Content for NMR-STAR saveframe, "spectral_peak_list_1"

    save_spectral_peak_list_1
   _Spectral_peak_list.Sf_category                      spectral_peak_list
   _Spectral_peak_list.Sf_framecode                     spectral_peak_list_1
   _Spectral_peak_list.Entry_ID                         51025
   _Spectral_peak_list.ID                               1
   _Spectral_peak_list.Name                             .
   _Spectral_peak_list.Sample_ID                        1
   _Spectral_peak_list.Sample_label                     $sample_1
   _Spectral_peak_list.Sample_condition_list_ID         1
   _Spectral_peak_list.Sample_condition_list_label      $sample_conditions_1
   _Spectral_peak_list.Chem_shift_reference_ID          1
   _Spectral_peak_list.Chem_shift_reference_label       $chem_shift_reference_1
   _Spectral_peak_list.Experiment_ID                    2
   _Spectral_peak_list.Experiment_name                  '3D HNCA'
   _Spectral_peak_list.Experiment_class                 .
   _Spectral_peak_list.Experiment_type                  .
   _Spectral_peak_list.Number_of_spectral_dimensions    3
   _Spectral_peak_list.Chemical_shift_list              .
   _Spectral_peak_list.Assigned_chem_shift_list_ID      .
   _Spectral_peak_list.Assigned_chem_shift_list_label   .
   _Spectral_peak_list.Details                          .
   _Spectral_peak_list.Text_data_format                 text
   _Spectral_peak_list.Text_data
;
_nef_spectrum_dimension.dimension_id
         _nef_spectrum_dimension.axis_unit
         _nef_spectrum_dimension.axis_code
         _nef_spectrum_dimension.spectrometer_frequency
         _nef_spectrum_dimension.spectral_width
         _nef_spectrum_dimension.value_first_point
         _nef_spectrum_dimension.folding
         _nef_spectrum_dimension.absolute_peak_positions
         _nef_spectrum_dimension.is_acquisition

         1  ppm  1H   899.7540283  7.262375446  12.75518772  circular  true  true
         2  ppm  13C  226.2550049  28.69994351  70.90597151  circular  true  false
         3  ppm  15N  91.18099976  33.23393017  133.2719651  circular  true  false

         _nef_peak.index
         _nef_peak.peak_id
         _nef_peak.volume
         _nef_peak.volume_uncertainty
         _nef_peak.height
         _nef_peak.height_uncertainty
         _nef_peak.position_1
         _nef_peak.position_uncertainty_1
         _nef_peak.position_2
         _nef_peak.position_uncertainty_2
         _nef_peak.position_3
         _nef_peak.position_uncertainty_3
         _nef_peak.chain_code_1
         _nef_peak.sequence_code_1
         _nef_peak.residue_name_1
         _nef_peak.atom_name_1
         _nef_peak.chain_code_2
         _nef_peak.sequence_code_2
         _nef_peak.residue_name_2
         _nef_peak.atom_name_2
         _nef_peak.chain_code_3
         _nef_peak.sequence_code_3
         _nef_peak.residue_name_3
         _nef_peak.atom_name_3

         153  169  11446935.09  .  526724.8125  .  8.12560042   .  54.6517211   .  120.6209449  .  A  1        MET  H%      A  1        MET  CA       A  1        MET  N
         180  196  113638043.2  .  5579453.5    .  8.236896849  .  51.7824999   .  122.3042712  .  A  2        ASN  H          .        .    .        A  2        ASN  N
         179  195  56684037.25  .  2869452.25   .  8.236823533  .  54.68654394  .  122.3039517  .  A  2        ASN  H          .        .    .        A  2        ASN  N
         322  359  25536962.94  .  1018210.5    .  8.135574187  .  60.95050718  .  116.3552755  .  A  4        TYR  H       A  4        TYR  CA       A  4        TYR  N
         253  278  27789142.38  .  1418673.125  .  7.791584471  .  64.2653186   .  120.4152298  .  A  5        ILE  H       A  5        ILE  CA       A  5        ILE  N
         145  161  22377880.69  .  1177166.375  .  6.953433823  .  60.78120326  .  119.0034279  .  A  6        TYR  H       A  6        TYR  CA       A  6        TYR  N
         247  269  24736367.5   .  1244264.125  .  7.675656541  .  57.2537734   .  119.7011757  .  A  7        LEU  H       A  7        LEU  CA       A  7        LEU  N
         286  315  36121306.44  .  1875197.25   .  8.572215794  .  47.13330379  .  105.8099732  .  A  8        GLY  H       A  8        GLY  CA       A  8        GLY  N
         285  314  12143398.95  .  638237.8125  .  8.565107832  .  57.04395427  .  105.8147051  .  A  8        GLY  H          .        .    .        A  8        GLY  N
         256  281  39418484.25  .  1766283.5    .  8.60494582   .  47.48358949  .  108.9556297  .  A  9        GLY  H       A  9        GLY  CA       A  9        GLY  N
         29   30   17517452.5   .  859494.6875  .  8.699898445  .  55.42619875  .  125.8888911  .  A  10       ALA  H       A  10       ALA  CA       A  10       ALA  N
         71   76   42532915.88  .  2034764.75   .  8.900429559  .  64.54470141  .  122.8551017  .  A  16       ILE  H       A  16       ILE  CA       A  16       ILE  N
         72   77   12817316.22  .  589002       .  8.904286348  .  65.41880512  .  122.8222526  .  A  16       ILE  H          .        .    .        A  16       ILE  N
         107  116  26865365.38  .  1352905.5    .  8.846942207  .  47.49281737  .  109.3718094  .  A  17       GLY  H       A  17       GLY  CA       A  17       GLY  N
         108  118  13540966.34  .  652789.1875  .  8.857665868  .  64.59257489  .  109.3854006  .  A  17       GLY  H          .        .    .        A  17       GLY  N
         230  250  12203053.91  .  606946.125   .  8.536337004  .  47.02908135  .  118.4158927  .  A  18       THR  H          .        .    .        A  18       THR  N
         231  251  24098045     .  1299434.75   .  8.535290933  .  66.06329104  .  118.4067159  .  A  18       THR  H       A  18       THR  CA       A  18       THR  N
         320  357  16259305     .  839340.9375  .  7.639565137  .  67.10425405  .  118.0578102  .  A  19       THR  H       A  19       THR  CA       A  19       THR  N
         114  124  11814093.69  .  531465.9375  .  8.669616798  .  67.07206443  .  122.1650322  .  A  20       LEU  H          .        .    .        A  20       LEU  N
         113  123  56225510.25  .  2850847.5    .  8.672243649  .  57.70429876  .  122.1866763  .  A  20       LEU  H       A  20       LEU  CA       A  20       LEU  N
         312  348  50075916.62  .  2215757.75   .  8.266486267  .  59.25109525  .  121.7547364  .  A  21       MET  H       A  21       MET  CA       A  21       MET  N
         270  298  81790342.75  .  4021737.5    .  7.620876253  .  59.56605571  .  125.2018097  .  A  22       LYS  H       A  22       LYS  CA       A  22       LYS  N
         57   59   33616812.69  .  1594265.375  .  7.488842638  .  59.59952324  .  119.3536479  .  A  23       PHE  H          .        .    .        A  23       PHE  N
         56   58   71473957.88  .  3577993.75   .  7.49318987   .  60.0319596   .  119.3733856  .  A  23       PHE  H       A  23       PHE  CA       A  23       PHE  N
         110  120  28017846.25  .  1344104.375  .  8.020566975  .  60.07553943  .  113.8471977  .  A  24       SER  H          .        .    .        A  24       SER  N
         109  119  62048369.5   .  2998137      .  8.015679209  .  60.52701593  .  113.8692506  .  A  24       SER  H       A  24       SER  CA       A  24       SER  N
         78   83   34132694.06  .  1702237.5    .  7.728548209  .  60.50572225  .  121.4516638  .  A  25       GLU  H          .        .    .        A  25       GLU  N
         77   82   116018733.8  .  5880545      .  7.728469168  .  55.95425024  .  121.4700336  .  A  25       GLU  H       A  25       GLU  CA       A  25       GLU  N
         172  188  18051005.81  .  892381.6875  .  9.388720246  .  55.87951751  .  112.328337   .  A  26       GLY  H          .        .    .        A  26       GLY  N
         171  187  64123526.38  .  3277314.25   .  9.393569889  .  45.96545595  .  112.3685277  .  A  26       GLY  H       A  26       GLY  CA       A  26       GLY  N
         52   54   29854240.94  .  1497248.875  .  7.925979565  .  59.69786433  .  113.4711196  .  A  27       PHE  H       A  27       PHE  CA       A  27       PHE  N
         99   105  33508901.88  .  1601215.875  .  7.576050035  .  62.01448672  .  102.859965   .  A  28       THR  H       A  28       THR  CA       A  28       THR  N
         307  343  12933928.28  .  617080.9375  .  7.449571805  .  62.03654559  .  120.1955989  .  A  29       ARG  H          .        .    .        A  29       ARG  N
         308  344  71421934.75  .  3345286.75   .  7.437280875  .  53.9898452   .  120.149394   .  A  29       ARG  H       A  29       ARG  CA       A  29       ARG  N
         102  109  24314173.06  .  1180313.25   .  9.103994995  .  59.9125276   .  131.4777918  .  A  30       LEU  H       A  30       LEU  CA       A  30       LEU  N
         101  108  16989023.66  .  882372.4375  .  9.099891183  .  54.06942744  .  131.5307549  .  A  30       LEU  H          .        .    .        A  30       LEU  N
         268  296  58755995.25  .  3135194.5    .  9.330447016  .  59.91663741  .  119.461898   .  A  31       TRP  H          .        .    .        A  31       TRP  N
         269  297  162860430.2  .  8484968      .  9.330580131  .  61.63248385  .  119.4676072  .  A  31       TRP  H       A  31       TRP  CA       A  31       TRP  N
         173  189  57218065     .  2809252.25   .  7.470681064  .  63.9479039   .  116.2243172  .  A  33       SER  H       A  33       SER  CA       A  33       SER  N
         174  190  14028029.39  .  777136.1875  .  7.471664978  .  65.24418078  .  116.1781977  .  A  33       SER  H          .        .    .        A  33       SER  N
         138  152  30395058.69  .  1390254.625  .  8.403764076  .  63.92282364  .  122.2374404  .  A  34       VAL  H          .        .    .        A  34       VAL  N
         139  153  122268309.8  .  5870317.5    .  8.40373375   .  66.58703903  .  122.2815693  .  A  34       VAL  H       A  34       VAL  CA       A  34       VAL  N
         48   50   60457102.44  .  2695159.5    .  8.798447265  .  47.72376462  .  105.2330157  .  A  35       GLY  H       A  35       GLY  CA       A  35       GLY  N
         45   47   18970017.22  .  852335.25    .  8.797027453  .  66.54414253  .  105.1475563  .  A  35       GLY  H          .        .    .        A  35       GLY  N
         86   92   21555083.03  .  1039337.75   .  8.273871673  .  47.73586181  .  121.2828439  .  A  36       THR  H          .        .    .        A  36       THR  N
         87   93   20780656.31  .  1069669.625  .  8.282321123  .  68.46078974  .  121.1753123  .  A  36       THR  H       A  36       THR  CA       A  36       THR  N
         221  240  70690274.25  .  3510196.5    .  7.545394575  .  65.18898898  .  119.5081154  .  A  37       ILE  H       A  37       ILE  CA       A  37       ILE  N
         7    7    32008347.12  .  1505391      .  8.296853596  .  65.52899639  .  118.9160529  .  A  38       ILE  H       A  38       ILE  CA       A  38       ILE  N
         8    8    18970662     .  735957.8125  .  8.297334621  .  65.18637572  .  118.9238171  .  A  38       ILE  H          .        .    .        A  38       ILE  N
         303  336  54349203.38  .  2600727.75   .  8.210084552  .  65.41318369  .  116.8045207  .  A  39       CYS  H       A  39       CYS  CA       A  39       CYS  N
         165  181  45425530.62  .  2195410      .  8.521810059  .  60.11109263  .  119.3746463  .  A  40       TYR  H       A  40       TYR  CA       A  40       TYR  N
         166  182  17218421.47  .  879135       .  8.521630027  .  65.38602709  .  119.3823164  .  A  40       TYR  H          .        .    .        A  40       TYR  N
         265  290  11636751.67  .  660868.0625  .  8.704047833  .  62.15280814  .  113.2987061  .  A  43       SER  H       A  43       SER  CA       A  43       SER  N
         18   19   31022088.81  .  1481489.875  .  8.109964174  .  60.7377076   .  117.4195162  .  A  44       PHE  H       A  44       PHE  CA       A  44       PHE  N
         316  353  14440524.19  .  690277.5625  .  8.383879719  .  61.94397837  .  120.0444911  .  A  45       TRP  H       A  45       TRP  CA       A  45       TRP  N
         85   91   27283496.44  .  1376975      .  8.925621253  .  57.87194129  .  118.8660308  .  A  46       LEU  H       A  46       LEU  CA       A  46       LEU  N
         155  171  15788619.12  .  815774.875   .  8.122344265  .  57.00252726  .  121.6541868  .  A  48       ALA  H          .        .    .        A  48       ALA  N
         154  170  79940573.5   .  3922340      .  8.124613229  .  54.64039098  .  121.6676842  .  A  48       ALA  H       A  48       ALA  CA       A  48       ALA  N
         37   38   51907296.62  .  2497359.75   .  7.28323817   .  56.34699707  .  114.3587354  .  A  49       GLN  H       A  49       GLN  CA       A  49       GLN  N
         36   37   17755878.31  .  922013.5625  .  7.27830528   .  54.62681587  .  114.3357523  .  A  49       GLN  H          .        .    .        A  49       GLN  N
         290  319  13468931     .  700873.25    .  7.662930513  .  65.63422849  .  112.183398   .  A  50       THR  H       A  50       THR  CA       A  50       THR  N
         261  286  10502568.72  .  573937.125   .  7.297033503  .  65.53319615  .  120.1056019  .  A  51       LEU  H          .        .    .        A  51       LEU  N
         262  287  23483752.56  .  1185395.75   .  7.28763067   .  56.00855842  .  120.2551359  .  A  51       LEU  H       A  51       LEU  CA       A  51       LEU  N
         106  115  38746092     .  1857249.625  .  7.219070864  .  52.88564169  .  119.159914   .  A  52       ALA  H       A  52       ALA  CA       A  52       ALA  N
         105  114  11567886.52  .  636444.75    .  7.216717716  .  55.93380559  .  119.1461344  .  A  52       ALA  H          .        .    .        A  52       ALA  N
         277  305  14390550.22  .  725487.4375  .  7.721233706  .  58.22778301  .  113.9079825  .  A  53       TYR  H       A  53       TYR  CA       A  53       TYR  N
         50   52   98131015.25  .  4631276.5    .  7.832257808  .  57.41355266  .  119.7743255  .  A  54       ILE  H       A  54       ILE  CA       A  54       ILE  N
         239  260  59940042.25  .  2946110.75   .  8.244599483  .  62.6696898   .  118.5669627  .  A  56       THR  H          .        .    .        A  56       THR  N
         238  259  76724438     .  3895494.75   .  8.246853158  .  65.87944232  .  118.626867   .  A  56       THR  H       A  56       THR  CA       A  56       THR  N
         12   12   64342856.5   .  2728486.25   .  8.792088191  .  47.18870388  .  107.3738646  .  A  57       GLY  H       A  57       GLY  CA       A  57       GLY  N
         11   11   14102648.31  .  740395.3125  .  8.787792557  .  65.85929212  .  107.4727293  .  A  57       GLY  H          .        .    .        A  57       GLY  N
         244  266  25329348.88  .  1247305.625  .  6.847520107  .  47.15728114  .  119.5023723  .  A  58       ILE  H          .        .    .        A  58       ILE  N
         243  264  53519250.25  .  2682876.25   .  6.84708082   .  64.19075145  .  119.5189453  .  A  58       ILE  H       A  58       ILE  CA       A  58       ILE  N
         187  203  57997193.5   .  2830796.5    .  7.896769395  .  55.2818436   .  121.1171655  .  A  59       ALA  H       A  59       ALA  CA       A  59       ALA  N
         188  204  18365920.62  .  979522.3125  .  7.902422531  .  64.17176848  .  121.0779687  .  A  59       ALA  H          .        .    .        A  59       ALA  N
         240  261  12427056.09  .  614987.625   .  8.635699228  .  60.17133441  .  115.0875844  .  A  60       TYR  H       A  60       TYR  CA       A  60       TYR  N
         201  218  17332187.56  .  890204.25    .  8.761483202  .  66.28199704  .  120.920017   .  A  68       ILE  H       A  68       ILE  CA       A  68       ILE  N
         103  110  21081699.56  .  951595.8125  .  7.410587082  .  66.2637335   .  119.8005997  .  A  69       VAL  H          .        .    .        A  69       VAL  N
         104  111  45676434     .  2193090.5    .  7.40146317   .  66.84836931  .  119.7720254  .  A  69       VAL  H       A  69       VAL  CA       A  69       VAL  N
         234  255  17452268.41  .  862859.875   .  9.196226517  .  65.59842053  .  120.0582305  .  A  71       ILE  H       A  71       ILE  CA       A  71       ILE  N
         227  247  37218699.5   .  1853152.125  .  7.816322207  .  63.10404836  .  118.7037691  .  A  72       SER  H       A  72       SER  CA       A  72       SER  N
         4    4    68739213.75  .  3434233.25   .  8.496950426  .  58.19312466  .  124.387506   .  A  73       LEU  H       A  73       LEU  CA       A  73       LEU  N
         5    5    19036532.78  .  1007717.438  .  8.494088528  .  63.09780136  .  124.4167229  .  A  73       LEU  H          .        .    .        A  73       LEU  N
         130  143  135034245.2  .  6573153.5    .  8.723426269  .  58.06217046  .  119.2372357  .  A  74       LEU  H       A  74       LEU  CA       A  74       LEU  N
         161  177  31784592.06  .  1515622.875  .  8.250254342  .  62.79801192  .  115.5057766  .  A  75       SER  H       A  75       SER  CA       A  75       SER  N
         160  176  21420770.81  .  1082884.75   .  8.250305877  .  58.03024712  .  115.4806651  .  A  75       SER  H          .        .    .        A  75       SER  N
         295  325  55105299.75  .  2713828.25   .  7.869132032  .  59.26394092  .  125.7515192  .  A  76       TRP  H       A  76       TRP  CA       A  76       TRP  N
         296  326  12387176.81  .  570453       .  7.876937448  .  62.70645134  .  125.6522931  .  A  76       TRP  H          .        .    .        A  76       TRP  N
         150  166  26562063.38  .  1237642.5    .  8.201411387  .  59.22871158  .  104.4006556  .  A  77       GLY  H          .        .    .        A  77       GLY  N
         149  165  87022595.5   .  4489683.5    .  8.207579574  .  46.97251889  .  104.3758793  .  A  77       GLY  H       A  77       GLY  CA       A  77       GLY  N
         190  206  83823104.12  .  4372880.5    .  8.495542455  .  58.78516534  .  114.5477519  .  A  78       PHE  H       A  78       PHE  CA       A  78       PHE  N
         191  207  40751910.19  .  2091928.375  .  8.493059418  .  46.95910681  .  114.5141344  .  A  78       PHE  H          .        .    .        A  78       PHE  N
         32   33   18720802.25  .  991689.1875  .  6.864040433  .  58.81310748  .  112.4651615  .  A  79       PHE  H          .        .    .        A  79       PHE  N
         33   34   61178674.75  .  3027160      .  6.866568548  .  55.19448305  .  112.5013798  .  A  79       PHE  H       A  79       PHE  CA       A  79       PHE  N
         59   61   17093787.88  .  854709.0625  .  7.516268584  .  55.17179747  .  109.3630967  .  A  80       GLY  H          .        .    .        A  80       GLY  N
         58   60   83139065     .  4290871      .  7.517351254  .  46.30211554  .  109.3660021  .  A  80       GLY  H       A  80       GLY  CA       A  80       GLY  N
         260  285  56133789.12  .  2663166      .  7.608063033  .  55.39113487  .  119.6004027  .  A  81       GLN  H       A  81       GLN  CA       A  81       GLN  N
         259  284  22256327.72  .  1184789      .  7.608783904  .  46.30184112  .  119.5879792  .  A  81       GLN  H          .        .    .        A  81       GLN  N
         278  306  202993791    .  10078380     .  7.847775904  .  55.31463532  .  126.3752313  .  A  82       ARG  H       A  82       ARG  CA       A  82       ARG  N
         147  163  49598429.75  .  2453971      .  6.734589402  .  52.88062517  .  123.1426265  .  A  83       LEU  H       A  83       LEU  CA       A  83       LEU  N
         148  164  18776298.97  .  985601.125   .  6.729584336  .  55.27814192  .  123.1302069  .  A  83       LEU  H          .        .    .        A  83       LEU  N
         54   56   185888298.5  .  9492516      .  7.489513582  .  50.94035859  .  119.2498962  .  A  84       ASP  H       A  84       ASP  CA       A  84       ASP  N
         55   57   57392780.38  .  3042690.75   .  7.488923525  .  52.86998913  .  119.2313079  .  A  84       ASP  H          .        .    .        A  84       ASP  N
         128  141  227151930.5  .  11726141     .  8.754700406  .  59.27318858  .  118.6757958  .  A  85       LEU  H       A  85       LEU  CA       A  85       LEU  N
         21   22   48649280.94  .  2229488.25   .  7.543534161  .  66.12165911  .  117.5480451  .  A  87       ALA  H          .        .    .        A  87       ALA  N
         22   23   146375275.5  .  7171689.5    .  7.546013796  .  55.35198543  .  117.6458523  .  A  87       ALA  H       A  87       ALA  CA       A  87       ALA  N
         70   75   28635703.88  .  1389986.75   .  8.216635546  .  55.34195405  .  118.3425568  .  A  88       ILE  H          .        .    .        A  88       ILE  N
         69   74   78352795.88  .  3926317.5    .  8.223609228  .  65.14442379  .  118.3613584  .  A  88       ILE  H       A  88       ILE  CA       A  88       ILE  N
         131  144  73698830.75  .  3691684.5    .  8.78888257   .  64.25654106  .  119.4352593  .  A  89       ILE  H       A  89       ILE  CA       A  89       ILE  N
         13   13   109762548.2  .  5571034      .  8.81917066   .  47.49176965  .  107.636508   .  A  90       GLY  H       A  90       GLY  CA       A  90       GLY  N
         14   14   28516005.12  .  1338743.625  .  8.823702557  .  64.26960216  .  107.636508   .  A  90       GLY  H          .        .    .        A  90       GLY  N
         198  215  24918431.97  .  1210774.125  .  8.66091645   .  47.5118677   .  120.9106887  .  A  91       MET  H          .        .    .        A  91       MET  N
         197  214  68856637.25  .  3482549.75   .  8.663580016  .  59.74079373  .  120.8886224  .  A  91       MET  H       A  91       MET  CA       A  91       MET  N
         42   44   80223259.38  .  4087186.75   .  8.584128136  .  59.21256754  .  120.2934407  .  A  92       MET  H       A  92       MET  CA       A  92       MET  N
         281  310  19876462.91  .  1058779.125  .  8.240215106  .  58.34417539  .  120.5998156  .  A  93       LEU  H       A  93       LEU  CA       A  93       LEU  N
         229  249  31830306.69  .  1619521.25   .  8.804813342  .  54.96968385  .  119.9250361  .  A  96       ALA  H       A  96       ALA  CA       A  96       ALA  N
         9    9    38860448.69  .  2042038.125  .  8.53912881   .  48.38961628  .  105.6567946  .  A  97       GLY  H       A  97       GLY  CA       A  97       GLY  N
         10   10   10994675.2   .  527223.875   .  8.534989285  .  54.85757771  .  105.6314363  .  A  97       GLY  H          .        .    .        A  97       GLY  N
         82   88   19956063.94  .  998137.9375  .  8.359815179  .  48.35146281  .  120.9915553  .  A  98       VAL  H          .        .    .        A  98       VAL  N
         81   87   38610743.56  .  1932596.875  .  8.359413629  .  66.78249471  .  121.0498706  .  A  98       VAL  H       A  98       VAL  CA       A  98       VAL  N
         68   73   61546614.88  .  3077994      .  8.00537893   .  65.71584109  .  118.1865978  .  A  101      ILE  H       A  101      ILE  CA       A  101      ILE  N
         6    6    20179339.91  .  1104952.25   .  7.560869491  .  56.41369458  .  114.6197515  .  A  102      ASN  H       A  102      ASN  CA       A  102      ASN  N
         311  347  21902847.62  .  1100227.875  .  8.339955746  .  55.78094383  .  115.0952789  .  A  103      LEU  H       A  103      LEU  CA       A  103      LEU  N
         185  201  12923688.97  .  650395.9375  .  7.678565589  .  55.88233649  .  114.7560571  .  A  104      LEU  H          .        .    .        A  104      LEU  N
         186  202  47356764.62  .  2302024      .  7.680765813  .  54.3559278   .  114.8624061  .  A  104      LEU  H       A  104      LEU  CA       A  104      LEU  N
         177  193  105121445.8  .  5265678      .  7.136415431  .  57.52997451  .  112.4641015  .  A  105      SER  H       A  105      SER  CA       A  105      SER  N
         178  194  22699682.31  .  1128124.5    .  7.134112753  .  54.31642404  .  112.4850432  .  A  105      SER  H          .        .    .        A  105      SER  N
         276  304  24565482.06  .  1197107.125  .  9.449299734  .  57.53223532  .  127.5049907  .  A  106      ARG  H          .        .    .        A  106      ARG  N
         275  303  46739716.62  .  2344901.25   .  9.444073356  .  55.53572937  .  127.5154167  .  A  106      ARG  H       A  106      ARG  CA       A  106      ARG  N
         304  338  93216901.75  .  4537350      .  8.533513471  .  58.42931306  .  117.4803388  .  A  107      SER  H       A  107      SER  CA       A  107      SER  N
         305  339  29137947.06  .  1383394      .  8.534395534  .  55.5444614   .  117.4490131  .  A  107      SER  H          .        .    .        A  107      SER  N
         41   43   292736381.5  .  14466630     .  7.698681976  .  59.18437602  .  117.1075175  .  A  108      THR  H       A  108      THR  CA       A  108      THR  N
         40   41   93152813.5   .  4443669      .  7.698247762  .  58.4400626   .  117.1202959  .  A  108      THR  H          .        .    .        A  108      THR  N
         27   28   291836388    .  15383821     .  7.864561368  .  63.04072724  .  123.995306   .  A  110      HIS  H          .        .    .        A  110      HIS  N
         25   26   641464480    .  33269062     .  7.864778589  .  56.68165411  .  123.9946991  .  A  110      HIS  H          .        .    .        A  110      HIS  N
         151  167  35566529.62  .  1698546      .  8.108134571  .  54.6866528   .  120.6209449  .  B  1        MET  H%      B  1        MET  CA       B  1        MET  N
         158  174  150342743    .  7632119.5    .  8.387989517  .  51.15152595  .  122.7603276  .  B  2        ASN  H          .        .    .        B  2        ASN  N
         159  175  85625671     .  4235301.5    .  8.387751292  .  54.68725055  .  122.7741358  .  B  2        ASN  H          .        .    .        B  2        ASN  N
         297  327  16807685.03  .  874020.1875  .  8.334005934  .  64.18475205  .  116.6011097  .  B  4        TYR  H          .        .    .        B  4        TYR  N
         298  329  51532826     .  2452203.75   .  8.336991739  .  61.65039357  .  116.5580554  .  B  4        TYR  H       B  4        TYR  CA       B  4        TYR  N
         74   79   40434152.25  .  1913824      .  7.786945096  .  64.31056721  .  121.2457769  .  B  5        ILE  H       B  5        ILE  CA       B  5        ILE  N
         73   78   16734824.47  .  820481       .  7.793427583  .  61.63813033  .  121.1228056  .  B  5        ILE  H          .        .    .        B  5        ILE  N
         115  126  45904801.12  .  2188141.25   .  6.840534753  .  61.27373751  .  118.9377194  .  B  6        TYR  H       B  6        TYR  CA       B  6        TYR  N
         225  244  42074216.88  .  1811923.125  .  7.862964043  .  57.43757948  .  120.1699054  .  B  7        LEU  H       B  7        LEU  CA       B  7        LEU  N
         224  243  12899434.06  .  682944.3125  .  7.867979307  .  61.24464089  .  120.1379333  .  B  7        LEU  H          .        .    .        B  7        LEU  N
         232  253  45019232.38  .  2356574.5    .  8.723290158  .  47.13773705  .  106.3382306  .  B  8        GLY  H       B  8        GLY  CA       B  8        GLY  N
         233  254  11778365.12  .  577573.4375  .  8.711069774  .  57.48339423  .  106.3938272  .  B  8        GLY  H          .        .    .        B  8        GLY  N
         266  294  42757293.38  .  2140537.5    .  8.671941737  .  47.57617789  .  109.455143   .  B  9        GLY  H       B  9        GLY  CA       B  9        GLY  N
         267  295  31124192     .  1530620.25   .  8.670142054  .  47.15975035  .  109.4243081  .  B  9        GLY  H          .        .    .        B  9        GLY  N
         31   32   41003516.69  .  1970899.75   .  8.803237303  .  55.35797223  .  125.4203828  .  B  10       ALA  H       B  10       ALA  CA       B  10       ALA  N
         30   31   15921618.12  .  805139.5     .  8.809754661  .  47.55782402  .  125.3255517  .  B  10       ALA  H       B  9        GLY  CA       B  10       ALA  N
         137  151  14949782.41  .  704565.3125  .  8.439557856  .  64.0528945   .  122.2339201  .  B  11       ILE  H       B  11       ILE  CA       B  11       ILE  N
         315  352  17580429.47  .  884951.875   .  8.359128797  .  58.06301962  .  120.2967041  .  B  12       LEU  H       B  12       LEU  CA       B  12       LEU  N
         318  355  17976494.12  .  797885.5     .  8.691075231  .  55.38414457  .  119.2003457  .  B  13       ALA  H       B  13       ALA  CA       B  13       ALA  N
         63   68   15568114.25  .  879970.75    .  7.87768031   .  55.42286511  .  119.5968075  .  B  14       GLU  H          .        .    .        B  14       GLU  N
         62   66   17660188.03  .  819924.125   .  7.880142348  .  59.7129647   .  119.5763112  .  B  14       GLU  H       B  14       GLU  CA       B  14       GLU  N
         300  331  27042017.12  .  1369119.375  .  8.57352689   .  66.29101511  .  121.6870123  .  B  15       VAL  H       B  15       VAL  CA       B  15       VAL  N
         125  138  26296982.25  .  1350830.375  .  8.63288475   .  65.17416231  .  122.3537518  .  B  16       ILE  H       B  16       ILE  CA       B  16       ILE  N
         258  283  11987394.45  .  699503.6875  .  8.597823864  .  65.1413196   .  108.8360446  .  B  17       GLY  H       B  16       ILE  CA       B  17       GLY  N
         257  282  41355054.88  .  1984156.125  .  8.593457192  .  47.81830356  .  108.7675131  .  B  17       GLY  H       B  17       GLY  CA       B  17       GLY  N
         79   84   50038579.25  .  2551562.75   .  8.384717357  .  57.9916366   .  121.1441321  .  B  20       LEU  H       B  20       LEU  CA       B  20       LEU  N
         80   86   15007620.25  .  695032.3125  .  8.392336449  .  67.77302895  .  120.9654809  .  B  20       LEU  H          .        .    .        B  20       LEU  N
         91   97   29876739     .  1353535.375  .  8.291025176  .  57.90806026  .  121.4465853  .  B  21       MET  H          .        .    .        B  21       MET  N
         90   96   70422727.12  .  3445179      .  8.290190736  .  59.20853087  .  121.5306172  .  B  21       MET  H       B  21       MET  CA       B  21       MET  N
         196  213  17916215.41  .  819573.625   .  7.742347376  .  59.16411758  .  123.0529961  .  B  22       LYS  H          .        .    .        B  22       LYS  N
         195  212  14260566.25  .  726280.4375  .  7.757147661  .  59.20485368  .  123.0065966  .  B  22       LYS  H          .        .    .        B  22       LYS  N
         194  211  90895639     .  4570221      .  7.752785058  .  58.6467505   .  123.0018993  .  B  22       LYS  H       B  22       LYS  CA       B  22       LYS  N
         289  318  150228892.5  .  7539474      .  7.614438659  .  58.69613029  .  118.0427772  .  B  23       PHE  H       B  23       PHE  CA       B  23       PHE  N
         64   69   30237626.5   .  1501322.75   .  7.933646634  .  58.65369627  .  115.2231128  .  B  24       SER  H          .        .    .        B  24       SER  N
         65   70   79298729.38  .  3883206.5    .  7.931132779  .  60.08732601  .  115.2995021  .  B  24       SER  H       B  24       SER  CA       B  24       SER  N
         156  172  35755175.5   .  1773873.75   .  8.093559354  .  60.08685643  .  122.264421   .  B  25       GLU  H          .        .    .        B  25       GLU  N
         157  173  123529201.5  .  6082419      .  8.097577666  .  55.85645489  .  122.2536019  .  B  25       GLU  H       B  25       GLU  CA       B  25       GLU  N
         39   40   80431708.62  .  4191273.75   .  9.172806924  .  46.83646372  .  113.1887133  .  B  26       GLY  H       B  26       GLY  CA       B  26       GLY  N
         38   39   21796409.88  .  1052558.5    .  9.173201559  .  55.80565705  .  113.1983767  .  B  26       GLY  H          .        .    .        B  26       GLY  N
         53   55   30346092.38  .  1648748.5    .  7.919687948  .  46.82074287  .  113.6927686  .  B  27       PHE  H          .        .    .        B  27       PHE  N
         51   53   70807436.5   .  3535839      .  7.920676389  .  58.91259193  .  113.7310877  .  B  27       PHE  H       B  27       PHE  CA       B  27       PHE  N
         144  160  18962547.41  .  815822.625   .  7.590502092  .  62.02408899  .  102.6873302  .  B  28       THR  H       B  28       THR  CA       B  28       THR  N
         176  192  16389187.06  .  768389.25    .  7.590827546  .  61.94760225  .  121.027117   .  B  29       ARG  H          .        .    .        B  29       ARG  N
         175  191  87238475.25  .  4404821.5    .  7.592083328  .  54.17737724  .  121.0228101  .  B  29       ARG  H       B  29       ARG  CA       B  29       ARG  N
         111  121  11662669.86  .  577370.75    .  8.961370469  .  54.24135696  .  131.130394   .  B  30       LEU  H          .        .    .        B  30       LEU  N
         112  122  13696958.03  .  668385.5     .  8.960366419  .  59.64953753  .  131.2008904  .  B  30       LEU  H       B  30       LEU  CA       B  30       LEU  N
         97   103  133830893.5  .  6813943.5    .  9.18943775   .  61.66654849  .  118.8691302  .  B  31       TRP  H       B  31       TRP  CA       B  31       TRP  N
         98   104  50853891.88  .  2479110.25   .  9.190535663  .  59.62508186  .  118.8659053  .  B  31       TRP  H          .        .    .        B  31       TRP  N
         264  289  50630978.5   .  2432333      .  7.296205639  .  63.53773644  .  115.6553909  .  B  33       SER  H       B  33       SER  CA       B  33       SER  N
         263  288  20267890     .  955328.5     .  7.29413369   .  65.33923441  .  115.64373    .  B  33       SER  H          .        .    .        B  33       SER  N
         142  158  99530039.75  .  4595165      .  8.402066669  .  66.46790236  .  121.9297514  .  B  34       VAL  H       B  34       VAL  CA       B  34       VAL  N
         43   45   24810027.81  .  1215784.625  .  8.787006217  .  66.4366684   .  105.4494133  .  B  35       GLY  H       B  34       VAL  CA       B  35       GLY  N
         44   46   80197316.38  .  3972254      .  8.788414753  .  47.74150376  .  105.4836573  .  B  35       GLY  H       B  35       GLY  CA       B  35       GLY  N
         88   94   24426088.25  .  1153113.375  .  8.317699846  .  47.7448108   .  121.3330163  .  B  36       THR  H          .        .    .        B  36       THR  N
         89   95   22472583.75  .  1097813.875  .  8.322434126  .  68.59028279  .  121.3458738  .  B  36       THR  H       B  36       THR  CA       B  36       THR  N
         313  349  64558773.75  .  3119931      .  7.496004101  .  65.03412327  .  119.4015163  .  B  37       ILE  H       B  37       ILE  CA       B  37       ILE  N
         236  257  57504988.5   .  2757290      .  8.372937144  .  65.58430066  .  119.5139072  .  B  38       ILE  H       B  38       ILE  CA       B  38       ILE  N
         237  258  30851054.5   .  1471421.75   .  8.367700991  .  64.97412799  .  119.5504988  .  B  38       ILE  H          .        .    .        B  38       ILE  N
         136  150  56181166.38  .  2626310.25   .  8.266951325  .  65.22045189  .  117.0293972  .  B  39       CYS  H       B  39       CYS  CA       B  39       CYS  N
         163  179  10897162.28  .  563506.25    .  8.594503757  .  65.15906599  .  119.1631942  .  B  40       TYR  H          .        .    .        B  40       TYR  N
         164  180  24611025.62  .  1081718.5    .  8.585339366  .  59.60329161  .  119.2386675  .  B  40       TYR  H       B  40       TYR  CA       B  40       TYR  N
         162  178  12718560.66  .  592136       .  8.580748502  .  65.18512375  .  119.2500951  .  B  40       TYR  H          .        .    .        B  40       TYR  N
         100  106  42988219.88  .  2022936      .  8.550243207  .  64.80412032  .  118.2131156  .  B  41       CYS  H       B  41       CYS  CA       B  41       CYS  N
         212  230  70936600     .  3501292.75   .  8.335142245  .  54.91821532  .  120.1565831  .  B  42       ALA  H       B  42       ALA  CA       B  42       ALA  N
         213  231  24666391.22  .  1192172.875  .  8.33672435   .  64.7945147   .  120.1597019  .  B  42       ALA  H          .        .    .        B  42       ALA  N
         95   101  31190464.38  .  1527648.75   .  8.484590112  .  62.81119466  .  112.5768936  .  B  43       SER  H       B  43       SER  CA       B  43       SER  N
         96   102  23432473.88  .  1104644.375  .  8.481699148  .  54.90860718  .  112.6470524  .  B  43       SER  H          .        .    .        B  43       SER  N
         116  128  34704222.81  .  1569343.75   .  8.155155573  .  60.73637899  .  116.442131   .  B  44       PHE  H       B  44       PHE  CA       B  44       PHE  N
         83   89   49575589.62  .  2389779.25   .  8.433204089  .  63.08880909  .  120.986411   .  B  45       TRP  H       B  45       TRP  CA       B  45       TRP  N
         84   90   19161894.75  .  902736.25    .  8.431017244  .  60.76947532  .  120.9750486  .  B  45       TRP  H          .        .    .        B  45       TRP  N
         134  148  17976494.12  .  797885.5     .  8.683894804  .  58.0561283   .  119.1072218  .  B  46       LEU  H       B  46       LEU  CA       B  46       LEU  N
         135  149  13872509.77  .  708903.375   .  8.678361088  .  62.98999805  .  119.1264758  .  B  46       LEU  H          .        .    .        B  46       LEU  N
         241  262  22886844.75  .  1141070.125  .  8.645710975  .  57.08039224  .  121.8179287  .  B  47       LEU  H       B  47       LEU  CA       B  47       LEU  N
         202  219  19572390.97  .  902301.0625  .  8.730659673  .  54.7741396   .  121.3869099  .  B  48       ALA  H       B  48       ALA  CA       B  48       ALA  N
         254  279  21627955.16  .  1048305.438  .  7.320106048  .  54.82110816  .  115.0680788  .  B  49       GLN  H          .        .    .        B  49       GLN  N
         255  280  45748549.75  .  2249960.75   .  7.320414783  .  55.87358685  .  115.0530835  .  B  49       GLN  H       B  49       GLN  CA       B  49       GLN  N
         143  159  42270990.12  .  2138810.5    .  6.876570009  .  55.51535142  .  118.0971181  .  B  51       LEU  H       B  51       LEU  CA       B  51       LEU  N
         208  226  67717255.75  .  3384634      .  7.048214723  .  52.75891106  .  120.325985   .  B  52       ALA  H       B  52       ALA  CA       B  52       ALA  N
         209  227  15755999.72  .  814807.9375  .  7.054706481  .  55.52430408  .  120.4082313  .  B  52       ALA  H          .        .    .        B  52       ALA  N
         204  221  12183017.19  .  613411.125   .  7.550069204  .  52.77932841  .  113.4415998  .  B  53       TYR  H          .        .    .        B  53       TYR  N
         203  220  36319605     .  1961209.5    .  7.545087423  .  57.87733437  .  113.3070827  .  B  53       TYR  H       B  53       TYR  CA       B  53       TYR  N
         49   51   104177635.5  .  4803898      .  7.809967979  .  57.37109584  .  119.4724684  .  B  54       ILE  H       B  54       ILE  CA       B  54       ILE  N
         301  333  21385491.28  .  1023975.188  .  9.087295757  .  63.08076954  .  124.0464552  .  B  56       THR  H          .        .    .        B  56       THR  N
         302  334  23935088.5   .  1188745.625  .  9.100746775  .  66.77319429  .  124.0100775  .  B  56       THR  H       B  56       THR  CA       B  56       THR  N
         24   25   15808477.19  .  911866.5     .  10.00147279  .  66.76261772  .  107.0998221  .  B  57       GLY  H          .        .    .        B  57       GLY  N
         23   24   37266905.69  .  1961385.5    .  9.992965954  .  46.82486421  .  107.024634   .  B  57       GLY  H       B  57       GLY  CA       B  57       GLY  N
         222  241  54653478.25  .  2695077.25   .  6.497446863  .  63.84452241  .  118.2249186  .  B  58       ILE  H       B  58       ILE  CA       B  58       ILE  N
         223  242  33439849.88  .  1643725.5    .  6.498172111  .  46.80521639  .  118.2435487  .  B  58       ILE  H          .        .    .        B  58       ILE  N
         181  197  63503554.12  .  3005176      .  8.293296578  .  55.42008709  .  122.0924775  .  B  59       ALA  H       B  59       ALA  CA       B  59       ALA  N
         182  198  23301364.81  .  1072442.375  .  8.293640982  .  63.80860578  .  122.1291441  .  B  59       ALA  H          .        .    .        B  59       ALA  N
         293  323  12344822.12  .  620164.875   .  8.416574309  .  55.39869518  .  116.1615505  .  B  60       TYR  H          .        .    .        B  60       TYR  N
         294  324  21440129.97  .  1051766      .  8.424632863  .  62.26832785  .  116.0719543  .  B  60       TYR  H       B  60       TYR  CA       B  60       TYR  N
         168  184  19918549.28  .  991494.1875  .  8.12066404   .  62.28287006  .  118.7287874  .  B  61       ALA  H          .        .    .        B  61       ALA  N
         167  183  51978694.38  .  2651558.5    .  8.118735695  .  55.20667631  .  118.7776696  .  B  61       ALA  H       B  61       ALA  CA       B  61       ALA  N
         323  360  22161222.34  .  1099360.875  .  8.536938292  .  65.92017409  .  117.0568362  .  B  62       ILE  H       B  62       ILE  CA       B  62       ILE  N
         140  154  19728189.12  .  951348.5     .  8.431410184  .  60.1462311   .  122.3192392  .  B  63       TRP  H       B  63       TRP  CA       B  63       TRP  N
         306  340  21167842.81  .  1043481.688  .  9.102649103  .  66.20419791  .  120.561944   .  B  66       VAL  H       B  66       VAL  CA       B  66       VAL  N
         242  263  18011631.03  .  939644.25    .  7.258413762  .  47.654013    .  107.1643366  .  B  67       GLY  H       B  67       GLY  CA       B  67       GLY  N
         314  351  33055371.81  .  1685856.25   .  7.708129084  .  66.91570856  .  122.8994963  .  B  69       VAL  H       B  69       VAL  CA       B  69       VAL  N
         133  146  81856252     .  3996019.5    .  8.642386461  .  64.23363589  .  119.397568   .  B  71       ILE  H       B  71       ILE  CA       B  71       ILE  N
         216  234  25229268.38  .  1227100.625  .  8.046950074  .  62.88011758  .  119.8853802  .  B  72       SER  H       B  72       SER  CA       B  72       SER  N
         127  140  16388357.53  .  837015.3125  .  8.206987395  .  62.80446413  .  121.3727237  .  B  73       LEU  H          .        .    .        B  73       LEU  N
         126  139  94776768     .  4768527      .  8.212940981  .  57.8399653   .  121.3587506  .  B  73       LEU  H       B  73       LEU  CA       B  73       LEU  N
         200  217  125351097.8  .  6096283      .  8.738820673  .  57.99562695  .  120.350913   .  B  74       LEU  H       B  74       LEU  CA       B  74       LEU  N
         17   17   49972999.38  .  2488103.75   .  8.558831055  .  62.14321268  .  117.1728328  .  B  75       SER  H       B  75       SER  CA       B  75       SER  N
         287  316  17843783.94  .  871901.125   .  7.892646209  .  62.16290215  .  124.5383147  .  B  76       TRP  H          .        .    .        B  76       TRP  N
         288  317  80379336.5   .  4106219.5    .  7.894439966  .  58.97376707  .  124.6304302  .  B  76       TRP  H       B  76       TRP  CA       B  76       TRP  N
         46   48   21667606.94  .  1129551.875  .  8.765210762  .  58.97131315  .  105.5829     .  B  77       GLY  H          .        .    .        B  77       GLY  N
         47   49   97570807     .  5062336      .  8.760868536  .  46.7021658   .  105.5885647  .  B  77       GLY  H       B  77       GLY  CA       B  77       GLY  N
         252  274  69691250.5   .  3671005.25   .  8.229993943  .  58.21249855  .  113.5805732  .  B  78       PHE  H       B  78       PHE  CA       B  78       PHE  N
         251  273  27194072.44  .  1435996.5    .  8.226071557  .  46.66305738  .  113.6015428  .  B  78       PHE  H          .        .    .        B  78       PHE  N
         169  185  72093609.62  .  3524427.25   .  7.213891537  .  56.60530998  .  114.3648945  .  B  79       PHE  H       B  79       PHE  CA       B  79       PHE  N
         170  186  20164394.38  .  1016567.812  .  7.214502895  .  58.20863839  .  114.3415627  .  B  79       PHE  H          .        .    .        B  79       PHE  N
         119  132  16571893.25  .  746395.6875  .  7.979902147  .  56.49774745  .  109.2361518  .  B  80       GLY  H          .        .    .        B  80       GLY  N
         118  131  130102931.5  .  6767325      .  7.952999397  .  46.36573434  .  109.1615846  .  B  80       GLY  H       B  80       GLY  CA       B  80       GLY  N
         120  133  28328800.38  .  1441754.5    .  7.953166657  .  56.57923765  .  109.1771196  .  B  80       GLY  H          .        .    .        B  80       GLY  N
         75   80   220929317    .  11363596     .  7.788953964  .  54.97607465  .  120.7934897  .  B  81       GLN  H       B  81       GLN  CA       B  81       GLN  N
         76   81   51280765.12  .  2635854.5    .  7.7877101    .  46.34219093  .  120.770648   .  B  81       GLN  H          .        .    .        B  81       GLN  N
         35   36   345680060.5  .  18074640     .  8.282825097  .  55.75634072  .  124.2670759  .  B  82       ARG  H       B  82       ARG  CA       B  82       ARG  N
         34   35   202597209    .  10429363     .  8.281312561  .  54.97776019  .  124.2642322  .  B  82       ARG  H          .        .    .        B  82       ARG  N
         124  137  159035825.2  .  8532963      .  8.105216348  .  55.75191116  .  124.4943718  .  B  83       LEU  H          .        .    .        B  83       LEU  N
         123  136  289460868    .  14806282     .  8.105799361  .  53.73649172  .  124.4830461  .  B  83       LEU  H       B  83       LEU  CA       B  83       LEU  N
         282  311  70957966.12  .  3381394.25   .  7.456069893  .  53.78214982  .  120.4648414  .  B  84       ASP  H          .        .    .        B  84       ASP  N
         283  312  214096305    .  10891222     .  7.458455325  .  50.95540274  .  120.5657918  .  B  84       ASP  H       B  84       ASP  CA       B  84       ASP  N
         129  142  211170779    .  10526680     .  8.762858715  .  59.27318858  .  118.8895998  .  B  85       LEU  H       B  85       LEU  CA       B  85       LEU  N
         19   20   146375275.5  .  7171689.5    .  7.529342116  .  55.35198543  .  117.8770329  .  B  87       ALA  H       B  87       ALA  CA       B  87       ALA  N
         20   21   59435393     .  2899955.75   .  7.534628502  .  66.18527096  .  117.8499022  .  B  87       ALA  H          .        .    .        B  87       ALA  N
         67   72   32701004.25  .  1714766.25   .  7.966528453  .  55.40137159  .  118.1820798  .  B  88       ILE  H          .        .    .        B  88       ILE  N
         66   71   80369342.75  .  3997941.5    .  7.967576924  .  64.59261543  .  118.1889529  .  B  88       ILE  H       B  88       ILE  CA       B  88       ILE  N
         132  145  90903511.75  .  4339634.5    .  8.683425211  .  64.35854686  .  119.6775138  .  B  89       ILE  H       B  89       ILE  CA       B  89       ILE  N
         15   15   27652478.94  .  1323429.125  .  8.841462165  .  64.31207109  .  107.6204168  .  B  90       GLY  H          .        .    .        B  90       GLY  N
         16   16   96267635.75  .  4822241      .  8.849492945  .  47.57862117  .  107.636508   .  B  90       GLY  H       B  90       GLY  CA       B  90       GLY  N
         219  238  88456936.5   .  4468474.5    .  8.56198725   .  59.79494706  .  119.9248802  .  B  91       MET  H       B  91       MET  CA       B  91       MET  N
         220  239  28781376.38  .  1489435.625  .  8.558944215  .  47.5950087   .  119.9313397  .  B  91       MET  H          .        .    .        B  91       MET  N
         250  272  76881353.75  .  3740626.75   .  8.438606078  .  59.49014208  .  119.7590934  .  B  92       MET  H       B  92       MET  CA       B  92       MET  N
         319  356  21640807.62  .  976486.6875  .  8.290527016  .  58.03862425  .  119.6583148  .  B  93       LEU  H       B  93       LEU  CA       B  93       LEU  N
         117  130  26616286.94  .  1177896.25   .  8.157907705  .  64.31784848  .  116.3043306  .  B  95       CYS  H       B  95       CYS  CA       B  95       CYS  N
         246  268  10881068.77  .  562789.5625  .  8.644719724  .  64.26553139  .  120.2999325  .  B  96       ALA  H          .        .    .        B  96       ALA  N
         245  267  24122886.69  .  1376005.5    .  8.637010801  .  54.85824275  .  120.3898791  .  B  96       ALA  H       B  96       ALA  CA       B  96       ALA  N
         2    2    46858508.5   .  2424944.25   .  8.469280592  .  48.60240701  .  105.8932598  .  B  97       GLY  H       B  97       GLY  CA       B  97       GLY  N
         3    3    13380184.56  .  747753.5625  .  8.478330722  .  54.70025491  .  105.8741784  .  B  97       GLY  H          .        .    .        B  97       GLY  N
         279  307  19126154.06  .  934286       .  8.248272885  .  48.52092579  .  120.4534906  .  B  98       VAL  H          .        .    .        B  98       VAL  N
         280  308  40667481.44  .  2052262      .  8.251708257  .  66.75108623  .  120.4244048  .  B  98       VAL  H       B  98       VAL  CA       B  98       VAL  N
         215  233  33312805.44  .  1621015      .  8.071129787  .  58.1732441   .  119.8468222  .  B  99       LEU  H       B  99       LEU  CA       B  99       LEU  N
         217  235  15438188.56  .  728960       .  8.064188873  .  66.63557109  .  119.8616658  .  B  99       LEU  H          .        .    .        B  99       LEU  N
         249  271  43482242.25  .  2076535.125  .  8.42099438   .  65.76108636  .  119.3232775  .  B  100      ILE  H       B  100      ILE  CA       B  100      ILE  N
         248  270  13964927.66  .  645329.3125  .  8.430660043  .  58.11817121  .  119.2341536  .  B  100      ILE  H          .        .    .        B  100      ILE  N
         228  248  95606087     .  4727177.5    .  7.822949973  .  65.70729378  .  118.6707911  .  B  101      ILE  H       B  101      ILE  CA       B  101      ILE  N
         192  209  22763036.12  .  1220212.125  .  8.135177859  .  65.72574289  .  115.3131438  .  B  102      ASN  H          .        .    .        B  102      ASN  N
         193  210  84679968.75  .  4259722      .  8.135021891  .  56.57133888  .  115.34985    .  B  102      ASN  H       B  102      ASN  CA       B  102      ASN  N
         189  205  67678512.75  .  3269059.25   .  8.484384678  .  56.19216461  .  114.7575112  .  B  103      LEU  H       B  103      LEU  CA       B  103      LEU  N
         299  330  43983357.31  .  2308133.25   .  7.805202506  .  54.6179953   .  114.3814787  .  B  104      LEU  H       B  104      LEU  CA       B  104      LEU  N
         122  135  23797537.44  .  1129492.25   .  7.546701541  .  54.62442945  .  112.0619969  .  B  105      SER  H          .        .    .        B  105      SER  N
         121  134  99031382.25  .  5023659      .  7.545752792  .  58.0329753   .  112.109374   .  B  105      SER  H       B  105      SER  CA       B  105      SER  N
         272  300  30202711.19  .  1525899.75   .  10.08040757  .  58.04335746  .  129.411682   .  B  106      ARG  H          .        .    .        B  106      ARG  N
         271  299  54185587.38  .  2668415.25   .  10.07716817  .  54.76749995  .  129.382985   .  B  106      ARG  H       B  106      ARG  CA       B  106      ARG  N
         206  223  15198508.44  .  744346.1875  .  8.490746193  .  54.81011295  .  117.8834217  .  B  107      SER  H          .        .    .        B  107      SER  N
         205  222  69389767.12  .  3299289      .  8.492745184  .  59.82468912  .  117.871391   .  B  107      SER  H       B  107      SER  CA       B  107      SER  N
         184  200  261552555.5  .  13041101     .  7.673640363  .  58.18415569  .  114.3997218  .  B  108      THR  H       B  108      THR  CA       B  108      THR  N
         183  199  55436655.75  .  2963720.25   .  7.676655973  .  59.82941552  .  114.4025023  .  B  108      THR  H          .        .    .        B  108      THR  N
         26   27   805908656    .  42847044     .  7.776608601  .  56.73862519  .  123.9807732  .  B  110      HIS  H          .        .    .        B  110      HIS  N
;

   loop_
      _Spectral_dim.ID
      _Spectral_dim.Axis_code
      _Spectral_dim.Spectrometer_frequency
      _Spectral_dim.Atom_type
      _Spectral_dim.Atom_isotope_number
      _Spectral_dim.Spectral_region
      _Spectral_dim.Magnetization_linkage_ID
      _Spectral_dim.Under_sampling_type
      _Spectral_dim.Sweep_width
      _Spectral_dim.Sweep_width_units
      _Spectral_dim.Value_first_point
      _Spectral_dim.Absolute_peak_positions
      _Spectral_dim.Acquisition
      _Spectral_dim.Center_frequency_offset
      _Spectral_dim.Encoding_code
      _Spectral_dim.Encoded_reduced_dimension_ID
      _Spectral_dim.Entry_ID
      _Spectral_dim.Spectral_peak_list_ID

      1   .   .   H   1    H   .   .   .   ppm   .   .   .   .   .   .   51025   1
      2   .   .   C   13   C   .   .   .   ppm   .   .   .   .   .   .   51025   1
      3   .   .   N   15   N   .   .   .   ppm   .   .   .   .   .   .   51025   1
   stop_
save_