  174    HD3  ARG  24           1HD      ARG  24  -8.809  -6.570  -0.107
  175   HH11  ARG  24          1HH1      ARG  24  -8.125  -7.738   1.142
  176   HH12  ARG  24          2HH1      ARG  24  -8.249  -9.284   1.915
  177   HH21  ARG  24          1HH2      ARG  24  -9.957 -10.797  -0.767
  178   HH22  ARG  24          2HH2      ARG  24  -9.325 -11.019   0.839
  179    H    THR  25           H        THR  25 -10.300  -3.722  -0.650
  180    HA   THR  25           HA       THR  25 -13.038  -2.776  -1.025
  181    HB   THR  25           HB       THR  25 -12.670  -4.791   0.412
  182    HG1  THR  25           1HG      THR  25 -14.386  -3.023   0.730
  183   HG21  THR  25          3HG2      THR  25 -11.305  -2.761   2.144
  184   HG22  THR  25          1HG2      THR  25 -10.553  -4.136   1.350
  185   HG23  THR  25          2HG2      THR  25 -11.724  -4.400   2.643
  186    H    LEU  26           H        LEU  26 -10.494  -1.266  -1.339
  187    HA   LEU  26           HA       LEU  26  -9.352   0.567  -0.696
  188    HG   LEU  26           HG       LEU  26 -12.152   1.359  -1.551
  189    HB2  LEU  26           2HB      LEU  26 -11.861   1.128   0.881
  190    HB3  LEU  26           1HB      LEU  26 -10.494   2.225   0.822
  191   HD11  LEU  26          1HD1      LEU  26 -13.353   2.872  -0.054
  192   HD12  LEU  26          2HD1      LEU  26 -12.938   3.662  -1.575
  193   HD13  LEU  26          3HD1      LEU  26 -12.006   4.007  -0.118
  194   HD21  LEU  26          3HD2      LEU  26  -9.829   1.786  -2.162
  195   HD22  LEU  26          1HD2      LEU  26  -9.896   3.352  -1.355
  196   HD23  LEU  26          2HD2      LEU  26 -10.887   3.053  -2.784
  197    H    GLU  27           H        GLU  27  -7.968  -1.001   0.212
  198    HA   GLU  27           HA       GLU  27  -8.009  -1.168   3.152
  199    HB2  GLU  27           2HB      GLU  27  -8.525  -3.341   1.960
  200    HB3  GLU  27           1HB      GLU  27  -6.942  -3.237   1.212
  201    HG2  GLU  27           2HG      GLU  27  -7.062  -4.754   3.176
  202    HG3  GLU  27           1HG      GLU  27  -5.826  -3.493   3.278
  203    H    SER  28           H        SER  28  -5.850  -1.441   4.111
  204    HA   SER  28           HA       SER  28  -3.697  -0.410   2.390
  205    HG   SER  28           HG       SER  28  -4.874   1.485   3.338
  206    HB2  SER  28           2HB      SER  28  -4.333   0.077   5.273
  207    HB3  SER  28           1HB      SER  28  -2.694   0.302   4.679
  208    H    THR  29           H        THR  29  -1.694  -1.355   2.518
  209    HA   THR  29           HA       THR  29  -1.340  -3.728   4.213
  210    HB   THR  29           HB       THR  29  -0.073  -4.679   2.139
  211    HG1  THR  29           1HG      THR  29  -0.856  -2.480   1.078
  212   HG21  THR  29          3HG2      THR  29  -2.137  -5.748   1.316
  213   HG22  THR  29          1HG2      THR  29  -3.072  -4.601   2.279
  214   HG23  THR  29          2HG2      THR  29  -1.998  -5.754   3.079
  215    H    TRP  30           H        TRP  30   0.695  -3.835   5.072
  216    HA   TRP  30           HA       TRP  30   2.273  -1.470   4.679
  217    HD1  TRP  30           HD       TRP  30   0.662  -2.092   8.174
  218    HE1  TRP  30           1HE      TRP  30   0.878   0.276   9.173
  219    HE3  TRP  30           3HE      TRP  30   4.965  -0.624   5.836
  220    HZ2  TRP  30           2HZ      TRP  30   2.616   2.520   8.911
  221    HZ3  TRP  30           3HZ      TRP  30   5.838   1.634   6.258
  222    HH2  TRP  30           HH       TRP  30   4.693   3.168   7.781
  223    HB2  TRP  30           2HB      TRP  30   2.209  -3.611   6.681
  224    HB3  TRP  30           1HB      TRP  30   3.827  -2.991   6.327
  225    H    GLU  31           H        GLU  31   3.253  -4.926   4.485
  226    HA   GLU  31           HA       GLU  31   4.883  -4.055   2.208
  227    HB2  GLU  31           2HB      GLU  31   6.396  -5.752   2.544
  228    HB3  GLU  31           1HB      GLU  31   6.046  -5.188   4.170
  229    HG2  GLU  31           2HG      GLU  31   5.296  -7.179   4.803
  230    HG3  GLU  31           1HG      GLU  31   4.311  -7.365   3.349
  231    H    LYS  32           H        LYS  32   5.309  -6.463   1.023
  232    HA   LYS  32           HA       LYS  32   3.320  -6.540  -0.875
  233    HB2  LYS  32           2HB      LYS  32   5.169  -8.810  -0.115
  234    HB3  LYS  32           1HB      LYS  32   4.305  -8.651  -1.639
  235    HG2  LYS  32           2HG      LYS  32   5.566  -6.597  -2.113
  236    HG3  LYS  32           1HG      LYS  32   6.456  -6.818  -0.605
  237    HD2  LYS  32           2HD      LYS  32   6.412  -8.726  -2.942
  238    HD3  LYS  32           1HD      LYS  32   7.729  -7.631  -2.524
  239    HE2  LYS  32           2HE      LYS  32   6.705  -9.910  -0.836
  240    HE3  LYS  32           1HE      LYS  32   8.209  -9.893  -1.755
  241    HZ1  LYS  32           3HZ      LYS  32   7.507  -8.309   0.650
  242    HZ2  LYS  32           1HZ      LYS  32   8.819  -7.897  -0.352
  243    HZ3  LYS  32           2HZ      LYS  32   8.790  -9.396   0.439
  244    HA   PRO  33           HA       PRO  33  -0.118  -8.926   0.882
  245    HB2  PRO  33           2HB      PRO  33  -0.573  -9.076  -2.068
  246    HB3  PRO  33           1HB      PRO  33  -1.719  -8.695  -0.778
  247    HG2  PRO  33           2HG      PRO  33  -0.764  -6.766  -2.311
  248    HG3  PRO  33           1HG      PRO  33  -0.944  -6.510  -0.565
  249    HD2  PRO  33           2HD      PRO  33   1.525  -7.056  -2.160
  250    HD3  PRO  33           1HD      PRO  33   1.300  -5.978  -0.768
  251    H    GLN  34           H        GLN  34  -1.147 -11.072  -0.117
  252    HA   GLN  34           HA       GLN  34   1.073 -12.943   0.003
  253    HB2  GLN  34           2HB      GLN  34  -1.917 -13.409   0.033
  254    HB3  GLN  34           1HB      GLN  34  -0.695 -14.646   0.290
  255    HG2  GLN  34           2HG      GLN  34   0.090 -13.475   2.277
  256    HG3  GLN  34           1HG      GLN  34  -1.128 -12.229   2.022
  257   HE21  GLN  34          1HE2      GLN  34  -3.180 -14.132   1.180
  258   HE22  GLN  34          2HE2      GLN  34  -3.683 -14.940   2.625
  259    H    GLU  35           H        GLU  35  -1.391 -11.898  -2.238
  260    HA   GLU  35           HA       GLU  35  -0.500 -13.861  -4.225
  261    HB2  GLU  35           2HB      GLU  35  -2.455 -12.997  -5.550
  262    HB3  GLU  35           1HB      GLU  35  -2.872 -13.773  -4.032
  263    HG2  GLU  35           2HG      GLU  35  -2.634 -10.793  -4.316
  264    HG3  GLU  35           1HG      GLU  35  -4.132 -11.667  -4.619
  265    H    LEU  36           H        LEU  36   0.452 -10.953  -3.229
  266    HA   LEU  36           HA       LEU  36   0.682  -9.375  -5.547
  267    HG   LEU  36           HG       LEU  36   2.531  -6.984  -3.487
  268    HB2  LEU  36           2HB      LEU  36   1.005  -8.702  -3.155
  269    HB3  LEU  36           1HB      LEU  36   2.604  -9.390  -3.259
  270   HD11  LEU  36          1HD1      LEU  36   3.980  -6.782  -5.401
  271   HD12  LEU  36          2HD1      LEU  36   3.436  -8.368  -5.951
  272   HD13  LEU  36          3HD1      LEU  36   4.333  -8.222  -4.446
  273   HD21  LEU  36          3HD2      LEU  36   0.423  -6.604  -4.550
  274   HD22  LEU  36          1HD2      LEU  36   0.982  -7.430  -6.017
  275   HD23  LEU  36          2HD2      LEU  36   1.723  -5.907  -5.524
  276    H    LYS  37           H        LYS  37   1.635 -10.039  -7.360
  277    HA   LYS  37           HA       LYS  37   4.315 -11.190  -7.183
  278    HB2  LYS  37           2HB      LYS  37   3.740 -12.698  -9.115
  279    HB3  LYS  37           1HB      LYS  37   2.961 -13.111  -7.595
  280    HG2  LYS  37           2HG      LYS  37   0.883 -12.112  -8.356
  281    HG3  LYS  37           1HG      LYS  37   1.660 -11.597  -9.853
  282    HD2  LYS  37           2HD      LYS  37   0.363 -13.616 -10.226
  283    HD3  LYS  37           1HD      LYS  37   2.083 -13.945 -10.431
  284    HE2  LYS  37           2HE      LYS  37   1.019 -15.737  -9.208
  285    HE3  LYS  37           1HE      LYS  37   2.163 -14.884  -8.173
  286    HZ1  LYS  37           3HZ      LYS  37  -0.778 -14.500  -8.184
  287    HZ2  LYS  37           1HZ      LYS  37   0.314 -13.677  -7.186
  288    HZ3  LYS  37           2HZ      LYS  37   0.097 -15.354  -7.017
  289    H1   GLY 101           1HT      GLY 101  -1.035  18.473  -7.816
  290    H2   GLY 101           2HT      GLY 101  -0.096  18.285  -9.208
  291    H3   GLY 101           3HT      GLY 101  -0.117  19.771  -8.390
  292    HA2  GLY 101           1HA      GLY 101   1.923  18.536  -7.938
  293    HA3  GLY 101           2HA      GLY 101   0.969  18.809  -6.486
  294    HA   PRO 102           HA       PRO 102   1.722  14.222  -6.981
  295    HB2  PRO 102           2HB      PRO 102   3.411  13.822  -4.916
  296    HB3  PRO 102           1HB      PRO 102   3.994  14.295  -6.516
  297    HG2  PRO 102           2HG      PRO 102   3.591  15.964  -4.068
  298    HG3  PRO 102           1HG      PRO 102   4.906  16.014  -5.257
  299    HD2  PRO 102           2HD      PRO 102   2.785  17.759  -5.224
  300    HD3  PRO 102           1HD      PRO 102   3.724  17.365  -6.677
  301    HA   PRO 103           HA       PRO 103  -1.299  13.700  -3.789
  302    HB2  PRO 103           2HB      PRO 103  -1.533  11.015  -3.792
  303    HB3  PRO 103           1HB      PRO 103  -2.138  12.009  -5.116
  304    HG2  PRO 103           2HG      PRO 103   0.370  10.400  -4.944
  305    HG3  PRO 103           1HG      PRO 103  -0.730  10.615  -6.317
  306    HD2  PRO 103           2HD      PRO 103   1.653  11.955  -6.018
  307    HD3  PRO 103           1HD      PRO 103   0.281  12.558  -6.970
  308    H    LEU 104           H        LEU 104  -1.391  13.340  -1.611
  309    HA   LEU 104           HA       LEU 104   0.989  12.438  -0.253
  310    HG   LEU 104           HG       LEU 104  -0.389  15.055   1.974
  311    HB2  LEU 104           2HB      LEU 104  -1.699  13.419   0.674
  312    HB3  LEU 104           1HB      LEU 104  -0.587  12.663   1.797
  313   HD11  LEU 104          1HD1      LEU 104   1.997  15.336   1.528
  314   HD12  LEU 104          2HD1      LEU 104   1.981  13.885   0.526
  315   HD13  LEU 104          3HD1      LEU 104   1.648  13.766   2.253
  316   HD21  LEU 104          3HD2      LEU 104   0.360  16.431   0.083
  317   HD22  LEU 104          1HD2      LEU 104  -1.220  15.702  -0.208
  318   HD23  LEU 104          2HD2      LEU 104   0.217  15.032  -0.981
  319    H    ILE 105           H        ILE 105   1.188  10.534   0.961
  320    HA   ILE 105           HA       ILE 105  -0.504   8.362   0.115
  321    HB   ILE 105           HB       ILE 105   1.559   8.060   2.319
  322   HG12  ILE 105          2HG1      ILE 105   3.120   7.439   0.326
  323   HG13  ILE 105          1HG1      ILE 105   2.034   8.427  -0.633
  324   HG21  ILE 105          1HG2      ILE 105   0.639   6.220   0.139
  325   HG22  ILE 105          2HG2      ILE 105   0.133   6.173   1.828
  326   HG23  ILE 105          3HG2      ILE 105   1.812   5.846   1.401
  327   HD11  ILE 105          3HD1      ILE 105   4.080   9.583   0.131
  328   HD12  ILE 105          1HD1      ILE 105   3.488   9.433   1.787
  329   HD13  ILE 105          2HD1      ILE 105   2.571  10.367   0.598
  330    HA   PRO 106           HA       PRO 106  -3.028   8.399   3.900
  331    HB2  PRO 106           2HB      PRO 106  -3.504   5.554   3.346
  332    HB3  PRO 106           1HB      PRO 106  -4.671   6.870   3.343
  333    HG2  PRO 106           2HG      PRO 106  -3.916   5.590   1.095
  334    HG3  PRO 106           1HG      PRO 106  -4.378   7.300   1.107
  335    HD2  PRO 106           2HD      PRO 106  -1.654   6.070   1.040
  336    HD3  PRO 106           1HD      PRO 106  -2.269   7.494   0.175
  337    HA   PRO 107           HA       PRO 107   0.063   6.104   6.217
  338    HB2  PRO 107           2HB      PRO 107  -1.561   6.095   8.611
  339    HB3  PRO 107           1HB      PRO 107  -0.104   7.034   8.285
  340    HG2  PRO 107           2HG      PRO 107  -2.615   8.121   8.547
  341    HG3  PRO 107           1HG      PRO 107  -1.291   8.873   7.642
  342    HD2  PRO 107           2HD      PRO 107  -3.647   7.339   6.633
  343    HD3  PRO 107           1HD      PRO 107  -2.821   8.746   5.922
  344    HA   PRO 108           HA       PRO 108  -1.931   2.097   6.224
  345    HB2  PRO 108           2HB      PRO 108   0.513   0.820   6.952
  346    HB3  PRO 108           1HB      PRO 108  -0.210   0.919   5.341
  347    HG2  PRO 108           2HG      PRO 108   2.145   2.157   6.098
  348    HG3  PRO 108           1HG      PRO 108   1.129   2.620   4.710
  349    HD2  PRO 108           2HD      PRO 108   1.343   3.871   7.398
  350    HD3  PRO 108           1HD      PRO 108   1.109   4.588   5.784
  351    HA   PRO 109           HA       PRO 109  -2.615   1.389  10.565
  352    HB2  PRO 109           2HB      PRO 109  -3.900  -0.978  10.379
  353    HB3  PRO 109           1HB      PRO 109  -4.649   0.542   9.876
  354    HG2  PRO 109           2HG      PRO 109  -3.307  -1.550   8.187
  355    HG3  PRO 109           1HG      PRO 109  -4.838  -0.696   7.905
  356    HD2  PRO 109           2HD      PRO 109  -2.511  -0.004   6.715
  357    HD3  PRO 109           1HD      PRO 109  -3.777   1.173   7.111
  Start of MODEL   10
    1    H1   GLY   1           1HT      GLY   1 -13.516 -15.855 -11.399
    2    H2   GLY   1           2HT      GLY   1 -12.506 -15.249 -12.622
    3    H3   GLY   1           3HT      GLY   1 -12.553 -14.495 -11.108
    4    HA2  GLY   1           1HA      GLY   1 -11.584 -17.251 -11.600
    5    HA3  GLY   1           2HA      GLY   1 -10.550 -15.843 -11.393
    6    H    ALA   2           H        ALA   2 -10.725 -18.285  -9.785
    7    HA   ALA   2           HA       ALA   2 -11.949 -17.592  -7.290
    8    HB1  ALA   2           1HB      ALA   2  -9.854 -19.685  -7.886
    9    HB2  ALA   2           2HB      ALA   2 -11.599 -19.931  -7.957
   10    HB3  ALA   2           3HB      ALA   2 -10.820 -19.567  -6.417
   11    H    THR   3           H        THR   3  -8.630 -17.671  -8.525
   12    HA   THR   3           HA       THR   3  -7.694 -16.027  -6.309
   13    HB   THR   3           HB       THR   3  -5.496 -16.156  -7.587
   14    HG1  THR   3           1HG      THR   3  -5.587 -17.000  -9.515
   15   HG21  THR   3          3HG2      THR   3  -6.782 -18.714  -6.653
   16   HG22  THR   3          1HG2      THR   3  -5.884 -17.563  -5.665
   17   HG23  THR   3          2HG2      THR   3  -5.054 -18.490  -6.917
   18    H    ALA   4           H        ALA   4  -6.863 -13.912  -6.623
   19    HA   ALA   4           HA       ALA   4  -7.159 -12.601  -9.151
   20    HB1  ALA   4           1HB      ALA   4  -8.955 -11.087  -8.542
   21    HB2  ALA   4           2HB      ALA   4  -9.140 -11.895  -6.985
   22    HB3  ALA   4           3HB      ALA   4  -9.516 -12.758  -8.478
   23    H    VAL   5           H        VAL   5  -5.720 -11.039  -9.227
   24    HA   VAL   5           HA       VAL   5  -4.427 -10.072  -6.838
   25    HB   VAL   5           HB       VAL   5  -4.125  -8.996  -9.640
   26   HG11  VAL   5          1HG1      VAL   5  -2.175  -8.965  -7.330
   27   HG12  VAL   5          2HG1      VAL   5  -3.201  -7.614  -7.822
   28   HG13  VAL   5          3HG1      VAL   5  -1.962  -8.218  -8.918
   29   HG21  VAL   5          3HG2      VAL   5  -2.213 -10.521  -9.897
   30   HG22  VAL   5          1HG2      VAL   5  -3.739 -11.386  -9.702
   31   HG23  VAL   5          2HG2      VAL   5  -2.618 -11.260  -8.347
   32    H    SER   6           H        SER   6  -5.141  -8.417  -5.696
   33    HA   SER   6           HA       SER   6  -7.280  -6.750  -6.618
   34    HG   SER   6           HG       SER   6  -7.386  -8.402  -4.809
   35    HB2  SER   6           2HB      SER   6  -5.682  -6.483  -4.106
   36    HB3  SER   6           1HB      SER   6  -7.237  -5.728  -4.455
   37    H    GLU   7           H        GLU   7  -7.048  -4.322  -6.325
   38    HA   GLU   7           HA       GLU   7  -4.859  -3.574  -7.984
   39    HB2  GLU   7           2HB      GLU   7  -7.042  -2.021  -6.611
   40    HB3  GLU   7           1HB      GLU   7  -5.745  -1.221  -7.491
   41    HG2  GLU   7           2HG      GLU   7  -7.569  -3.284  -8.694
   42    HG3  GLU   7           1HG      GLU   7  -7.835  -1.544  -8.794
   43    H    TRP   8           H        TRP   8  -2.972  -3.518  -7.247
   44    HA   TRP   8           HA       TRP   8  -2.451  -2.820  -4.418
   45    HD1  TRP   8           HD       TRP   8  -1.079  -7.138  -6.173
   46    HE1  TRP   8           1HE      TRP   8  -2.619  -8.694  -4.825
   47    HE3  TRP   8           3HE      TRP   8  -3.108  -3.690  -3.131
   48    HZ2  TRP   8           2HZ      TRP   8  -4.544  -8.440  -2.729
   49    HZ3  TRP   8           3HZ      TRP   8  -4.866  -4.380  -1.587
   50    HH2  TRP   8           HH       TRP   8  -5.551  -6.648  -1.324
   51    HB2  TRP   8           2HB      TRP   8  -0.817  -4.542  -6.349
   52    HB3  TRP   8           1HB      TRP   8  -0.367  -4.180  -4.694
   53    H    THR   9           H        THR   9  -1.808  -0.696  -4.515
   54    HA   THR   9           HA       THR   9  -0.012   0.100  -6.670
   55    HB   THR   9           HB       THR   9  -1.256   1.922  -6.626
   56    HG1  THR   9           1HG      THR   9  -0.416   3.529  -5.492
   57   HG21  THR   9          3HG2      THR   9  -2.766   2.610  -4.800
   58   HG22  THR   9          1HG2      THR   9  -2.090   1.333  -3.787
   59   HG23  THR   9          2HG2      THR   9  -3.003   0.916  -5.241
   60    H    GLU  10           H        GLU  10   1.725   1.507  -6.121
   61    HA   GLU  10           HA       GLU  10   3.103   0.456  -3.730
   62    HB2  GLU  10           2HB      GLU  10   4.351   1.335  -6.331
   63    HB3  GLU  10           1HB      GLU  10   5.229   0.757  -4.931
   64    HG2  GLU  10           2HG      GLU  10   4.169  -1.427  -5.148
   65    HG3  GLU  10           1HG      GLU  10   3.256  -0.855  -6.542
   66    H    TYR  11           H        TYR  11   2.949   1.915  -2.290
   67    HA   TYR  11           HA       TYR  11   3.533   4.729  -2.933
   68    HD1  TYR  11           1HD      TYR  11   2.518   6.964  -2.077
   69    HD2  TYR  11           2HD      TYR  11  -0.499   4.077  -2.883
   70    HE1  TYR  11           1HE      TYR  11   1.216   8.686  -3.253
   71    HE2  TYR  11           2HE      TYR  11  -1.811   5.778  -4.081
   72    HH   TYR  11           HH       TYR  11  -2.040   8.209  -4.152
   73    HB2  TYR  11           2HB      TYR  11   1.273   3.488  -1.536
   74    HB3  TYR  11           1HB      TYR  11   2.033   4.771  -0.611
   75    H    LYS  12           H        LYS  12   4.875   5.806  -1.434
   76    HA   LYS  12           HA       LYS  12   5.671   4.186   0.873
   77    HB2  LYS  12           2HB      LYS  12   7.989   5.004   0.643
   78    HB3  LYS  12           1HB      LYS  12   7.480   4.027  -0.724
   79    HG2  LYS  12           2HG      LYS  12   7.059   6.132  -1.990
   80    HG3  LYS  12           1HG      LYS  12   7.746   7.023  -0.631
   81    HD2  LYS  12           2HD      LYS  12   9.819   5.648  -0.886
   82    HD3  LYS  12           1HD      LYS  12   9.138   4.993  -2.374
   83    HE2  LYS  12           2HE      LYS  12   9.768   7.881  -1.787
   84    HE3  LYS  12           1HE      LYS  12  10.671   6.811  -2.855
   85    HZ1  LYS  12           3HZ      LYS  12   8.590   6.633  -4.208
   86    HZ2  LYS  12           1HZ      LYS  12   9.296   8.178  -4.185
   87    HZ3  LYS  12           2HZ      LYS  12   7.925   7.858  -3.243
   88    H    THR  13           H        THR  13   5.504   5.150   2.739
   89    HA   THR  13           HA       THR  13   4.450   7.843   2.764
   90    HB   THR  13           HB       THR  13   4.110   7.348   5.221
   91    HG1  THR  13           1HG      THR  13   4.880   5.533   6.032
   92   HG21  THR  13          3HG2      THR  13   2.341   6.993   3.549
   93   HG22  THR  13          1HG2      THR  13   2.270   5.784   4.833
   94   HG23  THR  13          2HG2      THR  13   2.951   5.364   3.260
   95    H    ALA  14           H        ALA  14   5.153   8.885   5.112
   96    HA   ALA  14           HA       ALA  14   7.814   9.830   4.699
   97    HB1  ALA  14           1HB      ALA  14   5.944  10.252   7.023
   98    HB2  ALA  14           2HB      ALA  14   6.013  11.248   5.569
   99    HB3  ALA  14           3HB      ALA  14   7.392  11.193   6.668
  100    H    ASP  15           H        ASP  15   6.900   6.965   5.776
  101    HA   ASP  15           HA       ASP  15   8.721   6.663   8.010
  102    HB2  ASP  15           2HB      ASP  15   7.140   4.635   6.416
  103    HB3  ASP  15           1HB      ASP  15   8.084   4.268   7.853
  104    H    GLY  16           H        GLY  16   8.845   6.572   4.608
  105    HA2  GLY  16           2HA      GLY  16  10.568   6.038   3.160
  106    HA3  GLY  16           1HA      GLY  16  11.568   5.662   4.558
  107    H    LYS  17           H        LYS  17   8.445   4.246   4.081
  108    HA   LYS  17           HA       LYS  17   9.709   1.626   3.620
  109    HB2  LYS  17           2HB      LYS  17   7.157   2.218   5.122
  110    HB3  LYS  17           1HB      LYS  17   7.893   0.638   4.917
  111    HG2  LYS  17           2HG      LYS  17   9.196   2.925   6.371
  112    HG3  LYS  17           1HG      LYS  17   8.216   1.688   7.158
  113    HD2  LYS  17           2HD      LYS  17   9.793  -0.022   6.215
  114    HD3  LYS  17           1HD      LYS  17  10.810   1.312   5.667
  115    HE2  LYS  17           2HE      LYS  17  11.565   0.375   7.817
  116    HE3  LYS  17           1HE      LYS  17  11.106   2.075   7.943
  117    HZ1  LYS  17           3HZ      LYS  17  10.260   0.709   9.786
  118    HZ2  LYS  17           1HZ      LYS  17   9.356  -0.211   8.685
  119    HZ3  LYS  17           2HZ      LYS  17   9.009   1.435   8.903
  120    H    THR  18           H        THR  18   8.610   0.173   2.275
  121    HA   THR  18           HA       THR  18   6.957   1.415   0.246
  122    HB   THR  18           HB       THR  18   7.926  -1.449   0.409
  123    HG1  THR  18           1HG      THR  18   9.809  -0.515   0.056
  124   HG21  THR  18          3HG2      THR  18   6.059  -1.138  -1.129
  125   HG22  THR  18          1HG2      THR  18   7.546  -1.428  -2.032
  126   HG23  THR  18          2HG2      THR  18   6.895   0.206  -1.904
  127    H    TYR  19           H        TYR  19   4.848   1.505   0.503
  128    HA   TYR  19           HA       TYR  19   3.470  -0.620   2.000
  129    HD1  TYR  19           1HD      TYR  19   0.616  -0.044   2.426
  130    HD2  TYR  19           2HD      TYR  19   2.047   4.001   2.636
  131    HE1  TYR  19           1HE      TYR  19  -1.676   0.786   2.507
  132    HE2  TYR  19           2HE      TYR  19  -0.215   4.768   2.672
  133    HH   TYR  19           HH       TYR  19  -2.906   2.746   3.208
  134    HB2  TYR  19           2HB      TYR  19   3.184   1.053   3.492
  135    HB3  TYR  19           1HB      TYR  19   3.601   2.283   2.324
  136    H    TYR  20           H        TYR  20   1.589  -1.443   1.123
  137    HA   TYR  20           HA       TYR  20   0.903  -0.434  -1.560
  138    HD1  TYR  20           1HD      TYR  20   1.770  -2.254  -3.576
  139    HD2  TYR  20           2HD      TYR  20   2.419  -4.104   0.228
  140    HE1  TYR  20           1HE      TYR  20   3.894  -3.175  -4.387
  141    HE2  TYR  20           2HE      TYR  20   4.539  -5.015  -0.603
  142    HH   TYR  20           HH       TYR  20   5.959  -4.029  -3.596
  143    HB2  TYR  20           2HB      TYR  20   0.194  -3.154  -0.386
  144    HB3  TYR  20           1HB      TYR  20  -0.089  -2.602  -2.020
  145    H    TYR  21           H        TYR  21  -1.131   0.299  -1.951
  146    HA   TYR  21           HA       TYR  21  -2.999   0.238   0.321
  147    HD1  TYR  21           1HD      TYR  21  -5.299   1.881  -2.333
  148    HD2  TYR  21           2HD      TYR  21  -3.820   3.372   1.385
  149    HE1  TYR  21           1HE      TYR  21  -7.535   2.729  -1.775
  150    HE2  TYR  21           2HE      TYR  21  -6.050   4.199   1.933
  151    HH   TYR  21           HH       TYR  21  -8.095   4.919   0.743
  152    HB2  TYR  21           2HB      TYR  21  -2.287   2.532  -0.264
  153    HB3  TYR  21           1HB      TYR  21  -2.815   2.280  -1.923
  154    H    ASN  22           H        ASN  22  -4.488  -1.114   0.075
  155    HA   ASN  22           HA       ASN  22  -4.930  -2.540  -2.347
  156    HB2  ASN  22           2HB      ASN  22  -5.117  -3.783  -0.336
  157    HB3  ASN  22           1HB      ASN  22  -6.112  -2.560   0.443
  158   HD21  ASN  22          1HD2      ASN  22  -8.313  -2.592   0.142
  159   HD22  ASN  22          2HD2      ASN  22  -9.127  -3.877  -0.669
  160    H    ASN  23           H        ASN  23  -6.142  -1.752  -3.956
  161    HA   ASN  23           HA       ASN  23  -8.466  -0.100  -3.300
  162    HB2  ASN  23           2HB      ASN  23  -7.109  -0.710  -5.929
  163    HB3  ASN  23           1HB      ASN  23  -8.629   0.169  -5.817
  164   HD21  ASN  23          1HD2      ASN  23  -6.159   1.107  -6.909
  165   HD22  ASN  23          2HD2      ASN  23  -5.669   2.466  -5.959
  166    H    ARG  24           H        ARG  24  -8.186  -3.116  -2.883
  167    HA   ARG  24           HA       ARG  24 -10.055  -4.321  -4.618
  168    HE   ARG  24           HE       ARG  24  -8.266  -7.733  -2.472
  169    HB2  ARG  24           2HB      ARG  24  -8.528  -5.592  -3.079
  170    HB3  ARG  24           1HB      ARG  24  -9.608  -5.142  -1.767
  171    HG2  ARG  24           2HG      ARG  24 -11.463  -6.202  -3.200
  172    HG3  ARG  24           1HG      ARG  24 -10.137  -6.946  -4.093
  173    HD2  ARG  24           2HD      ARG  24 -10.804  -7.265  -1.176
  174    HD3  ARG  24           1HD      ARG  24 -10.842  -8.495  -2.439
  175   HH11  ARG  24          1HH1      ARG  24 -10.427  -8.700   0.109
  176   HH12  ARG  24          2HH1      ARG  24  -9.152  -9.321   1.120
  177   HH21  ARG  24          1HH2      ARG  24  -6.580  -8.536  -1.118
  178   HH22  ARG  24          2HH2      ARG  24  -6.971  -9.221   0.430
  179    H    THR  25           H        THR  25 -10.749  -4.177  -1.201
  180    HA   THR  25           HA       THR  25 -13.289  -2.805  -1.658
  181    HB   THR  25           HB       THR  25 -13.643  -3.520   0.790
  182    HG1  THR  25           1HG      THR  25 -12.242  -4.970   1.616
  183   HG21  THR  25          3HG2      THR  25 -14.753  -4.610  -1.099
  184   HG22  THR  25          1HG2      THR  25 -14.298  -5.794   0.130
  185   HG23  THR  25          2HG2      THR  25 -13.340  -5.633  -1.342
  186    H    LEU  26           H        LEU  26 -10.510  -1.614  -1.502
  187    HA   LEU  26           HA       LEU  26  -9.459   0.225  -0.721
  188    HG   LEU  26           HG       LEU  26 -12.254   0.926  -1.807
  189    HB2  LEU  26           2HB      LEU  26 -12.091   0.781   0.640
  190    HB3  LEU  26           1HB      LEU  26 -10.734   1.894   0.617
  191   HD11  LEU  26          1HD1      LEU  26 -13.538   2.479  -0.429
  192   HD12  LEU  26          2HD1      LEU  26 -13.045   3.227  -1.947
  193   HD13  LEU  26          3HD1      LEU  26 -12.191   3.618  -0.453
  194   HD21  LEU  26          3HD2      LEU  26 -10.021   2.938  -1.565
  195   HD22  LEU  26          1HD2      LEU  26 -10.915   2.550  -3.035
  196   HD23  LEU  26          2HD2      LEU  26  -9.889   1.331  -2.282
  197    H    GLU  27           H        GLU  27  -7.915  -0.782   0.395
  198    HA   GLU  27           HA       GLU  27  -8.172  -0.933   3.304
  199    HB2  GLU  27           2HB      GLU  27  -8.756  -3.215   2.439
  200    HB3  GLU  27           1HB      GLU  27  -7.226  -3.252   1.592
  201    HG2  GLU  27           2HG      GLU  27  -7.214  -4.565   3.661
  202    HG3  GLU  27           1HG      GLU  27  -6.007  -3.290   3.637
  203    H    SER  28           H        SER  28  -6.001  -1.128   4.314
  204    HA   SER  28           HA       SER  28  -3.825  -0.352   2.470
  205    HG   SER  28           HG       SER  28  -5.147   1.853   3.854
  206    HB2  SER  28           2HB      SER  28  -4.359   0.398   5.316
  207    HB3  SER  28           1HB      SER  28  -2.760   0.540   4.646
  208    H    THR  29           H        THR  29  -1.987  -1.592   2.463
  209    HA   THR  29           HA       THR  29  -1.573  -3.378   4.727
  210    HB   THR  29           HB       THR  29  -2.766  -4.803   3.148
  211    HG1  THR  29           1HG      THR  29  -0.154  -5.736   2.795
  212   HG21  THR  29          3HG2      THR  29  -2.061  -3.509   1.104
  213   HG22  THR  29          1HG2      THR  29  -2.021  -5.269   0.936
  214   HG23  THR  29          2HG2      THR  29  -0.522  -4.362   1.209
  215    H    TRP  30           H        TRP  30   0.603  -4.041   4.959
  216    HA   TRP  30           HA       TRP  30   2.278  -1.832   4.118
  217    HD1  TRP  30           HD       TRP  30   1.016  -2.347   7.980
  218    HE1  TRP  30           1HE      TRP  30   1.226   0.066   8.865
  219    HE3  TRP  30           3HE      TRP  30   4.793  -0.731   4.952
  220    HZ2  TRP  30           2HZ      TRP  30   2.792   2.392   8.281
  221    HZ3  TRP  30           3HZ      TRP  30   5.590   1.576   5.173
  222    HH2  TRP  30           HH       TRP  30   4.631   3.100   6.813
  223    HB2  TRP  30           2HB      TRP  30   2.388  -3.814   6.335
  224    HB3  TRP  30           1HB      TRP  30   3.918  -3.151   5.767
  225    H    GLU  31           H        GLU  31   2.696  -5.352   4.355
  226    HA   GLU  31           HA       GLU  31   4.700  -5.139   2.256
  227    HB2  GLU  31           2HB      GLU  31   3.999  -7.272   4.228
  228    HB3  GLU  31           1HB      GLU  31   4.914  -7.658   2.778
  229    HG2  GLU  31           2HG      GLU  31   6.533  -7.279   4.407
  230    HG3  GLU  31           1HG      GLU  31   6.479  -5.796   3.448
  231    H    LYS  32           H        LYS  32   4.759  -7.118   0.818
  232    HA   LYS  32           HA       LYS  32   2.587  -6.829  -0.952
  233    HB2  LYS  32           2HB      LYS  32   3.903  -8.700  -2.178
  234    HB3  LYS  32           1HB      LYS  32   4.642  -7.113  -1.984
  235    HG2  LYS  32           2HG      LYS  32   5.855  -7.959  -0.012
  236    HG3  LYS  32           1HG      LYS  32   5.171  -9.553  -0.314
  237    HD2  LYS  32           2HD      LYS  32   6.298  -9.657  -2.466
  238    HD3  LYS  32           1HD      LYS  32   6.909  -8.014  -2.244
  239    HE2  LYS  32           2HE      LYS  32   8.108  -8.803  -0.209
  240    HE3  LYS  32           1HE      LYS  32   7.592 -10.444  -0.598
  241    HZ1  LYS  32           3HZ      LYS  32   9.295  -8.699  -2.294
  242    HZ2  LYS  32           1HZ      LYS  32   8.774 -10.264  -2.710
  243    HZ3  LYS  32           2HZ      LYS  32   9.820 -10.035  -1.393
  244    HA   PRO  33           HA       PRO  33  -0.283  -9.900   0.680
  245    HB2  PRO  33           2HB      PRO  33  -1.023  -9.333  -2.175
  246    HB3  PRO  33           1HB      PRO  33  -2.092  -9.562  -0.775
  247    HG2  PRO  33           2HG      PRO  33  -1.619  -7.132  -1.601
  248    HG3  PRO  33           1HG      PRO  33  -1.484  -7.466   0.140
  249    HD2  PRO  33           2HD      PRO  33   0.679  -7.123  -1.899
  250    HD3  PRO  33           1HD      PRO  33   0.619  -6.567  -0.213
  251    H    GLN  34           H        GLN  34  -1.014 -12.033  -0.072
  252    HA   GLN  34           HA       GLN  34   1.071 -13.577  -1.239
  253    HB2  GLN  34           2HB      GLN  34  -1.810 -14.291  -0.664
  254    HB3  GLN  34           1HB      GLN  34  -0.579 -15.444  -1.158
  255    HG2  GLN  34           2HG      GLN  34  -0.579 -13.809   1.375
  256    HG3  GLN  34           1HG      GLN  34  -0.927 -15.531   1.235
  257   HE21  GLN  34          1HE2      GLN  34   1.151 -14.107   2.753
  258   HE22  GLN  34          2HE2      GLN  34   2.650 -14.792   2.236
  259    H    GLU  35           H        GLU  35  -1.722 -11.961  -2.482
  260    HA   GLU  35           HA       GLU  35  -1.496 -13.240  -5.076
  261    HB2  GLU  35           2HB      GLU  35  -3.324 -11.078  -4.036
  262    HB3  GLU  35           1HB      GLU  35  -3.347 -11.649  -5.698
  263    HG2  GLU  35           2HG      GLU  35  -3.831 -13.361  -3.269
  264    HG3  GLU  35           1HG      GLU  35  -5.083 -12.698  -4.318
  265    H    LEU  36           H        LEU  36   0.217 -10.981  -3.528
  266    HA   LEU  36           HA       LEU  36   0.657  -9.156  -5.717
  267    HG   LEU  36           HG       LEU  36   2.431  -7.023  -3.346
  268    HB2  LEU  36           2HB      LEU  36   0.835  -8.688  -3.189
  269    HB3  LEU  36           1HB      LEU  36   2.406  -9.423  -3.321
  270   HD11  LEU  36          1HD1      LEU  36   4.224  -8.205  -4.343
  271   HD12  LEU  36          2HD1      LEU  36   3.903  -6.749  -5.286
  272   HD13  LEU  36          3HD1      LEU  36   3.344  -8.321  -5.860
  273   HD21  LEU  36          3HD2      LEU  36   1.731  -5.738  -5.293
  274   HD22  LEU  36          1HD2      LEU  36   0.369  -6.463  -4.432
  275   HD23  LEU  36          2HD2      LEU  36   0.943  -7.176  -5.948
  276    H    LYS  37           H        LYS  37   1.570 -10.107  -7.446
  277    HA   LYS  37           HA       LYS  37   3.719 -12.055  -7.031
  278    HB2  LYS  37           2HB      LYS  37   2.126 -11.450  -9.534
  279    HB3  LYS  37           1HB      LYS  37   3.327 -12.723  -9.363
  280    HG2  LYS  37           2HG      LYS  37   0.763 -12.560  -7.788
  281    HG3  LYS  37           1HG      LYS  37   1.003 -13.540  -9.235
  282    HD2  LYS  37           2HD      LYS  37   2.852 -14.730  -8.053
  283    HD3  LYS  37           1HD      LYS  37   2.453 -13.815  -6.597
  284    HE2  LYS  37           2HE      LYS  37   0.554 -15.636  -8.071
  285    HE3  LYS  37           1HE      LYS  37   1.461 -16.081  -6.630
  286    HZ1  LYS  37           3HZ      LYS  37  -0.854 -15.384  -6.195
  287    HZ2  LYS  37           1HZ      LYS  37  -0.469 -13.837  -6.752
  288    HZ3  LYS  37           2HZ      LYS  37   0.289 -14.450  -5.366
  289    H1   GLY 101           1HT      GLY 101   3.746  21.054  -6.582
  290    H2   GLY 101           2HT      GLY 101   3.061  19.867  -7.580
  291    H3   GLY 101           3HT      GLY 101   4.554  19.591  -6.829
  292    HA2  GLY 101           1HA      GLY 101   3.479  19.692  -4.649
  293    HA3  GLY 101           2HA      GLY 101   1.939  19.895  -5.467
  294    HA   PRO 102           HA       PRO 102   3.336  15.287  -5.714
  295    HB2  PRO 102           2HB      PRO 102   4.572  14.428  -3.488
  296    HB3  PRO 102           1HB      PRO 102   5.470  15.139  -4.836
  297    HG2  PRO 102           2HG      PRO 102   4.629  16.386  -2.252
  298    HG3  PRO 102           1HG      PRO 102   6.170  16.533  -3.110
  299    HD2  PRO 102           2HD      PRO 102   4.175  18.412  -3.205
  300    HD3  PRO 102           1HD      PRO 102   5.383  18.179  -4.485
  301    HA   PRO 103           HA       PRO 103  -0.289  14.457  -3.261
  302    HB2  PRO 103           2HB      PRO 103  -0.497  11.777  -3.636
  303    HB3  PRO 103           1HB      PRO 103  -0.899  12.926  -4.899
  304    HG2  PRO 103           2HG      PRO 103   1.567  11.298  -4.543
  305    HG3  PRO 103           1HG      PRO 103   0.696  11.704  -6.034
  306    HD2  PRO 103           2HD      PRO 103   2.987  12.962  -5.225
  307    HD3  PRO 103           1HD      PRO 103   1.751  13.728  -6.241
  308    H    LEU 104           H        LEU 104  -0.743  13.848  -1.149
  309    HA   LEU 104           HA       LEU 104   1.365  12.614   0.388
  310    HG   LEU 104           HG       LEU 104  -0.265  14.990   2.724
  311    HB2  LEU 104           2HB      LEU 104  -1.431  13.485   1.100
  312    HB3  LEU 104           1HB      LEU 104  -0.375  12.679   2.243
  313   HD11  LEU 104          1HD1      LEU 104   2.076  15.539   2.333
  314   HD12  LEU 104          2HD1      LEU 104   2.174  14.267   1.115
  315   HD13  LEU 104          3HD1      LEU 104   1.875  13.850   2.802
  316   HD21  LEU 104          3HD2      LEU 104  -1.183  15.872   0.654
  317   HD22  LEU 104          1HD2      LEU 104   0.316  15.484  -0.192
  318   HD23  LEU 104          2HD2      LEU 104   0.311  16.704   1.081
  319    H    ILE 105           H        ILE 105   1.378  10.562   1.191
  320    HA   ILE 105           HA       ILE 105  -0.410   8.639   0.005
  321    HB   ILE 105           HB       ILE 105   1.668   7.992   2.135
  322   HG12  ILE 105          2HG1      ILE 105   3.073   7.373   0.039
  323   HG13  ILE 105          1HG1      ILE 105   1.985   8.431  -0.834
  324   HG21  ILE 105          1HG2      ILE 105   0.439   6.381  -0.073
  325   HG22  ILE 105          2HG2      ILE 105   0.074   6.258   1.649
  326   HG23  ILE 105          3HG2      ILE 105   1.674   5.822   1.055
  327   HD11  ILE 105          3HD1      ILE 105   2.671  10.248   0.772
  328   HD12  ILE 105          1HD1      ILE 105   3.873   9.695  -0.391
  329   HD13  ILE 105          2HD1      ILE 105   3.962   9.159   1.286
  330    HA   PRO 106           HA       PRO 106  -3.082   8.418   3.673
  331    HB2  PRO 106           2HB      PRO 106  -3.948   5.834   3.318
  332    HB3  PRO 106           1HB      PRO 106  -4.649   7.177   2.434
  333    HG2  PRO 106           2HG      PRO 106  -2.622   5.196   1.542
  334    HG3  PRO 106           1HG      PRO 106  -3.983   5.892   0.646
  335    HD2  PRO 106           2HD      PRO 106  -1.435   6.721   0.296
  336    HD3  PRO 106           1HD      PRO 106  -2.826   7.814   0.135
  337    HA   PRO 107           HA       PRO 107  -0.080   6.070   5.997
  338    HB2  PRO 107           2HB      PRO 107  -1.721   6.001   8.365
  339    HB3  PRO 107           1HB      PRO 107  -0.305   7.004   8.051
  340    HG2  PRO 107           2HG      PRO 107  -2.879   7.963   8.289
  341    HG3  PRO 107           1HG      PRO 107  -1.569   8.798   7.441
  342    HD2  PRO 107           2HD      PRO 107  -3.828   7.192   6.328
  343    HD3  PRO 107           1HD      PRO 107  -3.035   8.641   5.669
  344    HA   PRO 108           HA       PRO 108  -1.968   2.006   6.055
  345    HB2  PRO 108           2HB      PRO 108   0.549   0.847   6.733
  346    HB3  PRO 108           1HB      PRO 108  -0.256   0.858   5.158
  347    HG2  PRO 108           2HG      PRO 108   2.081   2.201   5.741
  348    HG3  PRO 108           1HG      PRO 108   0.975   2.590   4.405
  349    HD2  PRO 108           2HD      PRO 108   1.274   3.908   7.055
  350    HD3  PRO 108           1HD      PRO 108   0.963   4.585   5.432
  351    HA   PRO 109           HA       PRO 109  -2.397   1.260  10.446
  352    HB2  PRO 109           2HB      PRO 109  -3.431  -1.249  10.268
  353    HB3  PRO 109           1HB      PRO 109  -4.379   0.193   9.878
  354    HG2  PRO 109           2HG      PRO 109  -2.928  -1.669   8.010
  355    HG3  PRO 109           1HG      PRO 109  -4.566  -1.001   7.871
  356    HD2  PRO 109           2HD      PRO 109  -2.462  -0.006   6.546
  357    HD3  PRO 109           1HD      PRO 109  -3.784   1.025   7.129