NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage program type subtype subsubtype
432768 2jt8 15400 cing 4-filtered-FRED Wattos check violation distance


data_2jt8


save_distance_constraint_statistics_1
    _Distance_constraint_stats_list.Sf_category                   distance_constraint_statistics
    _Distance_constraint_stats_list.Constraint_list_ID            1
    _Distance_constraint_stats_list.Constraint_count              1305
    _Distance_constraint_stats_list.Viol_count                    581
    _Distance_constraint_stats_list.Viol_total                    514.789
    _Distance_constraint_stats_list.Viol_max                      0.659
    _Distance_constraint_stats_list.Viol_rms                      0.0327
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0039
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0886
    _Distance_constraint_stats_list.Cutoff_violation_report       0.500
    _Distance_constraint_stats_list.Details                       
;
Description of the tags in this list:
*  1 * Administrative tag
*  2 * Administrative tag
*  3 * Administrative tag
*  4 * ID of the restraint list.                                                              
*  5 * Number of restraints in list.                                                          
*  6 * Number of violated restraints (each model violation is used).                          
*  7 * Sum of violations in Angstrom.                                                         
*  8 * Maximum violation of a restraint without averaging in any way.                         
*  9 * Rms of violations over all restraints.                                                 
*  10 * Average violation over all restraints.                                                 
*  11 * Average violation over violated restraints.                                            
           This violation is averaged over only those models in which the restraint is violated.   
           These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).     
*  12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
*  13 * This tag                                                                               

Description of the tags in the per residue table below:
*  1 * Chain identifier (can be absent if none defined)                   
*  2 * Residue number                                                     
*  3 * Residue name                                                       
*  4 * Maximum violation in ensemble of models (without any averaging)
*  5 * Model number with the maximum violation
*  6 * Number of models with a violation above cutoff
*  7 * List of models (1 character per model) with a violation above cutoff.
           An '*' marks a violation above the cutoff. A '+' indicates the largest
           violation above the cutoff and a '-' marks the smallest violation over cutoff.
           For models  5, 15, 25,... a ' ' is replaced by a '.'.
           For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
*  8 * Administrative tag
*  9 * Administrative tag

Description of the tags in the per restraint table below:
*  1 * Restraint ID within restraint list.                                
           First node, FIRST member, first atom's:                              
*  2 * Chain identifier (can be absent if none defined)                   
*  3 * Residue number                                                     
*  4 * Residue name                                                       
*  5 * Name of (pseudo-)atom                                              
           First node, SECOND member, first atom's:                             
*  6 * Chain identifier (can be absent if none defined)                   
*  7 * Residue number                                                     
*  8 * Residue name                                                       
*  9 * Name of (pseudo-)atom                                              
           FIRST node's:
*  10 * Target distance value (Angstrom)
*  11 * Lower bound distance (Angstrom)
*  12 * Upper bound distance (Angstrom)
*  13 * Average distance in ensemble of models
*  14 * Minimum distance in ensemble of models
*  15 * Maximum distance in ensemble of models
*  16 * Maximum violation (without any averaging)
*  17 * Model number with the maximum violation
*  18 * Number of models with a violation above cutoff
*  19 * List of models with a violation above cutoff. See description above.
*  20 * Administrative tag
*  21 * Administrative tag
;


    loop_
       _Distance_constraint_stats_per_res.Atom_entity_assembly_ID
       _Distance_constraint_stats_per_res.Atom_comp_index_ID
       _Distance_constraint_stats_per_res.Atom_comp_ID
       _Distance_constraint_stats_per_res.Total_violation
       _Distance_constraint_stats_per_res.Max_violation
       _Distance_constraint_stats_per_res.Max_violation_model_number
       _Distance_constraint_stats_per_res.Over_cutoff_viol_count
       _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model

       1   3 ASP 0.166 0.032  5  0 "[    .    1]" 
       1   4 ILE 3.147 0.524  7  1 "[    . +  1]" 
       1   5 TYR 3.497 0.524  7  1 "[    . +  1]" 
       1   6 LYS 0.157 0.033  3  0 "[    .    1]" 
       1   7 ALA 0.879 0.388  7  0 "[    .    1]" 
       1   8 ALA 0.192 0.043  3  0 "[    .    1]" 
       1   9 VAL 0.007 0.007  2  0 "[    .    1]" 
       1  10 GLU 0.000 0.000  .  0 "[    .    1]" 
       1  11 GLN 0.053 0.035  1  0 "[    .    1]" 
       1  12 LEU 0.315 0.087  3  0 "[    .    1]" 
       1  13 THR 0.057 0.022  1  0 "[    .    1]" 
       1  14 GLU 0.013 0.013  3  0 "[    .    1]" 
       1  15 GLU 0.013 0.013  3  0 "[    .    1]" 
       1  16 GLN 0.051 0.022  1  0 "[    .    1]" 
       1  17 LYS 0.018 0.018  5  0 "[    .    1]" 
       1  18 ASN 0.257 0.116  4  0 "[    .    1]" 
       1  19 GLU 0.227 0.116  4  0 "[    .    1]" 
       1  20 PHE 4.874 0.459  7  0 "[    .    1]" 
       1  21 LYS 1.043 0.139 10  0 "[    .    1]" 
       1  22 ALA 0.004 0.004  6  0 "[    .    1]" 
       1  23 ALA 0.004 0.004  2  0 "[    .    1]" 
       1  24 PHE 0.036 0.024  5  0 "[    .    1]" 
       1  25 ASP 0.317 0.180 10  0 "[    .    1]" 
       1  26 ILE 1.374 0.436 10  0 "[    .    1]" 
       1  27 PHE 5.071 0.440  5  0 "[    .    1]" 
       1  28 VAL 0.439 0.193  5  0 "[    .    1]" 
       1  29 LEU 0.096 0.096  5  0 "[    .    1]" 
       1  30 GLY 0.000 0.000  .  0 "[    .    1]" 
       1  31 ALA 0.221 0.096  5  0 "[    .    1]" 
       1  32 GLU 0.003 0.003  5  0 "[    .    1]" 
       1  33 ASP 0.000 0.000  .  0 "[    .    1]" 
       1  34 GLY 0.000 0.000  .  0 "[    .    1]" 
       1  35 SER 0.363 0.193  5  0 "[    .    1]" 
       1  36 ILE 0.363 0.159  5  0 "[    .    1]" 
       1  38 THR 0.372 0.323  4  0 "[    .    1]" 
       1  39 LYS 0.285 0.177  4  0 "[    .    1]" 
       1  40 GLU 1.043 0.323  4  0 "[    .    1]" 
       1  41 LEU 0.145 0.133  4  0 "[    .    1]" 
       1  42 GLY 0.300 0.143  9  0 "[    .    1]" 
       1  43 LYS 0.304 0.143  9  0 "[    .    1]" 
       1  44 VAL 0.112 0.106  5  0 "[    .    1]" 
       1  45 MET 0.004 0.004  4  0 "[    .    1]" 
       1  46 ARG 0.003 0.002 10  0 "[    .    1]" 
       1  47 MET 0.404 0.298  4  0 "[    .    1]" 
       1  48 LEU 0.300 0.298  4  0 "[    .    1]" 
       1  49 GLY 0.000 0.000  .  0 "[    .    1]" 
       1  50 GLN 0.003 0.001  8  0 "[    .    1]" 
       1  51 ASN 0.000 0.000  .  0 "[    .    1]" 
       1  52 PRO 0.000 0.000  .  0 "[    .    1]" 
       1  53 THR 0.000 0.000  .  0 "[    .    1]" 
       1  54 PRO 0.000 0.000  .  0 "[    .    1]" 
       1  55 GLU 0.000 0.000  .  0 "[    .    1]" 
       1  56 GLU 0.001 0.001  1  0 "[    .    1]" 
       1  57 LEU 0.147 0.146  3  0 "[    .    1]" 
       1  58 GLN 0.008 0.007  4  0 "[    .    1]" 
       1  59 GLU 0.000 0.000  .  0 "[    .    1]" 
       1  60 MET 0.036 0.030  1  0 "[    .    1]" 
       1  61 ILE 0.019 0.011  1  0 "[    .    1]" 
       1  62 ASP 0.046 0.030  1  0 "[    .    1]" 
       1  63 GLU 0.006 0.003  9  0 "[    .    1]" 
       1  64 VAL 0.003 0.003  9  0 "[    .    1]" 
       1  65 ASP 0.000 0.000  .  0 "[    .    1]" 
       1  66 GLU 0.000 0.000  .  0 "[    .    1]" 
       1  67 ASP 0.000 0.000  .  0 "[    .    1]" 
       1  68 GLY 0.025 0.025  5  0 "[    .    1]" 
       1  69 SER 0.000 0.000 10  0 "[    .    1]" 
       1  70 GLY 0.025 0.025  5  0 "[    .    1]" 
       1  71 THR 0.000 0.000 10  0 "[    .    1]" 
       1  72 VAL 0.751 0.151  9  0 "[    .    1]" 
       1  73 ASP 0.001 0.001  1  0 "[    .    1]" 
       1  74 PHE 0.001 0.001  1  0 "[    .    1]" 
       1  75 ASP 0.000 0.000  .  0 "[    .    1]" 
       1  76 GLU 0.018 0.018 10  0 "[    .    1]" 
       1  77 PHE 0.014 0.014  2  0 "[    .    1]" 
       1  78 LEU 0.096 0.044  1  0 "[    .    1]" 
       1  79 VAL 0.505 0.163  8  0 "[    .    1]" 
       1  80 MET 0.021 0.013  5  0 "[    .    1]" 
       1  81 MET 0.000 0.000  .  0 "[    .    1]" 
       1  82 VAL 0.264 0.055  5  0 "[    .    1]" 
       1  83 ARG 0.094 0.026  7  0 "[    .    1]" 
       1  84 SER 0.024 0.013  5  0 "[    .    1]" 
       1  85 MET 0.348 0.144  9  0 "[    .    1]" 
       1  86 LYS 0.568 0.144  9  0 "[    .    1]" 
       1  87 ASP 0.101 0.063  1  0 "[    .    1]" 
       1  88 ASP 0.000 0.000  .  0 "[    .    1]" 
       1  89 SER 0.100 0.062  8  0 "[    .    1]" 
       1  90 LYS 0.100 0.062  8  0 "[    .    1]" 
       1  91 GLY 0.000 0.000  .  0 "[    .    1]" 
       1  92 LYS 0.022 0.010  3  0 "[    .    1]" 
       1  93 SER 0.022 0.010  3  0 "[    .    1]" 
       1  94 GLU 0.036 0.018  3  0 "[    .    1]" 
       1  95 GLU 0.077 0.077  6  0 "[    .    1]" 
       1  96 GLU 0.077 0.077  6  0 "[    .    1]" 
       1  97 LEU 1.551 0.210  2  0 "[    .    1]" 
       1  98 SER 0.025 0.012  4  0 "[    .    1]" 
       1  99 ASP 0.095 0.040  2  0 "[    .    1]" 
       1 100 LEU 0.007 0.007  4  0 "[    .    1]" 
       1 101 PHE 1.317 0.115  3  0 "[    .    1]" 
       1 102 ARG 1.348 0.115  3  0 "[    .    1]" 
       1 103 MET 0.000 0.000  .  0 "[    .    1]" 
       1 104 PHE 6.559 0.659  5 10  [***-+*****]  
       1 105 ASP 0.043 0.037  5  0 "[    .    1]" 
       1 106 LYS 0.043 0.017 10  0 "[    .    1]" 
       1 107 ASN 0.053 0.037  5  0 "[    .    1]" 
       1 108 ALA 0.006 0.006  4  0 "[    .    1]" 
       1 109 ASP 0.016 0.016  3  0 "[    .    1]" 
       1 110 GLY 0.000 0.000  .  0 "[    .    1]" 
       1 111 TYR 6.474 0.246  8  0 "[    .    1]" 
       1 112 ILE 2.699 0.205  5  0 "[    .    1]" 
       1 113 ASP 0.030 0.030  9  0 "[    .    1]" 
       1 114 LEU 3.078 0.467 10  0 "[    .    1]" 
       1 115 ASP 2.877 0.467 10  0 "[    .    1]" 
       1 116 GLU 0.295 0.233 10  0 "[    .    1]" 
       1 117 LEU 1.537 0.292 10  0 "[    .    1]" 
       1 118 LYS 1.765 0.292 10  0 "[    .    1]" 
       1 119 ILE 0.660 0.242 10  0 "[    .    1]" 
       1 120 MET 0.005 0.005  8  0 "[    .    1]" 
       1 121 LEU 0.010 0.007  4  0 "[    .    1]" 
       1 122 GLN 0.112 0.046 10  0 "[    .    1]" 
       1 123 ALA 0.056 0.020  4  0 "[    .    1]" 
       1 124 THR 0.025 0.018 10  0 "[    .    1]" 
       1 125 GLY 0.000 0.000  .  0 "[    .    1]" 
       1 126 GLU 0.004 0.004  7  0 "[    .    1]" 
       1 127 THR 0.048 0.026 10  0 "[    .    1]" 
       1 128 ILE 0.058 0.026 10  0 "[    .    1]" 
       1 129 THR 0.012 0.010  8  0 "[    .    1]" 
       1 130 GLU 0.193 0.139  5  0 "[    .    1]" 
       1 131 ASP 0.054 0.054  5  0 "[    .    1]" 
       1 132 ASP 0.338 0.087  4  0 "[    .    1]" 
       1 133 ILE 0.592 0.087  4  0 "[    .    1]" 
       1 134 GLU 0.102 0.034  8  0 "[    .    1]" 
       1 135 GLU 0.000 0.000  .  0 "[    .    1]" 
       1 136 LEU 0.165 0.124  6  0 "[    .    1]" 
       1 137 MET 0.715 0.124  6  0 "[    .    1]" 
       1 138 LYS 0.138 0.061  4  0 "[    .    1]" 
       1 139 ASP 0.138 0.061  4  0 "[    .    1]" 
       1 140 GLY 0.042 0.019  2  0 "[    .    1]" 
       1 141 ASP 0.227 0.119  3  0 "[    .    1]" 
       1 142 LYS 0.146 0.092 10  0 "[    .    1]" 
       1 143 ASN 0.717 0.197  8  0 "[    .    1]" 
       1 144 ASN 0.465 0.158  8  0 "[    .    1]" 
       1 145 ASP 0.080 0.038 10  0 "[    .    1]" 
       1 146 GLY 0.061 0.044  9  0 "[    .    1]" 
       1 147 ARG 0.497 0.218  8  0 "[    .    1]" 
       1 148 ILE 0.321 0.119  3  0 "[    .    1]" 
       1 149 ASP 0.223 0.047  6  0 "[    .    1]" 
       1 150 TYR 0.751 0.120  8  0 "[    .    1]" 
       1 151 ASP 0.843 0.207  8  0 "[    .    1]" 
       1 152 GLU 0.905 0.207  8  0 "[    .    1]" 
       1 154 LEU 1.253 0.210  2  0 "[    .    1]" 
       1 155 GLU 0.169 0.064  2  0 "[    .    1]" 
       1 156 PHE 4.129 0.261  1  0 "[    .    1]" 
       1 157 MET 2.373 0.261  1  0 "[    .    1]" 
       1 158 LYS 0.892 0.210  2  0 "[    .    1]" 
       1 159 GLY 0.651 0.210  2  0 "[    .    1]" 
       1 160 VAL 0.004 0.002  2  0 "[    .    1]" 
       1 161 GLU 0.002 0.002  7  0 "[    .    1]" 
    stop_

    loop_
       _Distance_constraint_stats.Restraint_ID
       _Distance_constraint_stats.Atom_1_entity_assembly_ID
       _Distance_constraint_stats.Atom_1_comp_index_ID
       _Distance_constraint_stats.Atom_1_comp_ID
       _Distance_constraint_stats.Atom_1_ID
       _Distance_constraint_stats.Atom_2_entity_assembly_ID
       _Distance_constraint_stats.Atom_2_comp_index_ID
       _Distance_constraint_stats.Atom_2_comp_ID
       _Distance_constraint_stats.Atom_2_ID
       _Distance_constraint_stats.Node_1_distance_val
       _Distance_constraint_stats.Node_1_distance_lower_bound_val
       _Distance_constraint_stats.Node_1_distance_upper_bound_val
       _Distance_constraint_stats.Distance_average
       _Distance_constraint_stats.Distance_minimum
       _Distance_constraint_stats.Distance_maximum
       _Distance_constraint_stats.Max_violation
       _Distance_constraint_stats.Max_violation_model_number
       _Distance_constraint_stats.Over_cutoff_violation_count
       _Distance_constraint_stats.Over_cutoff_viol_per_model
       _Distance_constraint_stats.Distance_constraint_stats_ID

          1 1   3 ASP H    1   3 ASP QB   . . 3.590 2.289 2.054 2.668     .  0  0 "[    .    1]" 1 
          2 1   3 ASP H    1   4 ILE H    . . 4.130 2.598 2.395 2.885     .  0  0 "[    .    1]" 1 
          3 1   3 ASP HA   1   4 ILE MG   . . 5.770 4.726 4.159 5.321     .  0  0 "[    .    1]" 1 
          4 1   3 ASP QB   1   4 ILE H    . . 3.630 2.796 2.332 3.662 0.032  5  0 "[    .    1]" 1 
          5 1   3 ASP QB   1   4 ILE MG   . . 4.340 3.691 2.200 4.336     .  0  0 "[    .    1]" 1 
          6 1   3 ASP QB   1   5 TYR H    . . 4.940 3.935 2.364 4.943 0.003  5  0 "[    .    1]" 1 
          7 1   3 ASP QB   1   6 LYS QB   . . 4.360 3.759 2.609 4.383 0.023  2  0 "[    .    1]" 1 
          8 1   3 ASP QB   1   6 LYS QD   . . 4.370 4.061 3.356 4.362     .  0  0 "[    .    1]" 1 
          9 1   3 ASP HB2  1   4 ILE H    . . 4.210 3.259 2.439 4.004     .  0  0 "[    .    1]" 1 
         10 1   3 ASP HB2  1   4 ILE HA   . . 6.000 4.938 4.308 5.586     .  0  0 "[    .    1]" 1 
         11 1   3 ASP HB2  1   5 TYR H    . . 5.750 4.812 3.433 5.682     .  0  0 "[    .    1]" 1 
         12 1   3 ASP HB2  1   7 ALA H    . . 6.000 5.477 4.324 6.014 0.014  2  0 "[    .    1]" 1 
         13 1   3 ASP HB3  1   4 ILE H    . . 4.210 3.270 2.423 4.239 0.029  5  0 "[    .    1]" 1 
         14 1   3 ASP HB3  1   4 ILE HA   . . 6.000 4.538 3.960 5.720     .  0  0 "[    .    1]" 1 
         15 1   3 ASP HB3  1   5 TYR H    . . 5.750 4.291 2.409 5.729     .  0  0 "[    .    1]" 1 
         16 1   3 ASP HB3  1   7 ALA H    . . 6.000 4.973 3.525 6.014 0.014  5  0 "[    .    1]" 1 
         17 1   4 ILE H    1   4 ILE HB   . . 3.990 3.558 2.709 3.950     .  0  0 "[    .    1]" 1 
         18 1   4 ILE H    1   4 ILE MD   . . 4.720 3.181 1.880 4.809 0.089  7  0 "[    .    1]" 1 
         19 1   4 ILE H    1   4 ILE MG   . . 3.970 2.514 1.909 3.877     .  0  0 "[    .    1]" 1 
         20 1   4 ILE H    1   5 TYR H    . . 3.790 2.611 1.845 3.228     .  0  0 "[    .    1]" 1 
         21 1   4 ILE H    1   7 ALA H    . . 5.070 4.557 3.646 5.119 0.049  7  0 "[    .    1]" 1 
         22 1   4 ILE HA   1   4 ILE MD   . . 4.360 3.396 2.074 4.087     .  0  0 "[    .    1]" 1 
         23 1   4 ILE HA   1   4 ILE MG   . . 3.550 2.577 2.163 3.191     .  0  0 "[    .    1]" 1 
         24 1   4 ILE HA   1   7 ALA H    . . 4.360 4.088 3.411 4.368 0.008  8  0 "[    .    1]" 1 
         25 1   4 ILE HA   1   7 ALA MB   . . 3.730 3.338 2.538 3.689     .  0  0 "[    .    1]" 1 
         26 1   4 ILE HB   1   4 ILE MD   . . 3.530 2.707 2.060 3.221     .  0  0 "[    .    1]" 1 
         27 1   4 ILE HB   1   5 TYR QE   . . 4.230 4.247 3.752 4.754 0.524  7  1 "[    . +  1]" 1 
         28 1   4 ILE MD   1   5 TYR HD1  . . 5.150 4.206 3.315 5.223 0.073  6  0 "[    .    1]" 1 
         29 1   4 ILE MD   1   5 TYR QE   . . 4.600 3.464 2.293 4.728 0.128  6  0 "[    .    1]" 1 
         30 1   4 ILE MD   1   7 ALA H    . . 6.000 5.812 5.009 6.388 0.388  7  0 "[    .    1]" 1 
         31 1   4 ILE MG   1   5 TYR H    . . 4.220 3.503 1.914 4.291 0.071  9  0 "[    .    1]" 1 
         32 1   4 ILE MG   1   5 TYR HA   . . 6.000 4.885 2.794 5.579     .  0  0 "[    .    1]" 1 
         33 1   4 ILE MG   1   5 TYR HD1  . . 5.190 4.371 2.002 5.263 0.073 10  0 "[    .    1]" 1 
         34 1   4 ILE MG   1   5 TYR QE   . . 4.880 4.125 2.404 4.951 0.071  9  0 "[    .    1]" 1 
         35 1   5 TYR H    1   5 TYR HB2  . . 3.730 2.644 2.508 2.778     .  0  0 "[    .    1]" 1 
         36 1   5 TYR H    1   5 TYR QB   . . 3.120 2.590 2.469 2.710     .  0  0 "[    .    1]" 1 
         37 1   5 TYR H    1   5 TYR HB3  . . 3.730 3.711 3.594 3.803 0.073  9  0 "[    .    1]" 1 
         38 1   5 TYR H    1   5 TYR HD1  . . 3.740 3.580 3.043 3.810 0.070 10  0 "[    .    1]" 1 
         39 1   5 TYR H    1   5 TYR QE   . . 4.920 4.746 4.241 5.148 0.228  9  0 "[    .    1]" 1 
         40 1   5 TYR H    1   6 LYS H    . . 3.190 2.154 1.845 2.533     .  0  0 "[    .    1]" 1 
         41 1   5 TYR H    1   6 LYS QB   . . 4.950 3.962 3.602 4.310     .  0  0 "[    .    1]" 1 
         42 1   5 TYR HA   1   5 TYR HD1  . . 3.020 2.102 1.952 2.345     .  0  0 "[    .    1]" 1 
         43 1   5 TYR HA   1   5 TYR QE   . . 4.850 4.436 4.302 4.647     .  0  0 "[    .    1]" 1 
         44 1   5 TYR HA   1   7 ALA H    . . 4.290 3.967 3.605 4.304 0.014  5  0 "[    .    1]" 1 
         45 1   5 TYR HA   1   8 ALA H    . . 3.950 3.549 3.374 3.931     .  0  0 "[    .    1]" 1 
         46 1   5 TYR HA   1   8 ALA MB   . . 3.650 3.099 2.544 3.422     .  0  0 "[    .    1]" 1 
         47 1   5 TYR HA   1   9 VAL H    . . 5.040 4.475 4.030 5.038     .  0  0 "[    .    1]" 1 
         48 1   5 TYR QB   1   5 TYR HD1  . . 3.020 2.914 2.860 2.979     .  0  0 "[    .    1]" 1 
         49 1   5 TYR QB   1   6 LYS H    . . 3.720 2.710 1.975 2.981     .  0  0 "[    .    1]" 1 
         50 1   5 TYR QB   1  79 VAL MG1  . . 4.370 2.407 1.905 3.348     .  0  0 "[    .    1]" 1 
         51 1   5 TYR QB   1  79 VAL MG2  . . 3.820 3.443 1.923 3.983 0.163  8  0 "[    .    1]" 1 
         52 1   5 TYR HD1  1   6 LYS H    . . 5.010 4.967 4.884 5.043 0.033  3  0 "[    .    1]" 1 
         53 1   5 TYR HD1  1   8 ALA MB   . . 4.450 4.339 3.905 4.472 0.022  3  0 "[    .    1]" 1 
         54 1   5 TYR HD1  1  82 VAL MG2  . . 3.930 2.712 1.921 3.679     .  0  0 "[    .    1]" 1 
         55 1   5 TYR QE   1  83 ARG HA   . . 5.700 4.450 2.160 5.706 0.006  3  0 "[    .    1]" 1 
         56 1   6 LYS H    1   6 LYS QB   . . 2.900 2.254 2.154 2.481     .  0  0 "[    .    1]" 1 
         57 1   6 LYS H    1   6 LYS QG   . . 4.400 3.567 2.169 4.028     .  0  0 "[    .    1]" 1 
         58 1   6 LYS HA   1   6 LYS QD   . . 4.100 3.709 3.045 4.100 0.000  3  0 "[    .    1]" 1 
         59 1   6 LYS HA   1   8 ALA H    . . 4.650 4.396 4.092 4.664 0.014  3  0 "[    .    1]" 1 
         60 1   6 LYS HA   1   9 VAL H    . . 4.190 3.607 3.405 3.871     .  0  0 "[    .    1]" 1 
         61 1   6 LYS QB   1   6 LYS QE   . . 4.360 3.325 2.568 3.618     .  0  0 "[    .    1]" 1 
         62 1   6 LYS QB   1   7 ALA H    . . 3.410 2.955 2.714 3.198     .  0  0 "[    .    1]" 1 
         63 1   6 LYS QE   1   6 LYS QG   . . 3.230 2.099 1.982 2.341     .  0  0 "[    .    1]" 1 
         64 1   7 ALA H    1   7 ALA MB   . . 2.900 2.166 2.052 2.242     .  0  0 "[    .    1]" 1 
         65 1   7 ALA H    1   8 ALA H    . . 3.400 2.540 2.336 2.786     .  0  0 "[    .    1]" 1 
         66 1   7 ALA MB   1   8 ALA H    . . 3.410 2.622 2.334 2.877     .  0  0 "[    .    1]" 1 
         67 1   7 ALA MB   1   9 VAL H    . . 5.250 4.582 4.203 4.906     .  0  0 "[    .    1]" 1 
         68 1   7 ALA MB   1  10 GLU H    . . 5.260 4.667 4.436 4.746     .  0  0 "[    .    1]" 1 
         69 1   8 ALA H    1   8 ALA MB   . . 3.040 2.131 2.027 2.247     .  0  0 "[    .    1]" 1 
         70 1   8 ALA H    1   9 VAL H    . . 3.340 2.643 2.441 2.946     .  0  0 "[    .    1]" 1 
         71 1   8 ALA H    1  11 GLN QG   . . 5.810 5.246 4.369 5.773     .  0  0 "[    .    1]" 1 
         72 1   8 ALA H    1  82 VAL HB   . . 4.500 4.468 4.345 4.543 0.043  3  0 "[    .    1]" 1 
         73 1   8 ALA HA   1  11 GLN H    . . 4.060 3.560 3.211 3.917     .  0  0 "[    .    1]" 1 
         74 1   8 ALA HA   1  11 GLN QB   . . 4.470 4.193 3.211 4.505 0.035  1  0 "[    .    1]" 1 
         75 1   8 ALA HA   1  11 GLN QG   . . 3.680 2.967 2.282 3.682 0.002  6  0 "[    .    1]" 1 
         76 1   8 ALA MB   1   9 VAL H    . . 3.570 2.591 2.181 2.931     .  0  0 "[    .    1]" 1 
         77 1   8 ALA MB   1  10 GLU H    . . 4.690 4.316 4.137 4.609     .  0  0 "[    .    1]" 1 
         78 1   8 ALA MB   1  11 GLN H    . . 4.910 4.501 4.194 4.763     .  0  0 "[    .    1]" 1 
         79 1   8 ALA MB   1  82 VAL HB   . . 3.790 2.416 1.957 3.599     .  0  0 "[    .    1]" 1 
         80 1   8 ALA MB   1  82 VAL MG1  . . 3.090 2.180 1.751 2.801     .  0  0 "[    .    1]" 1 
         81 1   9 VAL H    1   9 VAL HB   . . 3.130 2.550 2.406 2.684     .  0  0 "[    .    1]" 1 
         82 1   9 VAL H    1   9 VAL MG1  . . 3.980 3.150 2.116 3.766     .  0  0 "[    .    1]" 1 
         83 1   9 VAL H    1   9 VAL MG2  . . 3.980 2.771 1.986 3.764     .  0  0 "[    .    1]" 1 
         84 1   9 VAL H    1  10 GLU H    . . 3.400 2.723 2.631 2.814     .  0  0 "[    .    1]" 1 
         85 1   9 VAL H    1  11 GLN H    . . 4.680 4.402 4.123 4.687 0.007  2  0 "[    .    1]" 1 
         86 1   9 VAL H    1  12 LEU QB   . . 5.650 4.600 3.842 5.578     .  0  0 "[    .    1]" 1 
         87 1   9 VAL HA   1   9 VAL MG1  . . 3.330 2.667 2.236 3.203     .  0  0 "[    .    1]" 1 
         88 1   9 VAL HA   1   9 VAL MG2  . . 3.330 2.305 2.187 2.380     .  0  0 "[    .    1]" 1 
         89 1   9 VAL HA   1  11 GLN H    . . 4.830 4.106 3.562 4.362     .  0  0 "[    .    1]" 1 
         90 1   9 VAL HA   1  12 LEU H    . . 5.020 3.248 2.800 3.715     .  0  0 "[    .    1]" 1 
         91 1   9 VAL HA   1  12 LEU HG   . . 4.090 2.913 2.010 3.693     .  0  0 "[    .    1]" 1 
         92 1   9 VAL HB   1  10 GLU H    . . 4.090 3.335 2.628 4.089     .  0  0 "[    .    1]" 1 
         93 1  10 GLU H    1  10 GLU QG   . . 3.950 2.919 2.024 3.949     .  0  0 "[    .    1]" 1 
         94 1  10 GLU H    1  11 GLN H    . . 3.330 2.700 2.531 2.880     .  0  0 "[    .    1]" 1 
         95 1  10 GLU H    1  12 LEU QB   . . 5.640 4.600 4.332 5.137     .  0  0 "[    .    1]" 1 
         96 1  10 GLU HA   1  10 GLU QB   . . 2.600 2.437 2.307 2.529     .  0  0 "[    .    1]" 1 
         97 1  10 GLU HA   1  10 GLU QG   . . 2.870 2.349 2.134 2.537     .  0  0 "[    .    1]" 1 
         98 1  10 GLU HA   1  12 LEU H    . . 4.500 4.041 3.832 4.300     .  0  0 "[    .    1]" 1 
         99 1  10 GLU QB   1  11 GLN H    . . 4.010 2.692 2.428 3.056     .  0  0 "[    .    1]" 1 
        100 1  11 GLN H    1  11 GLN HB2  . . 3.830 3.381 2.568 3.796     .  0  0 "[    .    1]" 1 
        101 1  11 GLN H    1  11 GLN QB   . . 3.310 2.637 2.412 2.929     .  0  0 "[    .    1]" 1 
        102 1  11 GLN H    1  11 GLN HB3  . . 3.830 3.014 2.450 3.750     .  0  0 "[    .    1]" 1 
        103 1  11 GLN H    1  11 GLN QG   . . 3.380 2.320 2.120 2.524     .  0  0 "[    .    1]" 1 
        104 1  11 GLN HA   1  11 GLN QG   . . 3.450 3.104 2.506 3.384     .  0  0 "[    .    1]" 1 
        105 1  11 GLN QB   1  12 LEU H    . . 4.360 3.713 2.822 4.046     .  0  0 "[    .    1]" 1 
        106 1  11 GLN QG   1  12 LEU H    . . 4.750 3.320 2.246 4.379     .  0  0 "[    .    1]" 1 
        107 1  12 LEU H    1  12 LEU HB2  . . 3.920 2.497 2.067 3.409     .  0  0 "[    .    1]" 1 
        108 1  12 LEU H    1  12 LEU QB   . . 3.360 2.188 2.049 2.418     .  0  0 "[    .    1]" 1 
        109 1  12 LEU H    1  12 LEU HB3  . . 3.920 3.131 2.431 3.494     .  0  0 "[    .    1]" 1 
        110 1  12 LEU H    1  12 LEU HG   . . 4.000 3.900 3.314 4.087 0.087  3  0 "[    .    1]" 1 
        111 1  12 LEU H    1  13 THR H    . . 4.750 4.448 4.132 4.623     .  0  0 "[    .    1]" 1 
        112 1  12 LEU HA   1  12 LEU MD1  . . 4.760 2.592 2.199 3.784     .  0  0 "[    .    1]" 1 
        113 1  12 LEU HA   1  12 LEU MD2  . . 4.760 2.745 2.073 3.979     .  0  0 "[    .    1]" 1 
        114 1  12 LEU HA   1  13 THR H    . . 3.060 2.251 2.140 2.566     .  0  0 "[    .    1]" 1 
        115 1  12 LEU QB   1  13 THR H    . . 3.950 3.194 2.106 3.849     .  0  0 "[    .    1]" 1 
        116 1  12 LEU HB2  1  12 LEU MD1  . . 3.620 2.729 2.112 3.177     .  0  0 "[    .    1]" 1 
        117 1  12 LEU HB2  1  12 LEU MD2  . . 3.620 2.558 2.300 3.189     .  0  0 "[    .    1]" 1 
        118 1  12 LEU HB2  1  13 THR H    . . 4.710 4.133 3.613 4.558     .  0  0 "[    .    1]" 1 
        119 1  12 LEU HB3  1  12 LEU MD1  . . 3.620 2.566 2.156 3.194     .  0  0 "[    .    1]" 1 
        120 1  12 LEU HB3  1  12 LEU MD2  . . 3.620 2.734 2.184 3.194     .  0  0 "[    .    1]" 1 
        121 1  12 LEU HB3  1  13 THR H    . . 4.710 3.457 2.120 4.511     .  0  0 "[    .    1]" 1 
        122 1  13 THR H    1  13 THR MG   . . 3.110 2.427 1.918 3.119 0.009  3  0 "[    .    1]" 1 
        123 1  13 THR H    1  16 GLN H    . . 4.890 4.475 4.015 4.912 0.022  1  0 "[    .    1]" 1 
        124 1  13 THR HA   1  13 THR MG   . . 3.230 2.805 2.021 3.193     .  0  0 "[    .    1]" 1 
        125 1  13 THR HA   1  14 GLU H    . . 3.160 2.206 2.163 2.400     .  0  0 "[    .    1]" 1 
        126 1  13 THR HA   1  14 GLU QB   . . 4.690 4.467 4.268 4.637     .  0  0 "[    .    1]" 1 
        127 1  13 THR HA   1  14 GLU QG   . . 5.140 3.964 3.551 4.414     .  0  0 "[    .    1]" 1 
        128 1  13 THR HA   1  15 GLU H    . . 4.710 3.821 3.640 4.088     .  0  0 "[    .    1]" 1 
        129 1  13 THR HA   1  16 GLN H    . . 5.020 4.929 4.746 5.029 0.009  5  0 "[    .    1]" 1 
        130 1  13 THR MG   1  14 GLU H    . . 4.220 3.822 3.361 3.995     .  0  0 "[    .    1]" 1 
        131 1  13 THR MG   1  15 GLU H    . . 4.500 3.454 2.981 4.122     .  0  0 "[    .    1]" 1 
        132 1  13 THR MG   1  15 GLU QG   . . 3.830 3.488 3.042 3.830     .  0  0 "[    .    1]" 1 
        133 1  13 THR MG   1  16 GLN H    . . 4.790 3.142 1.920 4.794 0.004  2  0 "[    .    1]" 1 
        134 1  14 GLU H    1  14 GLU QB   . . 3.070 2.562 2.326 2.679     .  0  0 "[    .    1]" 1 
        135 1  14 GLU H    1  14 GLU QG   . . 3.800 2.198 1.977 2.551     .  0  0 "[    .    1]" 1 
        136 1  14 GLU H    1  15 GLU H    . . 3.630 2.615 2.428 2.770     .  0  0 "[    .    1]" 1 
        137 1  14 GLU QB   1  15 GLU H    . . 3.600 3.380 2.706 3.613 0.013  3  0 "[    .    1]" 1 
        138 1  14 GLU QG   1  15 GLU H    . . 4.050 2.737 2.146 4.012     .  0  0 "[    .    1]" 1 
        139 1  15 GLU H    1  15 GLU QG   . . 3.760 2.242 1.930 2.676     .  0  0 "[    .    1]" 1 
        140 1  15 GLU H    1  16 GLN H    . . 3.400 2.796 2.602 2.952     .  0  0 "[    .    1]" 1 
        141 1  15 GLU HA   1  18 ASN HB2  . . 4.610 3.912 3.168 4.314     .  0  0 "[    .    1]" 1 
        142 1  15 GLU HA   1  18 ASN HB3  . . 4.610 4.158 3.573 4.580     .  0  0 "[    .    1]" 1 
        143 1  15 GLU QB   1  16 GLN H    . . 3.740 2.683 2.141 3.582     .  0  0 "[    .    1]" 1 
        144 1  16 GLN H    1  16 GLN QB   . . 3.490 2.385 2.233 2.477     .  0  0 "[    .    1]" 1 
        145 1  16 GLN H    1  16 GLN HG2  . . 3.020 2.380 2.248 2.680     .  0  0 "[    .    1]" 1 
        146 1  16 GLN H    1  16 GLN HG3  . . 4.200 3.635 3.302 3.850     .  0  0 "[    .    1]" 1 
        147 1  16 GLN H    1  17 LYS H    . . 3.430 2.559 2.453 2.719     .  0  0 "[    .    1]" 1 
        148 1  16 GLN HA   1  16 GLN HG2  . . 4.070 3.741 3.670 3.821     .  0  0 "[    .    1]" 1 
        149 1  16 GLN HA   1  16 GLN HG3  . . 4.040 3.727 3.637 3.801     .  0  0 "[    .    1]" 1 
        150 1  16 GLN HA   1  19 GLU H    . . 3.960 3.091 2.957 3.315     .  0  0 "[    .    1]" 1 
        151 1  16 GLN HA   1  20 PHE HB3  . . 5.780 5.176 4.368 5.783 0.003  8  0 "[    .    1]" 1 
        152 1  16 GLN QB   1  19 GLU H    . . 5.210 4.527 4.387 4.799     .  0  0 "[    .    1]" 1 
        153 1  16 GLN HG3  1  17 LYS H    . . 3.600 2.809 2.467 3.042     .  0  0 "[    .    1]" 1 
        154 1  16 GLN HG3  1  18 ASN H    . . 5.610 5.031 4.638 5.237     .  0  0 "[    .    1]" 1 
        155 1  16 GLN HG3  1  20 PHE QD   . . 5.310 4.853 4.447 5.170     .  0  0 "[    .    1]" 1 
        156 1  17 LYS H    1  17 LYS QB   . . 3.120 2.190 2.118 2.247     .  0  0 "[    .    1]" 1 
        157 1  17 LYS H    1  17 LYS QD   . . 4.730 4.383 4.085 4.679     .  0  0 "[    .    1]" 1 
        158 1  17 LYS H    1  17 LYS QE   . . 6.000 5.095 4.306 5.940     .  0  0 "[    .    1]" 1 
        159 1  17 LYS H    1  17 LYS QG   . . 4.420 3.911 3.759 4.024     .  0  0 "[    .    1]" 1 
        160 1  17 LYS H    1  18 ASN QB   . . 5.810 4.475 4.302 4.604     .  0  0 "[    .    1]" 1 
        161 1  17 LYS HA   1  17 LYS QG   . . 3.650 2.333 2.084 2.509     .  0  0 "[    .    1]" 1 
        162 1  17 LYS HA   1  20 PHE H    . . 4.230 3.943 3.725 4.084     .  0  0 "[    .    1]" 1 
        163 1  17 LYS HA   1  20 PHE HB3  . . 5.280 4.754 3.707 5.298 0.018  5  0 "[    .    1]" 1 
        164 1  17 LYS HA   1  20 PHE QD   . . 4.170 2.818 2.474 3.038     .  0  0 "[    .    1]" 1 
        165 1  17 LYS QB   1  17 LYS QE   . . 4.340 2.704 2.212 3.654     .  0  0 "[    .    1]" 1 
        166 1  17 LYS QB   1  18 ASN H    . . 3.300 2.741 2.585 2.981     .  0  0 "[    .    1]" 1 
        167 1  17 LYS QB   1  18 ASN QB   . . 4.580 3.800 3.631 3.891     .  0  0 "[    .    1]" 1 
        168 1  17 LYS QB   1  20 PHE QD   . . 5.390 4.592 4.291 4.778     .  0  0 "[    .    1]" 1 
        169 1  17 LYS QG   1  20 PHE QD   . . 4.270 3.938 3.562 4.182     .  0  0 "[    .    1]" 1 
        170 1  18 ASN H    1  18 ASN HB2  . . 3.600 2.344 2.213 2.434     .  0  0 "[    .    1]" 1 
        171 1  18 ASN H    1  18 ASN QB   . . 3.050 2.238 2.161 2.286     .  0  0 "[    .    1]" 1 
        172 1  18 ASN H    1  18 ASN HB3  . . 3.600 2.864 2.738 3.026     .  0  0 "[    .    1]" 1 
        173 1  18 ASN H    1  19 GLU H    . . 3.290 2.343 2.284 2.375     .  0  0 "[    .    1]" 1 
        174 1  18 ASN H    1  19 GLU QG   . . 5.810 5.194 3.776 5.926 0.116  4  0 "[    .    1]" 1 
        175 1  18 ASN HA   1  20 PHE H    . . 5.000 4.667 4.582 4.835     .  0  0 "[    .    1]" 1 
        176 1  18 ASN HA   1  21 LYS HB2  . . 4.500 2.727 1.958 4.515 0.015  7  0 "[    .    1]" 1 
        177 1  18 ASN HA   1  21 LYS QB   . . 3.950 2.357 1.944 3.314     .  0  0 "[    .    1]" 1 
        178 1  18 ASN HA   1  21 LYS HB3  . . 4.500 3.343 3.307 3.410     .  0  0 "[    .    1]" 1 
        179 1  18 ASN QB   1  19 GLU H    . . 3.440 2.977 2.945 3.018     .  0  0 "[    .    1]" 1 
        180 1  18 ASN HB2  1  19 GLU H    . . 3.940 3.814 3.679 3.927     .  0  0 "[    .    1]" 1 
        181 1  18 ASN HB3  1  19 GLU H    . . 3.940 3.110 3.056 3.204     .  0  0 "[    .    1]" 1 
        182 1  19 GLU H    1  19 GLU QG   . . 4.000 3.418 2.376 3.919     .  0  0 "[    .    1]" 1 
        183 1  19 GLU H    1  20 PHE H    . . 3.540 2.642 2.394 2.752     .  0  0 "[    .    1]" 1 
        184 1  19 GLU H    1  20 PHE QD   . . 4.690 3.679 3.647 3.716     .  0  0 "[    .    1]" 1 
        185 1  19 GLU H    1  21 LYS H    . . 4.840 3.722 3.563 3.816     .  0  0 "[    .    1]" 1 
        186 1  19 GLU H    1  21 LYS QB   . . 4.940 4.352 4.126 4.868     .  0  0 "[    .    1]" 1 
        187 1  19 GLU HA   1  19 GLU HG2  . . 3.920 2.564 2.034 3.855     .  0  0 "[    .    1]" 1 
        188 1  19 GLU HA   1  19 GLU QG   . . 3.220 2.346 2.017 3.163     .  0  0 "[    .    1]" 1 
        189 1  19 GLU HA   1  19 GLU HG3  . . 3.920 3.238 2.654 3.643     .  0  0 "[    .    1]" 1 
        190 1  20 PHE H    1  20 PHE HB3  . . 3.570 2.394 2.170 2.515     .  0  0 "[    .    1]" 1 
        191 1  20 PHE H    1  20 PHE QD   . . 4.060 2.058 1.884 2.460     .  0  0 "[    .    1]" 1 
        192 1  20 PHE H    1  21 LYS H    . . 3.670 2.656 2.618 2.684     .  0  0 "[    .    1]" 1 
        193 1  20 PHE H    1  22 ALA H    . . 4.740 4.571 4.201 4.744 0.004  6  0 "[    .    1]" 1 
        194 1  20 PHE HA   1  20 PHE QD   . . 3.150 3.548 3.502 3.609 0.459  7  0 "[    .    1]" 1 
        195 1  20 PHE HA   1  23 ALA H    . . 4.300 3.305 2.902 3.901     .  0  0 "[    .    1]" 1 
        196 1  20 PHE HA   1  23 ALA MB   . . 4.030 3.060 2.274 3.771     .  0  0 "[    .    1]" 1 
        197 1  20 PHE HB2  1  23 ALA H    . . 5.850 4.955 4.258 5.749     .  0  0 "[    .    1]" 1 
        198 1  20 PHE HB2  1  23 ALA MB   . . 5.130 3.870 3.069 4.928     .  0  0 "[    .    1]" 1 
        199 1  20 PHE HB3  1  20 PHE QD   . . 3.320 2.744 2.711 2.759     .  0  0 "[    .    1]" 1 
        200 1  20 PHE HB3  1  21 LYS H    . . 4.360 4.246 3.919 4.407 0.047  5  0 "[    .    1]" 1 
        201 1  20 PHE QD   1  21 LYS H    . . 4.460 2.544 2.131 2.758     .  0  0 "[    .    1]" 1 
        202 1  20 PHE QD   1  21 LYS HA   . . 3.710 3.569 3.499 3.630     .  0  0 "[    .    1]" 1 
        203 1  20 PHE QD   1  21 LYS QB   . . 3.820 3.391 2.699 3.707     .  0  0 "[    .    1]" 1 
        204 1  20 PHE QD   1  21 LYS HG2  . . 4.220 3.908 3.844 4.025     .  0  0 "[    .    1]" 1 
        205 1  20 PHE QD   1  21 LYS QG   . . 3.530 3.597 3.564 3.669 0.139 10  0 "[    .    1]" 1 
        206 1  20 PHE QD   1  21 LYS HG3  . . 4.220 4.208 4.110 4.232 0.012  2  0 "[    .    1]" 1 
        207 1  20 PHE QD   1  78 LEU MD1  . . 3.750 3.219 2.584 3.634     .  0  0 "[    .    1]" 1 
        208 1  21 LYS H    1  21 LYS HB2  . . 3.670 2.571 2.108 3.644     .  0  0 "[    .    1]" 1 
        209 1  21 LYS H    1  21 LYS QB   . . 3.200 2.213 2.084 2.506     .  0  0 "[    .    1]" 1 
        210 1  21 LYS H    1  21 LYS HB3  . . 3.670 3.077 2.551 3.310     .  0  0 "[    .    1]" 1 
        211 1  21 LYS H    1  21 LYS QD   . . 5.190 4.556 4.191 4.773     .  0  0 "[    .    1]" 1 
        212 1  21 LYS H    1  21 LYS HG2  . . 4.830 3.608 3.122 3.878     .  0  0 "[    .    1]" 1 
        213 1  21 LYS H    1  21 LYS QG   . . 4.250 3.127 2.415 3.438     .  0  0 "[    .    1]" 1 
        214 1  21 LYS H    1  21 LYS HG3  . . 4.830 3.480 2.511 3.904     .  0  0 "[    .    1]" 1 
        215 1  21 LYS H    1  22 ALA H    . . 3.680 2.388 2.279 2.514     .  0  0 "[    .    1]" 1 
        216 1  21 LYS H    1  22 ALA MB   . . 4.970 4.043 3.916 4.179     .  0  0 "[    .    1]" 1 
        217 1  21 LYS HA   1  21 LYS QD   . . 4.440 3.397 3.126 3.788     .  0  0 "[    .    1]" 1 
        218 1  21 LYS HA   1  22 ALA MB   . . 5.130 4.914 4.798 4.983     .  0  0 "[    .    1]" 1 
        219 1  21 LYS HA   1  24 PHE H    . . 4.350 3.862 3.458 4.091     .  0  0 "[    .    1]" 1 
        220 1  21 LYS HA   1  24 PHE QB   . . 3.920 3.123 2.486 3.697     .  0  0 "[    .    1]" 1 
        221 1  21 LYS HA   1  25 ASP H    . . 5.360 4.779 3.859 5.496 0.136  5  0 "[    .    1]" 1 
        222 1  21 LYS QB   1  21 LYS QD   . . 3.330 2.050 1.964 2.126     .  0  0 "[    .    1]" 1 
        223 1  21 LYS QG   1  24 PHE H    . . 5.810 5.567 5.117 5.813 0.003  9  0 "[    .    1]" 1 
        224 1  22 ALA H    1  22 ALA MB   . . 3.010 2.260 2.101 2.392     .  0  0 "[    .    1]" 1 
        225 1  22 ALA H    1  23 ALA H    . . 3.340 2.319 1.935 2.818     .  0  0 "[    .    1]" 1 
        226 1  22 ALA H    1  23 ALA MB   . . 4.770 4.000 3.747 4.439     .  0  0 "[    .    1]" 1 
        227 1  22 ALA HA   1  25 ASP H    . . 4.330 3.677 3.093 4.098     .  0  0 "[    .    1]" 1 
        228 1  22 ALA HA   1  25 ASP QB   . . 3.810 3.160 2.639 3.724     .  0  0 "[    .    1]" 1 
        229 1  22 ALA MB   1  23 ALA H    . . 3.510 2.689 2.379 2.854     .  0  0 "[    .    1]" 1 
        230 1  23 ALA H    1  23 ALA MB   . . 3.180 2.156 2.036 2.263     .  0  0 "[    .    1]" 1 
        231 1  23 ALA H    1  24 PHE H    . . 3.670 2.545 2.426 2.693     .  0  0 "[    .    1]" 1 
        232 1  23 ALA H    1  24 PHE HA   . . 6.000 5.140 5.003 5.283     .  0  0 "[    .    1]" 1 
        233 1  23 ALA H    1  25 ASP H    . . 4.660 4.201 3.789 4.475     .  0  0 "[    .    1]" 1 
        234 1  23 ALA H    1  25 ASP QB   . . 5.400 5.069 4.450 5.326     .  0  0 "[    .    1]" 1 
        235 1  23 ALA HA   1  26 ILE H    . . 4.310 3.469 3.277 3.770     .  0  0 "[    .    1]" 1 
        236 1  23 ALA HA   1  26 ILE HB   . . 4.660 3.375 2.649 4.650     .  0  0 "[    .    1]" 1 
        237 1  23 ALA HA   1  26 ILE MD   . . 3.590 2.592 2.268 3.423     .  0  0 "[    .    1]" 1 
        238 1  23 ALA HA   1  26 ILE HG12 . . 5.020 4.672 2.918 5.024 0.004  2  0 "[    .    1]" 1 
        239 1  23 ALA HA   1  26 ILE HG13 . . 5.020 3.593 3.221 4.439     .  0  0 "[    .    1]" 1 
        240 1  23 ALA MB   1  24 PHE H    . . 3.660 2.783 2.242 2.992     .  0  0 "[    .    1]" 1 
        241 1  23 ALA MB   1  24 PHE HA   . . 4.960 3.821 3.748 3.897     .  0  0 "[    .    1]" 1 
        242 1  23 ALA MB   1  25 ASP H    . . 5.130 4.575 4.295 4.839     .  0  0 "[    .    1]" 1 
        243 1  24 PHE H    1  24 PHE HB2  . . 3.720 2.642 2.123 3.501     .  0  0 "[    .    1]" 1 
        244 1  24 PHE H    1  24 PHE HB3  . . 3.720 2.633 2.192 3.520     .  0  0 "[    .    1]" 1 
        245 1  24 PHE H    1  25 ASP H    . . 3.780 2.626 2.429 2.781     .  0  0 "[    .    1]" 1 
        246 1  24 PHE H    1  26 ILE H    . . 4.500 4.078 3.818 4.428     .  0  0 "[    .    1]" 1 
        247 1  24 PHE HA   1  25 ASP HA   . . 5.210 4.795 4.722 4.856     .  0  0 "[    .    1]" 1 
        248 1  24 PHE HA   1  26 ILE H    . . 4.330 4.112 3.815 4.354 0.024  5  0 "[    .    1]" 1 
        249 1  24 PHE HA   1  36 ILE MD   . . 5.020 4.578 3.389 5.024 0.004 10  0 "[    .    1]" 1 
        250 1  24 PHE QB   1  25 ASP H    . . 3.720 2.753 2.393 3.422     .  0  0 "[    .    1]" 1 
        251 1  25 ASP H    1  25 ASP HB2  . . 3.790 2.207 2.068 2.684     .  0  0 "[    .    1]" 1 
        252 1  25 ASP H    1  25 ASP QB   . . 3.130 2.126 2.047 2.296     .  0  0 "[    .    1]" 1 
        253 1  25 ASP H    1  25 ASP HB3  . . 3.790 3.110 2.385 3.561     .  0  0 "[    .    1]" 1 
        254 1  25 ASP H    1  26 ILE H    . . 3.860 2.627 2.433 2.746     .  0  0 "[    .    1]" 1 
        255 1  25 ASP H    1  26 ILE HB   . . 5.760 5.069 4.786 5.940 0.180 10  0 "[    .    1]" 1 
        256 1  25 ASP HA   1  26 ILE HA   . . 5.560 4.702 4.668 4.773     .  0  0 "[    .    1]" 1 
        257 1  25 ASP QB   1  26 ILE H    . . 3.730 2.834 2.651 2.949     .  0  0 "[    .    1]" 1 
        258 1  25 ASP HB2  1  26 ILE H    . . 4.330 3.455 3.002 4.168     .  0  0 "[    .    1]" 1 
        259 1  25 ASP HB3  1  26 ILE H    . . 4.330 3.090 2.813 3.715     .  0  0 "[    .    1]" 1 
        260 1  26 ILE H    1  26 ILE HB   . . 3.160 2.641 2.482 3.589 0.429 10  0 "[    .    1]" 1 
        261 1  26 ILE H    1  26 ILE MD   . . 3.810 3.539 3.405 3.828 0.018 10  0 "[    .    1]" 1 
        262 1  26 ILE H    1  26 ILE HG12 . . 3.830 3.476 2.812 3.669     .  0  0 "[    .    1]" 1 
        263 1  26 ILE H    1  26 ILE HG13 . . 3.830 2.385 2.083 3.985 0.155 10  0 "[    .    1]" 1 
        264 1  26 ILE H    1  26 ILE MG   . . 3.810 3.592 1.918 3.793     .  0  0 "[    .    1]" 1 
        265 1  26 ILE HA   1  26 ILE MD   . . 4.010 3.898 3.857 4.138 0.128 10  0 "[    .    1]" 1 
        266 1  26 ILE HA   1  26 ILE HG12 . . 3.750 2.746 2.607 3.707     .  0  0 "[    .    1]" 1 
        267 1  26 ILE HA   1  26 ILE HG13 . . 3.750 3.002 2.826 3.489     .  0  0 "[    .    1]" 1 
        268 1  26 ILE HA   1  26 ILE MG   . . 3.650 2.346 2.266 2.659     .  0  0 "[    .    1]" 1 
        269 1  26 ILE MD   1  26 ILE MG   . . 3.440 2.078 1.993 2.244     .  0  0 "[    .    1]" 1 
        270 1  26 ILE MG   1  27 PHE HA   . . 4.640 3.831 3.486 5.076 0.436 10  0 "[    .    1]" 1 
        271 1  27 PHE HA   1  27 PHE QE   . . 3.620 4.055 4.053 4.060 0.440  5  0 "[    .    1]" 1 
        272 1  27 PHE HA   1  29 LEU H    . . 5.110 3.757 3.547 3.925     .  0  0 "[    .    1]" 1 
        273 1  27 PHE QB   1  36 ILE MD   . . 4.180 2.864 2.062 4.293 0.113  5  0 "[    .    1]" 1 
        274 1  27 PHE QB   1  36 ILE MG   . . 5.500 3.967 2.362 5.510 0.010  5  0 "[    .    1]" 1 
        275 1  27 PHE HB2  1  36 ILE MD   . . 4.780 4.040 3.274 4.716     .  0  0 "[    .    1]" 1 
        276 1  27 PHE HB3  1  36 ILE MD   . . 4.780 2.975 2.084 4.939 0.159  5  0 "[    .    1]" 1 
        277 1  27 PHE QE   1  47 MET ME   . . 3.630 3.193 2.789 3.576     .  0  0 "[    .    1]" 1 
        278 1  28 VAL HA   1  31 ALA H    . . 4.090 2.928 2.754 3.217     .  0  0 "[    .    1]" 1 
        279 1  28 VAL HA   1  31 ALA MB   . . 3.920 2.659 2.068 3.353     .  0  0 "[    .    1]" 1 
        280 1  28 VAL HB   1  29 LEU H    . . 4.800 4.402 3.874 4.487     .  0  0 "[    .    1]" 1 
        281 1  28 VAL HB   1  31 ALA H    . . 4.840 3.549 3.182 4.573     .  0  0 "[    .    1]" 1 
        282 1  28 VAL HB   1  31 ALA MB   . . 3.780 2.357 2.017 3.827 0.047  5  0 "[    .    1]" 1 
        283 1  28 VAL HB   1  35 SER H    . . 5.260 4.809 4.383 5.391 0.131  5  0 "[    .    1]" 1 
        284 1  28 VAL HB   1  36 ILE MG   . . 3.440 3.282 2.757 3.458 0.018  2  0 "[    .    1]" 1 
        285 1  28 VAL MG1  1  29 LEU H    . . 4.940 4.287 4.268 4.355     .  0  0 "[    .    1]" 1 
        286 1  28 VAL MG1  1  31 ALA H    . . 4.810 4.226 2.702 4.561     .  0  0 "[    .    1]" 1 
        287 1  28 VAL MG1  1  35 SER H    . . 5.540 4.261 3.356 5.015     .  0  0 "[    .    1]" 1 
        288 1  28 VAL MG2  1  29 LEU H    . . 4.940 3.481 3.333 4.043     .  0  0 "[    .    1]" 1 
        289 1  28 VAL MG2  1  31 ALA H    . . 4.810 4.339 3.950 4.851 0.041  5  0 "[    .    1]" 1 
        290 1  28 VAL MG2  1  35 SER H    . . 5.540 5.462 5.185 5.733 0.193  5  0 "[    .    1]" 1 
        291 1  29 LEU H    1  29 LEU HB2  . . 3.970 2.537 2.243 3.490     .  0  0 "[    .    1]" 1 
        292 1  29 LEU H    1  29 LEU QB   . . 3.470 2.205 2.156 2.232     .  0  0 "[    .    1]" 1 
        293 1  29 LEU H    1  29 LEU HB3  . . 3.970 2.547 2.176 2.801     .  0  0 "[    .    1]" 1 
        294 1  29 LEU H    1  30 GLY H    . . 4.700 2.762 2.726 2.827     .  0  0 "[    .    1]" 1 
        295 1  29 LEU HA   1  29 LEU HG   . . 3.950 2.797 2.402 3.595     .  0  0 "[    .    1]" 1 
        296 1  29 LEU QB   1  31 ALA H    . . 5.110 4.736 4.491 5.206 0.096  5  0 "[    .    1]" 1 
        297 1  29 LEU HG   1  30 GLY H    . . 5.750 4.202 2.869 4.816     .  0  0 "[    .    1]" 1 
        298 1  30 GLY H    1  31 ALA H    . . 3.820 2.302 2.144 2.566     .  0  0 "[    .    1]" 1 
        299 1  30 GLY QA   1  31 ALA MB   . . 4.730 4.120 4.023 4.201     .  0  0 "[    .    1]" 1 
        300 1  31 ALA H    1  31 ALA MB   . . 3.170 2.174 2.047 2.377     .  0  0 "[    .    1]" 1 
        301 1  31 ALA H    1  32 GLU H    . . 4.860 4.417 4.020 4.573     .  0  0 "[    .    1]" 1 
        302 1  31 ALA HA   1  32 GLU QB   . . 4.880 4.446 4.263 4.818     .  0  0 "[    .    1]" 1 
        303 1  31 ALA HA   1  32 GLU QG   . . 4.410 3.925 3.707 4.413 0.003  5  0 "[    .    1]" 1 
        304 1  31 ALA MB   1  32 GLU H    . . 4.460 3.130 1.899 3.594     .  0  0 "[    .    1]" 1 
        305 1  31 ALA MB   1  32 GLU QG   . . 5.000 4.402 2.667 4.835     .  0  0 "[    .    1]" 1 
        306 1  31 ALA MB   1  33 ASP H    . . 4.030 3.314 2.858 3.494     .  0  0 "[    .    1]" 1 
        307 1  31 ALA MB   1  34 GLY H    . . 4.070 2.562 2.183 2.941     .  0  0 "[    .    1]" 1 
        308 1  31 ALA MB   1  34 GLY QA   . . 4.010 2.854 2.085 3.446     .  0  0 "[    .    1]" 1 
        309 1  31 ALA MB   1  35 SER H    . . 3.790 2.747 1.918 3.823 0.033  5  0 "[    .    1]" 1 
        310 1  31 ALA MB   1  35 SER QB   . . 4.910 4.093 3.165 4.829     .  0  0 "[    .    1]" 1 
        311 1  32 GLU H    1  32 GLU QB   . . 3.630 2.503 2.311 2.644     .  0  0 "[    .    1]" 1 
        312 1  32 GLU H    1  32 GLU QG   . . 4.650 2.283 1.932 2.747     .  0  0 "[    .    1]" 1 
        313 1  32 GLU H    1  33 ASP H    . . 4.160 2.382 2.198 2.853     .  0  0 "[    .    1]" 1 
        314 1  32 GLU QB   1  33 ASP H    . . 3.780 3.226 2.709 3.602     .  0  0 "[    .    1]" 1 
        315 1  32 GLU QG   1  33 ASP H    . . 4.760 3.008 1.958 4.271     .  0  0 "[    .    1]" 1 
        316 1  33 ASP H    1  33 ASP HB2  . . 4.120 2.304 2.099 2.639     .  0  0 "[    .    1]" 1 
        317 1  33 ASP H    1  33 ASP QB   . . 3.590 2.252 2.073 2.439     .  0  0 "[    .    1]" 1 
        318 1  33 ASP H    1  33 ASP HB3  . . 4.120 3.336 2.869 3.601     .  0  0 "[    .    1]" 1 
        319 1  33 ASP H    1  34 GLY H    . . 3.710 2.431 1.975 2.637     .  0  0 "[    .    1]" 1 
        320 1  33 ASP H    1  34 GLY QA   . . 4.760 4.312 3.929 4.424     .  0  0 "[    .    1]" 1 
        321 1  33 ASP H    1  35 SER H    . . 4.310 3.725 3.079 4.003     .  0  0 "[    .    1]" 1 
        322 1  34 GLY H    1  35 SER H    . . 3.550 2.571 2.447 2.749     .  0  0 "[    .    1]" 1 
        323 1  34 GLY QA   1  35 SER H    . . 3.050 2.824 2.778 2.876     .  0  0 "[    .    1]" 1 
        324 1  34 GLY QA   1  36 ILE MG   . . 4.210 3.724 3.094 4.195     .  0  0 "[    .    1]" 1 
        325 1  35 SER H    1  35 SER QB   . . 3.410 2.572 2.054 3.012     .  0  0 "[    .    1]" 1 
        326 1  35 SER H    1  36 ILE MG   . . 5.260 4.017 3.532 4.972     .  0  0 "[    .    1]" 1 
        327 1  35 SER QB   1  36 ILE MG   . . 5.180 4.561 4.161 5.080     .  0  0 "[    .    1]" 1 
        328 1  35 SER QB   1  72 VAL H    . . 4.730 3.879 1.929 4.698     .  0  0 "[    .    1]" 1 
        329 1  36 ILE H    1  36 ILE MD   . . 5.120 4.220 3.528 4.997     .  0  0 "[    .    1]" 1 
        330 1  36 ILE H    1  36 ILE HG12 . . 4.990 3.678 2.952 4.675     .  0  0 "[    .    1]" 1 
        331 1  36 ILE H    1  36 ILE HG13 . . 4.990 3.255 2.066 4.833     .  0  0 "[    .    1]" 1 
        332 1  36 ILE H    1  36 ILE MG   . . 4.730 2.999 2.414 3.405     .  0  0 "[    .    1]" 1 
        333 1  36 ILE H    1  72 VAL H    . . 4.410 4.134 3.111 4.440 0.030  5  0 "[    .    1]" 1 
        334 1  36 ILE H    1  72 VAL HB   . . 5.140 4.322 3.628 5.155 0.015  5  0 "[    .    1]" 1 
        335 1  36 ILE HA   1  36 ILE MD   . . 4.660 3.879 2.984 4.125     .  0  0 "[    .    1]" 1 
        336 1  38 THR HA   1  38 THR MG   . . 3.370 2.356 1.967 3.208     .  0  0 "[    .    1]" 1 
        337 1  38 THR HA   1  40 GLU H    . . 5.480 4.899 3.760 5.803 0.323  4  0 "[    .    1]" 1 
        338 1  39 LYS H    1  39 LYS QB   . . 3.450 2.548 2.042 3.327     .  0  0 "[    .    1]" 1 
        339 1  39 LYS H    1  39 LYS QG   . . 4.320 3.304 2.110 4.289     .  0  0 "[    .    1]" 1 
        340 1  39 LYS H    1  40 GLU H    . . 4.360 3.817 2.700 4.537 0.177  4  0 "[    .    1]" 1 
        341 1  39 LYS QB   1  39 LYS QG   . . 2.370 2.057 2.015 2.087     .  0  0 "[    .    1]" 1 
        342 1  39 LYS QB   1  40 GLU H    . . 4.440 3.279 1.707 4.017     .  0  0 "[    .    1]" 1 
        343 1  39 LYS QB   1  42 GLY H    . . 5.400 3.730 2.581 5.332     .  0  0 "[    .    1]" 1 
        344 1  40 GLU H    1  40 GLU QG   . . 3.700 2.423 1.807 3.830 0.130  1  0 "[    .    1]" 1 
        345 1  40 GLU H    1  41 LEU HA   . . 5.370 5.082 4.797 5.324     .  0  0 "[    .    1]" 1 
        346 1  40 GLU H    1  41 LEU QB   . . 4.550 4.412 4.156 4.550     .  6  0 "[    .    1]" 1 
        347 1  40 GLU H    1  41 LEU MD1  . . 6.000 4.524 2.695 5.607     .  0  0 "[    .    1]" 1 
        348 1  40 GLU H    1  41 LEU MD2  . . 6.000 5.385 3.494 6.004 0.004  9  0 "[    .    1]" 1 
        349 1  40 GLU H    1  42 GLY H    . . 5.020 4.012 3.310 4.716     .  0  0 "[    .    1]" 1 
        350 1  40 GLU QG   1  41 LEU QB   . . 4.080 3.555 2.754 4.088 0.008  9  0 "[    .    1]" 1 
        351 1  40 GLU QG   1  41 LEU HG   . . 4.230 3.329 2.358 4.363 0.133  4  0 "[    .    1]" 1 
        352 1  41 LEU H    1  41 LEU QB   . . 3.360 2.327 2.082 2.596     .  0  0 "[    .    1]" 1 
        353 1  41 LEU H    1  41 LEU MD1  . . 5.080 3.050 1.790 3.754     .  0  0 "[    .    1]" 1 
        354 1  41 LEU H    1  41 LEU MD2  . . 5.080 3.699 2.604 4.122     .  0  0 "[    .    1]" 1 
        355 1  41 LEU H    1  42 GLY H    . . 4.150 2.673 2.550 2.805     .  0  0 "[    .    1]" 1 
        356 1  41 LEU H    1  43 LYS H    . . 4.580 4.077 3.746 4.565     .  0  0 "[    .    1]" 1 
        357 1  41 LEU HA   1  44 VAL H    . . 4.230 3.817 3.440 4.066     .  0  0 "[    .    1]" 1 
        358 1  41 LEU QB   1  42 GLY H    . . 3.950 2.872 2.262 3.765     .  0  0 "[    .    1]" 1 
        359 1  41 LEU QB   1  42 GLY QA   . . 5.610 3.736 3.449 4.365     .  0  0 "[    .    1]" 1 
        360 1  42 GLY H    1  43 LYS H    . . 3.740 2.570 2.482 2.757     .  0  0 "[    .    1]" 1 
        361 1  42 GLY H    1  43 LYS QB   . . 5.810 4.353 4.143 4.587     .  0  0 "[    .    1]" 1 
        362 1  42 GLY QA   1  43 LYS HA   . . 4.340 4.053 4.003 4.085     .  0  0 "[    .    1]" 1 
        363 1  42 GLY QA   1  43 LYS QB   . . 5.550 4.363 4.268 4.616     .  0  0 "[    .    1]" 1 
        364 1  42 GLY QA   1  43 LYS QD   . . 5.610 5.341 4.773 5.753 0.143  9  0 "[    .    1]" 1 
        365 1  42 GLY QA   1  44 VAL H    . . 4.570 3.913 3.492 4.354     .  0  0 "[    .    1]" 1 
        366 1  42 GLY QA   1  45 MET H    . . 4.380 3.472 3.091 3.710     .  0  0 "[    .    1]" 1 
        367 1  42 GLY QA   1  45 MET QB   . . 4.510 3.240 2.002 3.943     .  0  0 "[    .    1]" 1 
        368 1  43 LYS H    1  43 LYS QB   . . 3.020 2.209 2.037 2.417     .  0  0 "[    .    1]" 1 
        369 1  43 LYS H    1  43 LYS QD   . . 4.520 3.936 3.395 4.283     .  0  0 "[    .    1]" 1 
        370 1  43 LYS H    1  44 VAL H    . . 3.520 2.667 2.540 2.845     .  0  0 "[    .    1]" 1 
        371 1  43 LYS H    1  45 MET H    . . 4.700 4.157 3.694 4.632     .  0  0 "[    .    1]" 1 
        372 1  43 LYS H    1  46 ARG H    . . 5.270 4.987 4.601 5.272 0.002 10  0 "[    .    1]" 1 
        373 1  43 LYS HA   1  43 LYS QD   . . 4.140 2.752 2.065 3.861     .  0  0 "[    .    1]" 1 
        374 1  43 LYS HA   1  46 ARG H    . . 4.270 3.416 3.067 4.023     .  0  0 "[    .    1]" 1 
        375 1  43 LYS HA   1  46 ARG QD   . . 4.650 4.135 3.158 4.651 0.001  5  0 "[    .    1]" 1 
        376 1  43 LYS HA   1  47 MET H    . . 5.020 4.420 3.847 4.981     .  0  0 "[    .    1]" 1 
        377 1  43 LYS QD   1  44 VAL H    . . 5.090 4.193 2.317 4.967     .  0  0 "[    .    1]" 1 
        378 1  44 VAL H    1  44 VAL HB   . . 3.630 2.873 2.435 3.632 0.002  9  0 "[    .    1]" 1 
        379 1  44 VAL H    1  45 MET H    . . 3.560 2.668 2.499 2.863     .  0  0 "[    .    1]" 1 
        380 1  44 VAL H    1  45 MET QG   . . 4.860 4.386 4.048 4.637     .  0  0 "[    .    1]" 1 
        381 1  44 VAL H    1  46 ARG H    . . 4.560 4.234 3.810 4.471     .  0  0 "[    .    1]" 1 
        382 1  44 VAL H    1  47 MET ME   . . 5.020 4.706 4.417 5.126 0.106  5  0 "[    .    1]" 1 
        383 1  44 VAL HA   1  44 VAL MG1  . . 3.610 2.683 2.293 3.203     .  0  0 "[    .    1]" 1 
        384 1  44 VAL HA   1  44 VAL MG2  . . 3.610 2.578 2.184 3.203     .  0  0 "[    .    1]" 1 
        385 1  44 VAL HA   1  46 ARG H    . . 4.800 4.372 4.059 4.595     .  0  0 "[    .    1]" 1 
        386 1  44 VAL HA   1  47 MET H    . . 4.240 3.509 3.354 3.795     .  0  0 "[    .    1]" 1 
        387 1  44 VAL HA   1  47 MET QB   . . 3.970 2.783 2.215 3.600     .  0  0 "[    .    1]" 1 
        388 1  44 VAL HA   1  47 MET ME   . . 4.450 3.504 2.385 4.448     .  0  0 "[    .    1]" 1 
        389 1  44 VAL HB   1  45 MET H    . . 3.980 3.543 2.405 3.984 0.004  4  0 "[    .    1]" 1 
        390 1  44 VAL MG1  1  45 MET H    . . 4.540 3.122 2.067 4.031     .  0  0 "[    .    1]" 1 
        391 1  44 VAL MG2  1  45 MET H    . . 4.540 3.292 1.883 3.873     .  0  0 "[    .    1]" 1 
        392 1  45 MET H    1  45 MET QB   . . 3.470 2.367 2.216 2.510     .  0  0 "[    .    1]" 1 
        393 1  45 MET H    1  45 MET QG   . . 3.310 2.434 2.140 2.764     .  0  0 "[    .    1]" 1 
        394 1  45 MET H    1  46 ARG H    . . 3.660 2.587 2.436 2.831     .  0  0 "[    .    1]" 1 
        395 1  45 MET HA   1  45 MET QG   . . 3.700 2.760 2.312 3.418     .  0  0 "[    .    1]" 1 
        396 1  45 MET HA   1  48 LEU H    . . 4.510 3.774 3.380 4.078     .  0  0 "[    .    1]" 1 
        397 1  45 MET QG   1  46 ARG H    . . 4.940 3.734 2.091 4.255     .  0  0 "[    .    1]" 1 
        398 1  46 ARG H    1  46 ARG QB   . . 3.060 2.211 2.074 2.474     .  0  0 "[    .    1]" 1 
        399 1  46 ARG H    1  47 MET QB   . . 5.420 4.382 4.109 4.871     .  0  0 "[    .    1]" 1 
        400 1  46 ARG H    1  48 LEU H    . . 5.030 4.170 3.820 4.666     .  0  0 "[    .    1]" 1 
        401 1  46 ARG QB   1  46 ARG QD   . . 3.030 2.109 1.965 2.303     .  0  0 "[    .    1]" 1 
        402 1  46 ARG QB   1  47 MET H    . . 3.450 2.769 2.533 2.963     .  0  0 "[    .    1]" 1 
        403 1  47 MET H    1  47 MET QB   . . 3.080 2.222 2.045 2.566     .  0  0 "[    .    1]" 1 
        404 1  47 MET H    1  47 MET QG   . . 3.930 3.122 2.139 3.931 0.001  2  0 "[    .    1]" 1 
        405 1  47 MET H    1  48 LEU H    . . 3.420 2.688 2.534 2.923     .  0  0 "[    .    1]" 1 
        406 1  47 MET HA   1  47 MET QG   . . 3.720 2.288 2.002 2.433     .  0  0 "[    .    1]" 1 
        407 1  47 MET QB   1  47 MET QG   . . 2.360 2.045 1.991 2.085     .  0  0 "[    .    1]" 1 
        408 1  47 MET QB   1  48 LEU H    . . 3.990 2.808 2.351 3.007     .  0  0 "[    .    1]" 1 
        409 1  47 MET QB   1  48 LEU HG   . . 3.770 3.201 2.416 4.068 0.298  4  0 "[    .    1]" 1 
        410 1  48 LEU H    1  48 LEU QB   . . 3.690 2.464 2.186 2.664     .  0  0 "[    .    1]" 1 
        411 1  48 LEU H    1  48 LEU MD1  . . 4.390 3.412 2.881 3.891     .  0  0 "[    .    1]" 1 
        412 1  48 LEU H    1  48 LEU MD2  . . 4.390 3.612 1.885 3.984     .  0  0 "[    .    1]" 1 
        413 1  48 LEU H    1  48 LEU HG   . . 4.310 2.767 2.075 4.142     .  0  0 "[    .    1]" 1 
        414 1  48 LEU H    1  49 GLY H    . . 3.390 2.515 2.049 2.839     .  0  0 "[    .    1]" 1 
        415 1  48 LEU HA   1  48 LEU MD1  . . 4.270 3.710 1.986 3.967     .  0  0 "[    .    1]" 1 
        416 1  48 LEU HA   1  48 LEU MD2  . . 4.270 2.472 2.029 3.481     .  0  0 "[    .    1]" 1 
        417 1  48 LEU HA   1  49 GLY QA   . . 4.750 4.181 4.048 4.336     .  0  0 "[    .    1]" 1 
        418 1  48 LEU QB   1  49 GLY H    . . 3.900 3.378 3.019 3.761     .  0  0 "[    .    1]" 1 
        419 1  48 LEU QB   1  50 GLN H    . . 3.720 3.390 2.638 3.721 0.001  8  0 "[    .    1]" 1 
        420 1  49 GLY H    1  50 GLN H    . . 3.250 2.597 2.360 2.837     .  0  0 "[    .    1]" 1 
        421 1  49 GLY H    1  50 GLN QG   . . 4.940 4.037 3.642 4.485     .  0  0 "[    .    1]" 1 
        422 1  50 GLN H    1  50 GLN QG   . . 3.230 2.444 2.158 2.730     .  0  0 "[    .    1]" 1 
        423 1  50 GLN HA   1  50 GLN QG   . . 3.540 2.713 2.441 3.353     .  0  0 "[    .    1]" 1 
        424 1  50 GLN QG   1  51 ASN H    . . 4.460 3.955 2.906 4.459     .  0  0 "[    .    1]" 1 
        425 1  51 ASN H    1  52 PRO QD   . . 4.900 4.343 4.326 4.370     .  0  0 "[    .    1]" 1 
        426 1  51 ASN HA   1  52 PRO QG   . . 5.000 4.073 4.071 4.077     .  0  0 "[    .    1]" 1 
        427 1  52 PRO HA   1  53 THR H    . . 2.980 2.244 2.156 2.431     .  0  0 "[    .    1]" 1 
        428 1  52 PRO HA   1  54 PRO HG2  . . 4.920 4.645 4.550 4.812     .  0  0 "[    .    1]" 1 
        429 1  53 THR H    1  53 THR MG   . . 3.830 3.815 3.814 3.816     .  0  0 "[    .    1]" 1 
        430 1  53 THR H    1  54 PRO QD   . . 4.230 1.862 1.860 1.862     .  0  0 "[    .    1]" 1 
        431 1  53 THR H    1  54 PRO HG2  . . 3.690 3.624 3.623 3.626     .  0  0 "[    .    1]" 1 
        432 1  53 THR H    1  56 GLU H    . . 4.680 4.251 3.869 4.524     .  0  0 "[    .    1]" 1 
        433 1  53 THR HB   1  54 PRO QD   . . 3.330 1.870 1.869 1.870     .  0  0 "[    .    1]" 1 
        434 1  53 THR MG   1  54 PRO QD   . . 3.420 1.949 1.948 1.950     .  0  0 "[    .    1]" 1 
        435 1  53 THR MG   1  54 PRO HG3  . . 3.850 3.753 3.752 3.754     .  0  0 "[    .    1]" 1 
        436 1  53 THR MG   1  55 GLU H    . . 4.450 4.193 4.138 4.277     .  0  0 "[    .    1]" 1 
        437 1  53 THR MG   1  56 GLU H    . . 4.970 4.715 4.658 4.843     .  0  0 "[    .    1]" 1 
        438 1  53 THR MG   1  56 GLU QB   . . 5.290 4.830 4.605 5.121     .  0  0 "[    .    1]" 1 
        439 1  54 PRO HA   1  56 GLU H    . . 4.920 3.824 3.650 4.026     .  0  0 "[    .    1]" 1 
        440 1  54 PRO HA   1  57 LEU H    . . 4.780 3.191 2.970 3.664     .  0  0 "[    .    1]" 1 
        441 1  54 PRO HA   1  57 LEU QB   . . 5.060 3.337 2.423 4.626     .  0  0 "[    .    1]" 1 
        442 1  54 PRO HA   1  57 LEU HG   . . 5.520 2.412 2.007 3.040     .  0  0 "[    .    1]" 1 
        443 1  54 PRO QB   1  55 GLU H    . . 3.710 3.502 3.366 3.587     .  0  0 "[    .    1]" 1 
        444 1  54 PRO HG2  1  55 GLU H    . . 3.120 2.877 2.627 3.042     .  0  0 "[    .    1]" 1 
        445 1  55 GLU H    1  55 GLU QG   . . 3.420 2.486 1.979 3.397     .  0  0 "[    .    1]" 1 
        446 1  55 GLU H    1  56 GLU H    . . 3.350 2.700 2.590 2.770     .  0  0 "[    .    1]" 1 
        447 1  55 GLU H    1  57 LEU H    . . 4.620 4.164 3.998 4.424     .  0  0 "[    .    1]" 1 
        448 1  56 GLU H    1  56 GLU QB   . . 3.270 2.485 2.400 2.555     .  0  0 "[    .    1]" 1 
        449 1  56 GLU H    1  56 GLU QG   . . 2.960 2.261 2.084 2.431     .  0  0 "[    .    1]" 1 
        450 1  56 GLU H    1  57 LEU H    . . 3.540 2.517 2.399 2.745     .  0  0 "[    .    1]" 1 
        451 1  56 GLU H    1  57 LEU MD1  . . 6.000 4.921 4.593 5.092     .  0  0 "[    .    1]" 1 
        452 1  56 GLU H    1  57 LEU MD2  . . 6.000 4.910 3.384 5.474     .  0  0 "[    .    1]" 1 
        453 1  56 GLU H    1  57 LEU HG   . . 4.270 4.003 3.775 4.268     .  0  0 "[    .    1]" 1 
        454 1  56 GLU HA   1  56 GLU QG   . . 3.330 2.795 2.442 3.330     .  0  0 "[    .    1]" 1 
        455 1  56 GLU QB   1  56 GLU QG   . . 2.330 2.037 1.967 2.082     .  0  0 "[    .    1]" 1 
        456 1  56 GLU QB   1  57 LEU H    . . 3.920 2.883 2.359 3.539     .  0  0 "[    .    1]" 1 
        457 1  56 GLU QG   1  57 LEU H    . . 4.130 3.645 2.226 4.131 0.001  1  0 "[    .    1]" 1 
        458 1  57 LEU H    1  57 LEU HB2  . . 3.740 2.624 2.404 3.473     .  0  0 "[    .    1]" 1 
        459 1  57 LEU H    1  57 LEU QB   . . 3.280 2.518 2.369 2.865     .  0  0 "[    .    1]" 1 
        460 1  57 LEU H    1  57 LEU HB3  . . 3.740 3.530 3.052 3.591     .  0  0 "[    .    1]" 1 
        461 1  57 LEU H    1  57 LEU MD1  . . 4.940 3.482 3.208 3.649     .  0  0 "[    .    1]" 1 
        462 1  57 LEU H    1  57 LEU MD2  . . 4.940 3.228 2.057 3.668     .  0  0 "[    .    1]" 1 
        463 1  57 LEU H    1  57 LEU HG   . . 4.030 2.153 1.916 2.431     .  0  0 "[    .    1]" 1 
        464 1  57 LEU H    1  58 GLN HB2  . . 6.000 4.685 4.287 5.162     .  0  0 "[    .    1]" 1 
        465 1  57 LEU H    1  58 GLN HB3  . . 6.000 5.344 4.950 5.790     .  0  0 "[    .    1]" 1 
        466 1  57 LEU HA   1  57 LEU MD2  . . 3.120 2.377 2.039 3.266 0.146  3  0 "[    .    1]" 1 
        467 1  57 LEU HA   1  57 LEU HG   . . 3.660 3.106 2.901 3.648     .  0  0 "[    .    1]" 1 
        468 1  57 LEU HA   1  61 ILE MD   . . 6.000 5.493 4.890 5.933     .  0  0 "[    .    1]" 1 
        469 1  57 LEU QB   1  58 GLN H    . . 3.930 2.880 2.688 3.400     .  0  0 "[    .    1]" 1 
        470 1  57 LEU QB   1  58 GLN HA   . . 4.280 3.921 3.881 4.064     .  0  0 "[    .    1]" 1 
        471 1  57 LEU MD1  1  58 GLN H    . . 5.710 4.522 3.739 4.799     .  0  0 "[    .    1]" 1 
        472 1  57 LEU MD2  1  58 GLN H    . . 5.710 4.684 3.837 4.906     .  0  0 "[    .    1]" 1 
        473 1  58 GLN H    1  58 GLN HB2  . . 3.460 2.272 2.064 2.553     .  0  0 "[    .    1]" 1 
        474 1  58 GLN H    1  58 GLN QB   . . 3.000 2.158 2.043 2.250     .  0  0 "[    .    1]" 1 
        475 1  58 GLN H    1  58 GLN HB3  . . 3.460 2.892 2.492 3.411     .  0  0 "[    .    1]" 1 
        476 1  58 GLN H    1  58 GLN QG   . . 4.640 3.746 3.091 3.995     .  0  0 "[    .    1]" 1 
        477 1  58 GLN H    1  59 GLU H    . . 3.540 2.709 2.493 2.781     .  0  0 "[    .    1]" 1 
        478 1  58 GLN H    1  61 ILE MD   . . 4.610 4.280 4.044 4.611 0.001  4  0 "[    .    1]" 1 
        479 1  58 GLN HA   1  58 GLN QG   . . 3.560 2.308 2.195 2.530     .  0  0 "[    .    1]" 1 
        480 1  58 GLN HA   1  61 ILE HB   . . 4.840 4.759 4.705 4.847 0.007  4  0 "[    .    1]" 1 
        481 1  58 GLN HA   1  61 ILE MD   . . 3.500 2.137 1.975 2.303     .  0  0 "[    .    1]" 1 
        482 1  58 GLN HA   1  61 ILE MG   . . 4.510 3.335 3.137 3.530     .  0  0 "[    .    1]" 1 
        483 1  58 GLN QB   1  58 GLN QG   . . 2.290 2.071 2.027 2.086     .  0  0 "[    .    1]" 1 
        484 1  58 GLN QB   1  59 GLU H    . . 3.130 2.804 2.665 2.926     .  0  0 "[    .    1]" 1 
        485 1  58 GLN QB   1  61 ILE MD   . . 4.430 3.608 3.441 3.770     .  0  0 "[    .    1]" 1 
        486 1  59 GLU H    1  59 GLU HG2  . . 4.230 3.241 2.439 3.944     .  0  0 "[    .    1]" 1 
        487 1  59 GLU H    1  59 GLU QG   . . 3.480 2.751 2.103 3.260     .  0  0 "[    .    1]" 1 
        488 1  59 GLU H    1  59 GLU HG3  . . 4.230 3.186 2.157 3.850     .  0  0 "[    .    1]" 1 
        489 1  59 GLU H    1  60 MET H    . . 3.720 2.502 2.449 2.614     .  0  0 "[    .    1]" 1 
        490 1  59 GLU H    1  61 ILE MD   . . 6.000 5.003 4.891 5.154     .  0  0 "[    .    1]" 1 
        491 1  59 GLU H    1  62 ASP H    . . 5.060 4.764 4.404 4.963     .  0  0 "[    .    1]" 1 
        492 1  59 GLU HA   1  59 GLU QG   . . 3.460 2.379 2.095 3.326     .  0  0 "[    .    1]" 1 
        493 1  59 GLU HA   1  61 ILE MD   . . 6.000 5.506 5.356 5.692     .  0  0 "[    .    1]" 1 
        494 1  59 GLU QG   1  60 MET H    . . 5.060 4.040 2.032 4.533     .  0  0 "[    .    1]" 1 
        495 1  60 MET H    1  61 ILE MG   . . 4.610 4.153 3.996 4.450     .  0  0 "[    .    1]" 1 
        496 1  60 MET H    1  62 ASP H    . . 3.850 3.808 3.765 3.880 0.030  1  0 "[    .    1]" 1 
        497 1  60 MET HA   1  63 GLU H    . . 4.090 3.921 3.784 4.091 0.001  1  0 "[    .    1]" 1 
        498 1  61 ILE HA   1  61 ILE MD   . . 4.220 4.170 4.151 4.180     .  0  0 "[    .    1]" 1 
        499 1  61 ILE HA   1  61 ILE MG   . . 3.250 2.330 2.209 2.409     .  0  0 "[    .    1]" 1 
        500 1  61 ILE HA   1  64 VAL HB   . . 4.800 2.941 2.008 4.641     .  0  0 "[    .    1]" 1 
        501 1  61 ILE HB   1  62 ASP H    . . 4.050 3.995 3.908 4.061 0.011  1  0 "[    .    1]" 1 
        502 1  61 ILE MD   1  62 ASP H    . . 4.130 4.059 4.030 4.101     .  0  0 "[    .    1]" 1 
        503 1  61 ILE MG   1  62 ASP H    . . 4.070 3.984 3.918 4.048     .  0  0 "[    .    1]" 1 
        504 1  62 ASP H    1  62 ASP QB   . . 3.470 2.127 2.046 2.275     .  0  0 "[    .    1]" 1 
        505 1  62 ASP H    1  63 GLU H    . . 3.530 2.727 2.467 2.781     .  0  0 "[    .    1]" 1 
        506 1  62 ASP QB   1  63 GLU QB   . . 4.450 3.890 3.504 4.315     .  0  0 "[    .    1]" 1 
        507 1  63 GLU H    1  63 GLU QB   . . 3.010 2.781 2.499 3.011 0.001  8  0 "[    .    1]" 1 
        508 1  63 GLU H    1  63 GLU HG2  . . 3.730 3.122 2.219 3.721     .  0  0 "[    .    1]" 1 
        509 1  63 GLU H    1  63 GLU HG3  . . 3.730 2.923 2.193 3.731 0.001  1  0 "[    .    1]" 1 
        510 1  63 GLU H    1  64 VAL H    . . 3.540 2.999 2.641 3.543 0.003  9  0 "[    .    1]" 1 
        511 1  63 GLU HA   1  65 ASP H    . . 5.100 3.870 3.146 4.531     .  0  0 "[    .    1]" 1 
        512 1  65 ASP H    1  65 ASP QB   . . 3.390 2.218 2.049 2.721     .  0  0 "[    .    1]" 1 
        513 1  65 ASP HA   1  66 GLU H    . . 3.230 2.198 2.142 2.354     .  0  0 "[    .    1]" 1 
        514 1  65 ASP HA   1  66 GLU QB   . . 4.710 4.294 4.076 4.556     .  0  0 "[    .    1]" 1 
        515 1  65 ASP HA   1  67 ASP H    . . 4.280 3.547 3.120 3.916     .  0  0 "[    .    1]" 1 
        516 1  66 GLU H    1  66 GLU QB   . . 3.100 2.321 2.131 2.518     .  0  0 "[    .    1]" 1 
        517 1  66 GLU H    1  66 GLU QG   . . 4.240 2.984 2.104 4.052     .  0  0 "[    .    1]" 1 
        518 1  66 GLU H    1  67 ASP H    . . 3.420 2.510 2.268 2.681     .  0  0 "[    .    1]" 1 
        519 1  66 GLU QB   1  67 ASP H    . . 3.450 2.829 2.642 3.074     .  0  0 "[    .    1]" 1 
        520 1  66 GLU QB   1  67 ASP QB   . . 4.230 4.046 3.878 4.230     .  0  0 "[    .    1]" 1 
        521 1  66 GLU QB   1  68 GLY H    . . 4.720 4.448 4.395 4.641     .  0  0 "[    .    1]" 1 
        522 1  66 GLU QG   1  67 ASP H    . . 4.360 4.199 3.905 4.353     .  0  0 "[    .    1]" 1 
        523 1  67 ASP H    1  67 ASP HB2  . . 3.960 3.415 2.628 3.703     .  0  0 "[    .    1]" 1 
        524 1  67 ASP H    1  67 ASP QB   . . 3.400 2.569 2.253 2.780     .  0  0 "[    .    1]" 1 
        525 1  67 ASP H    1  67 ASP HB3  . . 3.960 2.672 2.385 2.873     .  0  0 "[    .    1]" 1 
        526 1  67 ASP H    1  68 GLY QA   . . 4.870 4.365 4.065 4.445     .  0  0 "[    .    1]" 1 
        527 1  67 ASP H    1  69 SER H    . . 4.600 4.310 3.842 4.585     .  0  0 "[    .    1]" 1 
        528 1  68 GLY H    1  69 SER H    . . 3.550 2.847 2.712 2.947     .  0  0 "[    .    1]" 1 
        529 1  68 GLY H    1  70 GLY H    . . 4.840 4.448 4.014 4.800     .  0  0 "[    .    1]" 1 
        530 1  68 GLY QA   1  70 GLY H    . . 4.340 3.818 3.561 4.365 0.025  5  0 "[    .    1]" 1 
        531 1  69 SER H    1  69 SER QB   . . 3.330 2.854 2.672 3.007     .  0  0 "[    .    1]" 1 
        532 1  69 SER H    1  70 GLY H    . . 3.340 2.028 1.894 2.204     .  0  0 "[    .    1]" 1 
        533 1  69 SER H    1  70 GLY QA   . . 4.590 3.935 3.707 4.129     .  0  0 "[    .    1]" 1 
        534 1  69 SER H    1  71 THR H    . . 4.200 4.008 3.371 4.200     . 10  0 "[    .    1]" 1 
        535 1  70 GLY H    1  71 THR H    . . 3.370 2.669 2.434 2.987     .  0  0 "[    .    1]" 1 
        536 1  70 GLY H    1  71 THR MG   . . 4.690 4.314 3.931 4.599     .  0  0 "[    .    1]" 1 
        537 1  70 GLY QA   1  71 THR HB   . . 4.670 4.231 4.001 4.359     .  0  0 "[    .    1]" 1 
        538 1  70 GLY QA   1  71 THR MG   . . 5.050 3.971 3.791 4.216     .  0  0 "[    .    1]" 1 
        539 1  71 THR H    1  71 THR MG   . . 3.970 2.200 1.994 2.418     .  0  0 "[    .    1]" 1 
        540 1  71 THR HA   1  71 THR MG   . . 3.250 3.194 3.184 3.205     .  0  0 "[    .    1]" 1 
        541 1  71 THR HA   1  72 VAL H    . . 3.510 2.370 2.218 2.542     .  0  0 "[    .    1]" 1 
        542 1  71 THR MG   1  72 VAL H    . . 4.220 3.496 2.947 3.964     .  0  0 "[    .    1]" 1 
        543 1  72 VAL H    1  72 VAL HB   . . 3.810 2.891 2.393 3.657     .  0  0 "[    .    1]" 1 
        544 1  72 VAL H    1  72 VAL MG1  . . 4.580 2.385 1.899 3.565     .  0  0 "[    .    1]" 1 
        545 1  72 VAL H    1  72 VAL MG2  . . 3.700 3.505 1.987 3.851 0.151  9  0 "[    .    1]" 1 
        546 1  72 VAL HA   1  72 VAL MG1  . . 3.470 2.968 2.066 3.185     .  0  0 "[    .    1]" 1 
        547 1  72 VAL HA   1  72 VAL MG2  . . 3.460 2.399 2.078 3.161     .  0  0 "[    .    1]" 1 
        548 1  72 VAL HA   1  73 ASP H    . . 3.270 2.148 2.140 2.178     .  0  0 "[    .    1]" 1 
        549 1  72 VAL HA   1  76 GLU H    . . 6.000 5.497 4.704 5.785     .  0  0 "[    .    1]" 1 
        550 1  72 VAL HA   1  76 GLU QB   . . 4.670 3.177 2.458 4.688 0.018 10  0 "[    .    1]" 1 
        551 1  72 VAL HA   1  76 GLU QG   . . 4.490 3.989 3.321 4.489     .  0  0 "[    .    1]" 1 
        552 1  72 VAL HB   1  73 ASP H    . . 4.860 4.181 3.290 4.463     .  0  0 "[    .    1]" 1 
        553 1  72 VAL MG1  1  73 ASP H    . . 4.450 3.794 2.740 4.204     .  0  0 "[    .    1]" 1 
        554 1  72 VAL MG2  1  73 ASP H    . . 4.450 3.036 2.494 4.214     .  0  0 "[    .    1]" 1 
        555 1  73 ASP H    1  76 GLU H    . . 4.530 3.779 3.215 4.152     .  0  0 "[    .    1]" 1 
        556 1  73 ASP H    1  76 GLU QB   . . 4.180 2.367 1.906 4.101     .  0  0 "[    .    1]" 1 
        557 1  73 ASP H    1  76 GLU QG   . . 3.770 2.959 2.301 3.737     .  0  0 "[    .    1]" 1 
        558 1  73 ASP QB   1  74 PHE H    . . 3.200 2.330 2.039 2.723     .  0  0 "[    .    1]" 1 
        559 1  73 ASP QB   1  76 GLU H    . . 3.900 2.668 2.422 3.146     .  0  0 "[    .    1]" 1 
        560 1  73 ASP HB2  1  74 PHE H    . . 3.810 3.483 2.715 3.811 0.001  1  0 "[    .    1]" 1 
        561 1  73 ASP HB3  1  74 PHE H    . . 3.810 2.370 2.107 2.789     .  0  0 "[    .    1]" 1 
        562 1  74 PHE H    1  75 ASP H    . . 3.170 2.763 2.266 3.075     .  0  0 "[    .    1]" 1 
        563 1  74 PHE H    1  75 ASP HA   . . 5.540 5.320 4.913 5.521     .  0  0 "[    .    1]" 1 
        564 1  75 ASP H    1  75 ASP QB   . . 2.980 2.264 2.053 2.676     .  0  0 "[    .    1]" 1 
        565 1  75 ASP H    1  76 GLU H    . . 3.500 2.633 2.484 2.722     .  0  0 "[    .    1]" 1 
        566 1  75 ASP QB   1  76 GLU H    . . 4.220 2.774 2.337 3.456     .  0  0 "[    .    1]" 1 
        567 1  76 GLU H    1  76 GLU QB   . . 3.560 2.254 2.054 2.632     .  0  0 "[    .    1]" 1 
        568 1  76 GLU H    1  76 GLU QG   . . 3.290 2.721 1.931 3.288     .  0  0 "[    .    1]" 1 
        569 1  76 GLU H    1  77 PHE H    . . 3.690 2.676 2.497 2.872     .  0  0 "[    .    1]" 1 
        570 1  76 GLU HA   1  79 VAL H    . . 4.340 3.550 3.143 3.912     .  0  0 "[    .    1]" 1 
        571 1  76 GLU QB   1  77 PHE H    . . 4.240 2.836 2.477 3.524     .  0  0 "[    .    1]" 1 
        572 1  76 GLU QB   1  79 VAL H    . . 5.720 4.881 4.421 5.298     .  0  0 "[    .    1]" 1 
        573 1  76 GLU QG   1  77 PHE H    . . 4.800 4.126 2.336 4.514     .  0  0 "[    .    1]" 1 
        574 1  77 PHE H    1  77 PHE HB2  . . 3.970 2.351 2.076 2.713     .  0  0 "[    .    1]" 1 
        575 1  77 PHE H    1  77 PHE QB   . . 3.410 2.198 2.051 2.364     .  0  0 "[    .    1]" 1 
        576 1  77 PHE H    1  77 PHE HB3  . . 3.970 2.877 2.400 3.579     .  0  0 "[    .    1]" 1 
        577 1  77 PHE H    1  78 LEU H    . . 3.930 2.670 2.536 2.840     .  0  0 "[    .    1]" 1 
        578 1  77 PHE H    1  78 LEU HB2  . . 4.670 4.475 4.283 4.684 0.014  2  0 "[    .    1]" 1 
        579 1  77 PHE H    1  79 VAL H    . . 4.760 4.065 3.907 4.282     .  0  0 "[    .    1]" 1 
        580 1  77 PHE HA   1  80 MET H    . . 4.270 3.566 3.201 3.916     .  0  0 "[    .    1]" 1 
        581 1  77 PHE QB   1  78 LEU H    . . 3.950 2.558 2.336 2.781     .  0  0 "[    .    1]" 1 
        582 1  77 PHE HB2  1  78 LEU H    . . 4.520 3.526 2.846 3.963     .  0  0 "[    .    1]" 1 
        583 1  77 PHE HB3  1  78 LEU H    . . 4.520 2.717 2.358 3.688     .  0  0 "[    .    1]" 1 
        584 1  78 LEU H    1  78 LEU HB2  . . 3.610 2.089 2.050 2.206     .  0  0 "[    .    1]" 1 
        585 1  78 LEU H    1  78 LEU MD1  . . 4.380 3.263 2.338 3.948     .  0  0 "[    .    1]" 1 
        586 1  78 LEU H    1  78 LEU MD2  . . 4.380 3.811 2.333 4.385 0.005  6  0 "[    .    1]" 1 
        587 1  78 LEU H    1  78 LEU HG   . . 4.300 4.059 3.484 4.344 0.044  1  0 "[    .    1]" 1 
        588 1  78 LEU H    1  79 VAL H    . . 3.860 2.655 2.402 2.843     .  0  0 "[    .    1]" 1 
        589 1  78 LEU HA   1  78 LEU MD1  . . 4.100 2.669 1.969 3.718     .  0  0 "[    .    1]" 1 
        590 1  78 LEU HA   1  78 LEU MD2  . . 4.100 3.144 2.317 3.786     .  0  0 "[    .    1]" 1 
        591 1  78 LEU HA   1  78 LEU HG   . . 3.730 2.664 2.231 3.702     .  0  0 "[    .    1]" 1 
        592 1  78 LEU HA   1  81 MET H    . . 4.190 3.624 3.171 3.998     .  0  0 "[    .    1]" 1 
        593 1  78 LEU HB2  1  78 LEU MD1  . . 3.650 2.405 1.977 3.191     .  0  0 "[    .    1]" 1 
        594 1  78 LEU HB2  1  78 LEU MD2  . . 3.650 2.617 2.159 3.160     .  0  0 "[    .    1]" 1 
        595 1  78 LEU HB2  1  79 VAL H    . . 4.150 3.170 2.847 3.552     .  0  0 "[    .    1]" 1 
        596 1  79 VAL H    1  79 VAL HB   . . 3.460 2.671 2.495 3.604 0.144  1  0 "[    .    1]" 1 
        597 1  79 VAL H    1  79 VAL MG1  . . 4.080 3.470 2.051 3.786     .  0  0 "[    .    1]" 1 
        598 1  79 VAL H    1  79 VAL MG2  . . 4.080 2.332 1.931 3.778     .  0  0 "[    .    1]" 1 
        599 1  79 VAL H    1  80 MET H    . . 3.780 2.573 2.399 2.690     .  0  0 "[    .    1]" 1 
        600 1  79 VAL HA   1  79 VAL MG1  . . 3.540 2.388 2.168 3.203     .  0  0 "[    .    1]" 1 
        601 1  79 VAL HA   1  79 VAL MG2  . . 3.540 2.448 2.289 3.197     .  0  0 "[    .    1]" 1 
        602 1  79 VAL HA   1  82 VAL H    . . 4.410 3.780 3.461 4.062     .  0  0 "[    .    1]" 1 
        603 1  80 MET H    1  80 MET QB   . . 3.530 2.192 2.066 2.416     .  0  0 "[    .    1]" 1 
        604 1  80 MET H    1  80 MET QG   . . 4.300 3.090 2.397 3.750     .  0  0 "[    .    1]" 1 
        605 1  80 MET H    1  81 MET H    . . 3.680 2.515 2.333 2.765     .  0  0 "[    .    1]" 1 
        606 1  80 MET HA   1  82 VAL H    . . 5.020 4.232 3.571 5.019     .  0  0 "[    .    1]" 1 
        607 1  80 MET HA   1  83 ARG H    . . 4.450 3.603 3.370 3.799     .  0  0 "[    .    1]" 1 
        608 1  80 MET HA   1  83 ARG QB   . . 4.670 3.617 1.964 4.572     .  0  0 "[    .    1]" 1 
        609 1  80 MET HA   1  83 ARG QD   . . 4.410 3.000 1.995 4.037     .  0  0 "[    .    1]" 1 
        610 1  80 MET QB   1  81 MET H    . . 4.070 3.066 2.812 3.280     .  0  0 "[    .    1]" 1 
        611 1  80 MET QB   1  81 MET HA   . . 4.630 3.954 3.855 4.091     .  0  0 "[    .    1]" 1 
        612 1  80 MET QB   1  84 SER H    . . 5.460 5.154 4.524 5.473 0.013  5  0 "[    .    1]" 1 
        613 1  81 MET H    1  81 MET QB   . . 3.320 2.186 2.040 2.490     .  0  0 "[    .    1]" 1 
        614 1  81 MET H    1  81 MET QG   . . 4.040 3.603 2.076 4.017     .  0  0 "[    .    1]" 1 
        615 1  81 MET HA   1  84 SER H    . . 4.260 3.501 3.190 4.048     .  0  0 "[    .    1]" 1 
        616 1  82 VAL H    1  82 VAL HB   . . 3.600 3.207 2.570 3.655 0.055  5  0 "[    .    1]" 1 
        617 1  82 VAL HA   1  82 VAL MG1  . . 3.410 2.711 2.343 3.204     .  0  0 "[    .    1]" 1 
        618 1  82 VAL HA   1  82 VAL MG2  . . 3.410 2.856 2.302 3.193     .  0  0 "[    .    1]" 1 
        619 1  82 VAL HB   1  83 ARG H    . . 4.050 3.984 3.869 4.059 0.009  6  0 "[    .    1]" 1 
        620 1  82 VAL MG1  1  83 ARG H    . . 4.120 3.151 1.929 3.904     .  0  0 "[    .    1]" 1 
        621 1  82 VAL MG1  1  83 ARG HG2  . . 5.480 4.889 3.721 5.498 0.018  7  0 "[    .    1]" 1 
        622 1  82 VAL MG1  1  83 ARG HG3  . . 5.480 4.336 2.606 5.506 0.026  7  0 "[    .    1]" 1 
        623 1  82 VAL MG2  1  83 ARG H    . . 4.120 2.632 1.970 3.711     .  0  0 "[    .    1]" 1 
        624 1  82 VAL MG2  1  83 ARG HG2  . . 5.480 3.978 2.768 5.491 0.011  1  0 "[    .    1]" 1 
        625 1  82 VAL MG2  1  83 ARG HG3  . . 5.480 3.728 2.252 5.340     .  0  0 "[    .    1]" 1 
        626 1  83 ARG H    1  83 ARG HB2  . . 3.780 2.784 2.063 3.600     .  0  0 "[    .    1]" 1 
        627 1  83 ARG H    1  83 ARG HB3  . . 3.780 3.275 2.625 3.598     .  0  0 "[    .    1]" 1 
        628 1  83 ARG H    1  83 ARG QD   . . 4.490 3.946 3.530 4.444     .  0  0 "[    .    1]" 1 
        629 1  83 ARG H    1  83 ARG QG   . . 4.300 2.314 1.931 3.378     .  0  0 "[    .    1]" 1 
        630 1  83 ARG H    1  84 SER H    . . 3.560 2.658 2.518 2.871     .  0  0 "[    .    1]" 1 
        631 1  83 ARG H    1  84 SER QB   . . 5.410 4.726 4.189 5.081     .  0  0 "[    .    1]" 1 
        632 1  83 ARG HA   1  83 ARG QD   . . 4.680 4.042 3.829 4.261     .  0  0 "[    .    1]" 1 
        633 1  83 ARG HA   1  83 ARG QG   . . 3.600 2.682 2.138 3.388     .  0  0 "[    .    1]" 1 
        634 1  83 ARG QB   1  84 SER H    . . 3.940 2.805 2.397 3.457     .  0  0 "[    .    1]" 1 
        635 1  83 ARG QD   1  84 SER H    . . 4.730 4.261 2.766 4.733 0.003  9  0 "[    .    1]" 1 
        636 1  84 SER H    1  84 SER QB   . . 3.240 2.716 2.066 3.223     .  0  0 "[    .    1]" 1 
        637 1  84 SER QB   1  85 MET H    . . 3.850 2.715 2.019 3.823     .  0  0 "[    .    1]" 1 
        638 1  84 SER QB   1  86 LYS H    . . 5.170 3.554 2.133 5.169     .  0  0 "[    .    1]" 1 
        639 1  85 MET H    1  85 MET QG   . . 3.610 2.735 2.213 3.572     .  0  0 "[    .    1]" 1 
        640 1  85 MET H    1  86 LYS H    . . 3.410 2.606 1.885 3.374     .  0  0 "[    .    1]" 1 
        641 1  85 MET H    1  86 LYS QB   . . 4.960 4.382 3.448 4.964 0.004  7  0 "[    .    1]" 1 
        642 1  85 MET HA   1  86 LYS H    . . 3.370 2.998 2.240 3.514 0.144  9  0 "[    .    1]" 1 
        643 1  85 MET QG   1  86 LYS H    . . 4.880 3.491 1.946 4.714     .  0  0 "[    .    1]" 1 
        644 1  86 LYS H    1  86 LYS QB   . . 3.130 2.891 2.667 3.084     .  0  0 "[    .    1]" 1 
        645 1  86 LYS H    1  86 LYS QD   . . 4.460 4.140 3.221 4.545 0.085  7  0 "[    .    1]" 1 
        646 1  86 LYS H    1  86 LYS QG   . . 4.410 3.767 2.010 4.375     .  0  0 "[    .    1]" 1 
        647 1  86 LYS H    1  87 ASP H    . . 4.570 3.525 1.898 4.571 0.001 10  0 "[    .    1]" 1 
        648 1  86 LYS HA   1  86 LYS QD   . . 4.230 2.862 2.215 4.263 0.033  7  0 "[    .    1]" 1 
        649 1  86 LYS HA   1  86 LYS QG   . . 3.540 2.545 2.145 3.345     .  0  0 "[    .    1]" 1 
        650 1  86 LYS HA   1  87 ASP H    . . 3.490 2.862 2.462 3.553 0.063  1  0 "[    .    1]" 1 
        651 1  86 LYS HA   1  87 ASP HA   . . 4.660 4.492 4.359 4.635     .  0  0 "[    .    1]" 1 
        652 1  86 LYS QB   1  86 LYS QD   . . 2.500 2.121 1.987 2.304     .  0  0 "[    .    1]" 1 
        653 1  86 LYS QB   1  87 ASP H    . . 4.480 2.911 2.007 4.045     .  0  0 "[    .    1]" 1 
        654 1  86 LYS QG   1  87 ASP H    . . 4.600 3.683 1.933 4.598     .  0  0 "[    .    1]" 1 
        655 1  87 ASP H    1  87 ASP QB   . . 3.500 2.748 2.329 3.280     .  0  0 "[    .    1]" 1 
        656 1  87 ASP QB   1  88 ASP H    . . 4.310 2.692 1.954 3.764     .  0  0 "[    .    1]" 1 
        657 1  88 ASP QB   1  89 SER H    . . 4.230 2.781 1.938 3.977     .  0  0 "[    .    1]" 1 
        658 1  89 SER H    1  89 SER QB   . . 3.530 3.087 2.403 3.435     .  0  0 "[    .    1]" 1 
        659 1  89 SER HA   1  90 LYS H    . . 3.490 2.821 2.391 3.552 0.062  8  0 "[    .    1]" 1 
        660 1  89 SER HA   1  90 LYS QB   . . 4.570 4.133 3.731 4.570     .  0  0 "[    .    1]" 1 
        661 1  89 SER QB   1  90 LYS H    . . 4.340 2.726 2.013 4.018     .  0  0 "[    .    1]" 1 
        662 1  90 LYS H    1  90 LYS QB   . . 3.490 2.898 2.667 3.077     .  0  0 "[    .    1]" 1 
        663 1  90 LYS H    1  90 LYS QG   . . 4.290 3.856 3.116 4.266     .  0  0 "[    .    1]" 1 
        664 1  90 LYS HA   1  90 LYS QD   . . 4.610 3.360 2.080 4.005     .  0  0 "[    .    1]" 1 
        665 1  90 LYS HA   1  90 LYS QG   . . 3.600 2.251 2.024 2.517     .  0  0 "[    .    1]" 1 
        666 1  90 LYS HA   1  91 GLY H    . . 3.360 2.472 2.228 2.715     .  0  0 "[    .    1]" 1 
        667 1  90 LYS QB   1  91 GLY H    . . 4.270 2.693 1.965 4.014     .  0  0 "[    .    1]" 1 
        668 1  90 LYS QG   1  91 GLY H    . . 4.930 3.017 2.174 3.977     .  0  0 "[    .    1]" 1 
        669 1  91 GLY QA   1  92 LYS H    . . 2.820 2.243 2.111 2.820     .  0  0 "[    .    1]" 1 
        670 1  91 GLY QA   1  92 LYS HA   . . 4.560 3.974 3.934 4.130     .  0  0 "[    .    1]" 1 
        671 1  91 GLY QA   1  92 LYS QB   . . 4.600 4.133 3.960 4.528     .  0  0 "[    .    1]" 1 
        672 1  91 GLY QA   1  92 LYS QG   . . 4.570 3.738 3.066 4.370     .  0  0 "[    .    1]" 1 
        673 1  92 LYS H    1  92 LYS QB   . . 3.680 2.914 2.376 3.418     .  0  0 "[    .    1]" 1 
        674 1  92 LYS H    1  92 LYS QG   . . 3.430 2.485 1.960 3.285     .  0  0 "[    .    1]" 1 
        675 1  92 LYS H    1  93 SER H    . . 4.500 3.732 1.913 4.510 0.010  3  0 "[    .    1]" 1 
        676 1  92 LYS HA   1  92 LYS QD   . . 4.730 3.702 2.063 4.422     .  0  0 "[    .    1]" 1 
        677 1  92 LYS HA   1  92 LYS QG   . . 3.510 3.153 2.321 3.396     .  0  0 "[    .    1]" 1 
        678 1  92 LYS HA   1  93 SER H    . . 3.120 2.574 2.158 2.930     .  0  0 "[    .    1]" 1 
        679 1  92 LYS QG   1  93 SER H    . . 4.800 3.882 3.021 4.361     .  0  0 "[    .    1]" 1 
        680 1  93 SER H    1  93 SER QB   . . 3.520 2.698 2.233 3.096     .  0  0 "[    .    1]" 1 
        681 1  93 SER H    1  94 GLU H    . . 4.670 4.245 3.934 4.529     .  0  0 "[    .    1]" 1 
        682 1  93 SER HA   1  94 GLU H    . . 3.370 2.421 2.210 2.718     .  0  0 "[    .    1]" 1 
        683 1  93 SER HA   1  95 GLU H    . . 4.680 3.906 3.297 4.653     .  0  0 "[    .    1]" 1 
        684 1  93 SER QB   1  94 GLU H    . . 3.840 2.881 2.048 3.781     .  0  0 "[    .    1]" 1 
        685 1  93 SER QB   1  95 GLU H    . . 3.700 2.902 2.232 3.634     .  0  0 "[    .    1]" 1 
        686 1  94 GLU H    1  94 GLU QB   . . 3.230 2.303 2.078 2.603     .  0  0 "[    .    1]" 1 
        687 1  94 GLU H    1  94 GLU QG   . . 4.280 3.023 1.970 4.016     .  0  0 "[    .    1]" 1 
        688 1  94 GLU H    1  95 GLU H    . . 3.790 2.530 2.431 2.704     .  0  0 "[    .    1]" 1 
        689 1  94 GLU H    1  96 GLU H    . . 4.940 4.313 3.685 4.687     .  0  0 "[    .    1]" 1 
        690 1  94 GLU HA   1  96 GLU H    . . 4.310 3.904 3.587 4.307     .  0  0 "[    .    1]" 1 
        691 1  94 GLU HA   1  97 LEU H    . . 4.220 3.503 2.968 3.832     .  0  0 "[    .    1]" 1 
        692 1  94 GLU HA   1  97 LEU HB2  . . 4.410 3.417 2.190 4.330     .  0  0 "[    .    1]" 1 
        693 1  94 GLU HA   1  97 LEU HG   . . 4.710 4.487 3.706 4.728 0.018  3  0 "[    .    1]" 1 
        694 1  95 GLU H    1  95 GLU QB   . . 2.930 2.382 2.122 2.603     .  0  0 "[    .    1]" 1 
        695 1  95 GLU H    1  95 GLU QG   . . 4.520 2.915 2.021 4.063     .  0  0 "[    .    1]" 1 
        696 1  95 GLU H    1  96 GLU H    . . 3.620 2.720 2.411 2.870     .  0  0 "[    .    1]" 1 
        697 1  95 GLU QB   1  96 GLU H    . . 3.160 2.817 2.466 3.237 0.077  6  0 "[    .    1]" 1 
        698 1  95 GLU QG   1  96 GLU H    . . 4.280 3.913 1.938 4.269     .  0  0 "[    .    1]" 1 
        699 1  96 GLU H    1  97 LEU H    . . 3.430 2.666 2.447 2.774     .  0  0 "[    .    1]" 1 
        700 1  96 GLU H    1  98 SER H    . . 5.280 4.182 3.910 4.326     .  0  0 "[    .    1]" 1 
        701 1  96 GLU HA   1  99 ASP H    . . 3.720 3.407 3.133 3.689     .  0  0 "[    .    1]" 1 
        702 1  96 GLU HA   1  99 ASP QB   . . 3.720 3.159 2.691 3.715     .  0  0 "[    .    1]" 1 
        703 1  96 GLU QB   1  97 LEU HA   . . 5.060 3.922 3.804 4.426     .  0  0 "[    .    1]" 1 
        704 1  96 GLU QB   1  99 ASP H    . . 5.100 4.732 4.355 5.083     .  0  0 "[    .    1]" 1 
        705 1  97 LEU H    1  97 LEU HB2  . . 3.360 2.151 2.064 2.273     .  0  0 "[    .    1]" 1 
        706 1  97 LEU H    1  97 LEU HB3  . . 3.910 3.459 3.332 3.540     .  0  0 "[    .    1]" 1 
        707 1  97 LEU H    1  97 LEU MD1  . . 4.420 3.335 2.235 4.007     .  0  0 "[    .    1]" 1 
        708 1  97 LEU H    1  97 LEU HG   . . 4.110 3.430 2.713 3.930     .  0  0 "[    .    1]" 1 
        709 1  97 LEU H    1  98 SER H    . . 3.600 2.656 2.500 2.783     .  0  0 "[    .    1]" 1 
        710 1  97 LEU HA   1  97 LEU MD2  . . 4.020 2.652 2.048 3.608     .  0  0 "[    .    1]" 1 
        711 1  97 LEU HA   1  97 LEU HG   . . 3.740 2.660 2.241 3.702     .  0  0 "[    .    1]" 1 
        712 1  97 LEU HA   1 100 LEU MD2  . . 4.250 3.513 2.819 3.962     .  0  0 "[    .    1]" 1 
        713 1  97 LEU HB2  1  98 SER H    . . 4.120 3.078 2.777 3.258     .  0  0 "[    .    1]" 1 
        714 1  97 LEU HB3  1  98 SER H    . . 4.690 3.454 3.336 3.599     .  0  0 "[    .    1]" 1 
        715 1  97 LEU HB3  1 150 TYR QE   . . 5.090 5.063 4.637 5.158 0.068  1  0 "[    .    1]" 1 
        716 1  97 LEU MD1  1  98 SER H    . . 5.430 4.673 4.278 4.872     .  0  0 "[    .    1]" 1 
        717 1  97 LEU MD2  1  98 SER H    . . 5.430 4.702 4.125 5.006     .  0  0 "[    .    1]" 1 
        718 1  97 LEU HG   1  98 SER H    . . 5.460 5.040 4.739 5.271     .  0  0 "[    .    1]" 1 
        719 1  97 LEU HG   1 154 LEU HA   . . 3.800 3.833 3.190 4.010 0.210  2  0 "[    .    1]" 1 
        720 1  98 SER H    1  98 SER QB   . . 3.440 2.251 2.102 2.425     .  0  0 "[    .    1]" 1 
        721 1  98 SER H    1  99 ASP H    . . 3.660 2.583 2.417 2.765     .  0  0 "[    .    1]" 1 
        722 1  98 SER HA   1 150 TYR HD1  . . 5.590 5.280 4.738 5.602 0.012  4  0 "[    .    1]" 1 
        723 1  98 SER HA   1 150 TYR QE   . . 3.760 3.431 2.676 3.768 0.008  6  0 "[    .    1]" 1 
        724 1  98 SER QB   1  99 ASP H    . . 4.060 3.271 2.709 3.555     .  0  0 "[    .    1]" 1 
        725 1  98 SER QB   1 150 TYR QE   . . 3.970 3.438 2.986 3.950     .  0  0 "[    .    1]" 1 
        726 1  99 ASP H    1  99 ASP HB2  . . 3.690 2.366 2.102 2.744     .  0  0 "[    .    1]" 1 
        727 1  99 ASP H    1  99 ASP QB   . . 3.060 2.286 2.083 2.668     .  0  0 "[    .    1]" 1 
        728 1  99 ASP H    1  99 ASP HB3  . . 3.690 3.236 2.612 3.633     .  0  0 "[    .    1]" 1 
        729 1  99 ASP H    1 100 LEU HB2  . . 4.870 4.406 4.007 4.723     .  0  0 "[    .    1]" 1 
        730 1  99 ASP H    1 102 ARG QB   . . 5.810 5.721 5.432 5.850 0.040  2  0 "[    .    1]" 1 
        731 1  99 ASP HA   1 102 ARG H    . . 3.990 3.780 3.544 3.953     .  0  0 "[    .    1]" 1 
        732 1  99 ASP HA   1 102 ARG QG   . . 5.430 4.928 2.292 5.408     .  0  0 "[    .    1]" 1 
        733 1  99 ASP HA   1 103 MET H    . . 5.200 4.332 4.106 4.877     .  0  0 "[    .    1]" 1 
        734 1  99 ASP QB   1 100 LEU H    . . 3.490 2.420 2.070 2.788     .  0  0 "[    .    1]" 1 
        735 1  99 ASP HB2  1 100 LEU H    . . 4.120 2.979 2.323 3.803     .  0  0 "[    .    1]" 1 
        736 1  99 ASP HB3  1 100 LEU H    . . 4.120 2.889 2.091 4.051     .  0  0 "[    .    1]" 1 
        737 1 100 LEU H    1 100 LEU HB2  . . 3.380 2.168 2.053 2.238     .  0  0 "[    .    1]" 1 
        738 1 100 LEU H    1 100 LEU MD1  . . 4.600 2.913 1.940 3.915     .  0  0 "[    .    1]" 1 
        739 1 100 LEU H    1 100 LEU MD2  . . 4.410 3.200 2.097 4.057     .  0  0 "[    .    1]" 1 
        740 1 100 LEU H    1 100 LEU HG   . . 4.250 4.027 3.906 4.257 0.007  4  0 "[    .    1]" 1 
        741 1 100 LEU HA   1 100 LEU MD1  . . 3.800 2.278 2.091 2.461     .  0  0 "[    .    1]" 1 
        742 1 100 LEU HA   1 100 LEU MD2  . . 4.000 3.256 2.354 3.815     .  0  0 "[    .    1]" 1 
        743 1 100 LEU HA   1 102 ARG H    . . 5.030 4.683 4.611 4.819     .  0  0 "[    .    1]" 1 
        744 1 100 LEU HA   1 104 PHE H    . . 4.560 3.928 3.440 4.303     .  0  0 "[    .    1]" 1 
        745 1 100 LEU HB2  1 101 PHE H    . . 4.630 2.977 2.858 3.117     .  0  0 "[    .    1]" 1 
        746 1 100 LEU HB3  1 101 PHE H    . . 3.880 3.369 3.065 3.562     .  0  0 "[    .    1]" 1 
        747 1 100 LEU HB3  1 101 PHE QB   . . 4.980 4.762 4.378 4.966     .  0  0 "[    .    1]" 1 
        748 1 100 LEU MD1  1 101 PHE H    . . 5.540 4.439 4.103 4.710     .  0  0 "[    .    1]" 1 
        749 1 100 LEU MD2  1 101 PHE H    . . 5.540 4.532 4.106 4.832     .  0  0 "[    .    1]" 1 
        750 1 101 PHE H    1 101 PHE HB2  . . 3.500 2.623 2.170 2.819     .  0  0 "[    .    1]" 1 
        751 1 101 PHE H    1 101 PHE QB   . . 3.050 2.197 2.119 2.241     .  0  0 "[    .    1]" 1 
        752 1 101 PHE H    1 101 PHE HB3  . . 3.500 2.468 2.280 2.971     .  0  0 "[    .    1]" 1 
        753 1 101 PHE H    1 101 PHE HD1  . . 5.130 4.689 4.605 4.789     .  0  0 "[    .    1]" 1 
        754 1 101 PHE H    1 102 ARG H    . . 3.240 2.918 2.843 2.969     .  0  0 "[    .    1]" 1 
        755 1 101 PHE HA   1 101 PHE HD1  . . 3.960 2.343 2.167 2.707     .  0  0 "[    .    1]" 1 
        756 1 101 PHE HA   1 104 PHE H    . . 4.730 3.838 3.452 4.181     .  0  0 "[    .    1]" 1 
        757 1 101 PHE HA   1 112 ILE MD   . . 3.960 3.103 2.801 3.264     .  0  0 "[    .    1]" 1 
        758 1 101 PHE QB   1 101 PHE HD1  . . 3.170 2.862 2.790 2.919     .  0  0 "[    .    1]" 1 
        759 1 101 PHE QB   1 102 ARG H    . . 3.330 2.351 2.244 2.446     .  0  0 "[    .    1]" 1 
        760 1 101 PHE HB2  1 102 ARG H    . . 4.020 3.734 3.374 3.851     .  0  0 "[    .    1]" 1 
        761 1 101 PHE HB3  1 102 ARG H    . . 4.020 2.377 2.278 2.474     .  0  0 "[    .    1]" 1 
        762 1 101 PHE HD1  1 102 ARG H    . . 4.340 4.308 3.957 4.415 0.075  9  0 "[    .    1]" 1 
        763 1 101 PHE HD1  1 102 ARG HA   . . 4.300 4.265 3.663 4.415 0.115  3  0 "[    .    1]" 1 
        764 1 101 PHE HD1  1 112 ILE MD   . . 3.870 2.072 1.961 2.494     .  0  0 "[    .    1]" 1 
        765 1 101 PHE QE   1 110 GLY QA   . . 4.500 4.007 3.560 4.385     .  0  0 "[    .    1]" 1 
        766 1 101 PHE QE   1 111 TYR HA   . . 4.880 3.143 2.604 3.414     .  0  0 "[    .    1]" 1 
        767 1 101 PHE QE   1 112 ILE H    . . 4.610 4.421 3.975 4.636 0.026  3  0 "[    .    1]" 1 
        768 1 101 PHE QE   1 112 ILE MD   . . 4.290 2.591 2.246 3.004     .  0  0 "[    .    1]" 1 
        769 1 101 PHE QE   1 149 ASP HA   . . 4.740 3.859 2.983 4.754 0.014  9  0 "[    .    1]" 1 
        770 1 102 ARG H    1 102 ARG QB   . . 2.970 2.165 2.046 2.387     .  0  0 "[    .    1]" 1 
        771 1 102 ARG H    1 102 ARG QG   . . 4.190 3.534 2.325 3.970     .  0  0 "[    .    1]" 1 
        772 1 102 ARG HA   1 102 ARG QD   . . 4.720 3.362 2.047 4.262     .  0  0 "[    .    1]" 1 
        773 1 102 ARG HA   1 102 ARG QG   . . 3.570 2.472 2.006 3.328     .  0  0 "[    .    1]" 1 
        774 1 102 ARG HA   1 104 PHE H    . . 4.830 4.152 3.760 4.697     .  0  0 "[    .    1]" 1 
        775 1 102 ARG HA   1 105 ASP H    . . 4.430 3.216 2.803 3.477     .  0  0 "[    .    1]" 1 
        776 1 102 ARG HA   1 105 ASP HA   . . 5.770 5.021 4.626 5.456     .  0  0 "[    .    1]" 1 
        777 1 102 ARG QB   1 102 ARG QG   . . 2.260 2.029 1.995 2.087     .  0  0 "[    .    1]" 1 
        778 1 103 MET H    1 103 MET QB   . . 3.040 2.197 2.059 2.256     .  0  0 "[    .    1]" 1 
        779 1 103 MET H    1 104 PHE H    . . 3.410 2.562 2.300 2.850     .  0  0 "[    .    1]" 1 
        780 1 103 MET H    1 104 PHE HA   . . 5.830 5.203 4.995 5.421     .  0  0 "[    .    1]" 1 
        781 1 103 MET QB   1 104 PHE H    . . 3.810 2.732 2.297 2.995     .  0  0 "[    .    1]" 1 
        782 1 104 PHE H    1 104 PHE QB   . . 3.300 2.188 2.128 2.222     .  0  0 "[    .    1]" 1 
        783 1 104 PHE H    1 105 ASP H    . . 3.250 2.288 2.154 2.607     .  0  0 "[    .    1]" 1 
        784 1 104 PHE H    1 112 ILE MD   . . 4.440 3.962 3.638 4.344     .  0  0 "[    .    1]" 1 
        785 1 104 PHE H    1 112 ILE MG   . . 5.610 5.326 4.832 5.627 0.017  3  0 "[    .    1]" 1 
        786 1 104 PHE HA   1 104 PHE QE   . . 3.730 4.379 4.354 4.389 0.659  5 10  [***-+*****]  1 
        787 1 104 PHE HA   1 112 ILE MD   . . 4.830 4.487 4.222 4.840 0.010  4  0 "[    .    1]" 1 
        788 1 104 PHE QB   1 112 ILE MD   . . 3.190 2.297 2.033 2.683     .  0  0 "[    .    1]" 1 
        789 1 104 PHE QE   1 119 ILE HB   . . 4.080 3.784 2.501 4.100 0.020  4  0 "[    .    1]" 1 
        790 1 105 ASP H    1 105 ASP HB2  . . 3.380 2.502 2.332 2.657     .  0  0 "[    .    1]" 1 
        791 1 105 ASP H    1 105 ASP HB3  . . 3.190 2.622 2.469 2.817     .  0  0 "[    .    1]" 1 
        792 1 105 ASP H    1 112 ILE MD   . . 4.320 3.330 2.957 3.743     .  0  0 "[    .    1]" 1 
        793 1 105 ASP HA   1 106 LYS H    . . 3.030 2.489 2.274 2.559     .  0  0 "[    .    1]" 1 
        794 1 105 ASP HA   1 107 ASN H    . . 4.210 3.173 2.999 3.577     .  0  0 "[    .    1]" 1 
        795 1 105 ASP HA   1 108 ALA H    . . 4.650 4.066 3.498 4.331     .  0  0 "[    .    1]" 1 
        796 1 105 ASP HA   1 112 ILE MD   . . 3.950 2.767 2.513 3.120     .  0  0 "[    .    1]" 1 
        797 1 105 ASP HB2  1 107 ASN H    . . 5.770 5.296 4.968 5.807 0.037  5  0 "[    .    1]" 1 
        798 1 105 ASP HB2  1 112 ILE MD   . . 4.020 2.684 2.249 3.129     .  0  0 "[    .    1]" 1 
        799 1 105 ASP HB3  1 106 LYS H    . . 4.760 4.399 4.348 4.460     .  0  0 "[    .    1]" 1 
        800 1 105 ASP HB3  1 107 ASN H    . . 5.380 4.962 4.796 5.166     .  0  0 "[    .    1]" 1 
        801 1 105 ASP HB3  1 108 ALA H    . . 4.500 4.178 3.507 4.506 0.006  4  0 "[    .    1]" 1 
        802 1 106 LYS H    1 106 LYS QB   . . 3.060 2.480 2.334 2.599     .  0  0 "[    .    1]" 1 
        803 1 106 LYS H    1 106 LYS QG   . . 3.420 2.236 1.951 2.699     .  0  0 "[    .    1]" 1 
        804 1 106 LYS H    1 107 ASN H    . . 3.490 2.516 2.272 2.809     .  0  0 "[    .    1]" 1 
        805 1 106 LYS H    1 107 ASN HA   . . 5.380 5.098 4.937 5.395 0.015  5  0 "[    .    1]" 1 
        806 1 106 LYS H    1 112 ILE MD   . . 5.410 4.555 4.404 4.843     .  0  0 "[    .    1]" 1 
        807 1 106 LYS H    1 112 ILE MG   . . 5.470 4.846 4.590 5.057     .  0  0 "[    .    1]" 1 
        808 1 106 LYS H    1 116 GLU QB   . . 4.040 3.609 3.298 4.048 0.008  3  0 "[    .    1]" 1 
        809 1 106 LYS H    1 116 GLU QG   . . 4.210 2.532 1.923 3.375     .  0  0 "[    .    1]" 1 
        810 1 106 LYS HA   1 106 LYS QD   . . 4.130 4.039 3.933 4.117     .  0  0 "[    .    1]" 1 
        811 1 106 LYS QB   1 106 LYS QG   . . 2.360 2.070 2.038 2.087     .  0  0 "[    .    1]" 1 
        812 1 106 LYS QB   1 107 ASN H    . . 3.430 2.981 2.476 3.188     .  0  0 "[    .    1]" 1 
        813 1 106 LYS QB   1 119 ILE MD   . . 4.600 4.282 3.721 4.617 0.017 10  0 "[    .    1]" 1 
        814 1 106 LYS QE   1 106 LYS QG   . . 3.430 2.337 2.046 2.409     .  0  0 "[    .    1]" 1 
        815 1 106 LYS QE   1 119 ILE MD   . . 4.210 2.279 1.887 3.226     .  0  0 "[    .    1]" 1 
        816 1 106 LYS QE   1 119 ILE MG   . . 3.780 2.731 2.108 3.474     .  0  0 "[    .    1]" 1 
        817 1 106 LYS QG   1 107 ASN H    . . 5.770 4.152 3.902 4.458     .  0  0 "[    .    1]" 1 
        818 1 107 ASN H    1 107 ASN HB2  . . 3.930 2.382 2.094 3.568     .  0  0 "[    .    1]" 1 
        819 1 107 ASN H    1 107 ASN QB   . . 3.250 2.223 2.070 2.755     .  0  0 "[    .    1]" 1 
        820 1 107 ASN H    1 107 ASN HB3  . . 3.930 3.159 2.496 3.519     .  0  0 "[    .    1]" 1 
        821 1 107 ASN H    1 108 ALA MB   . . 4.830 4.698 4.629 4.731     .  0  0 "[    .    1]" 1 
        822 1 107 ASN HA   1 108 ALA MB   . . 4.750 3.959 3.907 4.019     .  0  0 "[    .    1]" 1 
        823 1 107 ASN QB   1 108 ALA H    . . 4.190 3.324 3.263 3.748     .  0  0 "[    .    1]" 1 
        824 1 107 ASN HB2  1 108 ALA H    . . 4.820 3.779 3.475 4.287     .  0  0 "[    .    1]" 1 
        825 1 107 ASN HB3  1 108 ALA H    . . 4.820 3.792 3.390 4.391     .  0  0 "[    .    1]" 1 
        826 1 108 ALA H    1 108 ALA HA   . . 2.850 2.284 2.282 2.290     .  0  0 "[    .    1]" 1 
        827 1 108 ALA H    1 108 ALA MB   . . 3.430 2.787 2.745 2.819     .  0  0 "[    .    1]" 1 
        828 1 108 ALA H    1 109 ASP H    . . 3.440 2.831 2.780 3.084     .  0  0 "[    .    1]" 1 
        829 1 108 ALA H    1 110 GLY H    . . 5.020 4.198 4.023 4.672     .  0  0 "[    .    1]" 1 
        830 1 108 ALA HA   1 109 ASP H    . . 3.310 2.873 2.558 2.936     .  0  0 "[    .    1]" 1 
        831 1 108 ALA HA   1 110 GLY H    . . 3.800 3.368 3.113 3.655     .  0  0 "[    .    1]" 1 
        832 1 108 ALA MB   1 109 ASP H    . . 4.190 3.644 3.617 3.718     .  0  0 "[    .    1]" 1 
        833 1 108 ALA MB   1 109 ASP HA   . . 5.140 4.161 4.112 4.197     .  0  0 "[    .    1]" 1 
        834 1 108 ALA MB   1 110 GLY H    . . 4.780 4.504 4.242 4.749     .  0  0 "[    .    1]" 1 
        835 1 109 ASP H    1 109 ASP HB2  . . 3.950 3.719 3.675 3.776     .  0  0 "[    .    1]" 1 
        836 1 109 ASP H    1 109 ASP QB   . . 3.330 2.794 2.685 2.944     .  0  0 "[    .    1]" 1 
        837 1 109 ASP H    1 109 ASP HB3  . . 3.950 2.891 2.760 3.098     .  0  0 "[    .    1]" 1 
        838 1 109 ASP H    1 110 GLY H    . . 3.100 2.124 1.925 2.359     .  0  0 "[    .    1]" 1 
        839 1 109 ASP H    1 111 TYR H    . . 3.980 3.640 3.471 3.996 0.016  3  0 "[    .    1]" 1 
        840 1 109 ASP HA   1 111 TYR H    . . 4.760 4.400 4.301 4.559     .  0  0 "[    .    1]" 1 
        841 1 109 ASP HB2  1 110 GLY H    . . 4.770 4.279 4.160 4.456     .  0  0 "[    .    1]" 1 
        842 1 109 ASP HB3  1 110 GLY H    . . 4.770 4.285 4.114 4.436     .  0  0 "[    .    1]" 1 
        843 1 110 GLY H    1 111 TYR H    . . 3.190 2.768 2.567 2.941     .  0  0 "[    .    1]" 1 
        844 1 110 GLY QA   1 111 TYR HD1  . . 5.000 4.581 4.546 4.650     .  0  0 "[    .    1]" 1 
        845 1 111 TYR H    1 111 TYR HB2  . . 3.870 2.859 2.845 2.868     .  0  0 "[    .    1]" 1 
        846 1 111 TYR H    1 111 TYR HB3  . . 3.870 3.734 3.732 3.737     .  0  0 "[    .    1]" 1 
        847 1 111 TYR H    1 111 TYR HD1  . . 4.030 4.224 4.203 4.276 0.246  8  0 "[    .    1]" 1 
        848 1 111 TYR H    1 111 TYR HE2  . . 4.220 4.426 4.397 4.446 0.226  3  0 "[    .    1]" 1 
        849 1 111 TYR H    1 112 ILE H    . . 4.840 4.490 4.478 4.506     .  0  0 "[    .    1]" 1 
        850 1 111 TYR H    1 147 ARG QB   . . 5.810 5.563 5.000 5.827 0.017  6  0 "[    .    1]" 1 
        851 1 111 TYR HA   1 111 TYR HD1  . . 3.090 2.908 2.885 2.933     .  0  0 "[    .    1]" 1 
        852 1 111 TYR HA   1 112 ILE H    . . 3.230 2.515 2.468 2.544     .  0  0 "[    .    1]" 1 
        853 1 111 TYR QB   1 111 TYR HD1  . . 2.980 2.500 2.484 2.507     .  0  0 "[    .    1]" 1 
        854 1 111 TYR QB   1 112 ILE H    . . 3.600 2.329 2.292 2.395     .  0  0 "[    .    1]" 1 
        855 1 111 TYR QB   1 147 ARG QB   . . 3.710 2.389 2.110 2.586     .  0  0 "[    .    1]" 1 
        856 1 111 TYR QB   1 147 ARG QD   . . 4.210 4.182 4.057 4.228 0.018  3  0 "[    .    1]" 1 
        857 1 111 TYR QB   1 147 ARG QG   . . 4.460 2.904 2.474 3.861     .  0  0 "[    .    1]" 1 
        858 1 111 TYR QB   1 148 ILE H    . . 4.800 2.843 2.349 3.163     .  0  0 "[    .    1]" 1 
        859 1 111 TYR QB   1 149 ASP HA   . . 5.460 4.000 3.679 4.161     .  0  0 "[    .    1]" 1 
        860 1 111 TYR HB2  1 112 ILE H    . . 4.300 3.005 2.936 3.114     .  0  0 "[    .    1]" 1 
        861 1 111 TYR HB3  1 112 ILE H    . . 4.300 2.426 2.392 2.489     .  0  0 "[    .    1]" 1 
        862 1 111 TYR HD1  1 112 ILE H    . . 4.310 4.501 4.476 4.514 0.204  9  0 "[    .    1]" 1 
        863 1 111 TYR HD1  1 147 ARG QB   . . 4.580 3.633 2.518 4.032     .  0  0 "[    .    1]" 1 
        864 1 111 TYR HD1  1 147 ARG QD   . . 4.420 3.910 3.517 4.184     .  0  0 "[    .    1]" 1 
        865 1 111 TYR HD1  1 147 ARG HG2  . . 4.960 4.310 3.697 4.935     .  0  0 "[    .    1]" 1 
        866 1 111 TYR HD1  1 147 ARG QG   . . 4.350 2.815 2.407 3.615     .  0  0 "[    .    1]" 1 
        867 1 111 TYR HD1  1 147 ARG HG3  . . 4.960 2.989 2.424 5.100 0.140  8  0 "[    .    1]" 1 
        868 1 111 TYR HD1  1 149 ASP H    . . 4.780 4.510 3.548 4.811 0.031  1  0 "[    .    1]" 1 
        869 1 111 TYR HD1  1 149 ASP HA   . . 3.960 2.823 2.305 3.024     .  0  0 "[    .    1]" 1 
        870 1 111 TYR HD1  1 149 ASP QB   . . 4.000 3.345 2.095 3.892     .  0  0 "[    .    1]" 1 
        871 1 111 TYR HD1  1 150 TYR H    . . 5.040 4.974 4.587 5.160 0.120  8  0 "[    .    1]" 1 
        872 1 111 TYR QE   1 149 ASP QB   . . 4.580 3.951 2.723 4.588 0.008  9  0 "[    .    1]" 1 
        873 1 112 ILE H    1 112 ILE HB   . . 3.510 2.691 2.609 2.764     .  0  0 "[    .    1]" 1 
        874 1 112 ILE H    1 112 ILE MD   . . 4.740 3.371 3.060 3.551     .  0  0 "[    .    1]" 1 
        875 1 112 ILE H    1 112 ILE HG12 . . 4.340 2.317 2.147 2.407     .  0  0 "[    .    1]" 1 
        876 1 112 ILE H    1 112 ILE HG13 . . 4.340 3.775 3.647 3.847     .  0  0 "[    .    1]" 1 
        877 1 112 ILE H    1 112 ILE MG   . . 4.660 3.849 3.828 3.882     .  0  0 "[    .    1]" 1 
        878 1 112 ILE H    1 137 MET ME   . . 5.370 3.887 3.422 4.263     .  0  0 "[    .    1]" 1 
        879 1 112 ILE H    1 147 ARG QB   . . 4.640 4.066 3.799 4.644 0.004  8  0 "[    .    1]" 1 
        880 1 112 ILE H    1 148 ILE H    . . 3.990 2.792 2.376 3.065     .  0  0 "[    .    1]" 1 
        881 1 112 ILE H    1 148 ILE HB   . . 4.170 2.211 1.943 2.737     .  0  0 "[    .    1]" 1 
        882 1 112 ILE H    1 148 ILE MG   . . 4.680 3.667 3.307 3.921     .  0  0 "[    .    1]" 1 
        883 1 112 ILE H    1 149 ASP HA   . . 4.860 4.719 4.401 4.907 0.047  6  0 "[    .    1]" 1 
        884 1 112 ILE HA   1 112 ILE MD   . . 3.750 2.112 2.025 2.211     .  0  0 "[    .    1]" 1 
        885 1 112 ILE HA   1 112 ILE MG   . . 3.530 2.234 2.162 2.340     .  0  0 "[    .    1]" 1 
        886 1 112 ILE HA   1 113 ASP H    . . 2.990 2.192 2.157 2.205     .  0  0 "[    .    1]" 1 
        887 1 112 ILE HB   1 112 ILE MD   . . 3.740 3.228 3.226 3.230     .  0  0 "[    .    1]" 1 
        888 1 112 ILE HB   1 113 ASP H    . . 4.720 3.906 3.846 3.991     .  0  0 "[    .    1]" 1 
        889 1 112 ILE HB   1 148 ILE H    . . 4.840 3.781 3.660 3.956     .  0  0 "[    .    1]" 1 
        890 1 112 ILE HB   1 148 ILE HB   . . 3.710 2.192 1.970 2.564     .  0  0 "[    .    1]" 1 
        891 1 112 ILE HB   1 148 ILE MG   . . 4.100 3.130 2.791 3.578     .  0  0 "[    .    1]" 1 
        892 1 112 ILE MD   1 112 ILE MG   . . 3.150 2.055 1.997 2.154     .  0  0 "[    .    1]" 1 
        893 1 112 ILE MD   1 113 ASP H    . . 4.640 3.812 3.643 3.941     .  0  0 "[    .    1]" 1 
        894 1 112 ILE MD   1 148 ILE MG   . . 4.410 3.398 2.818 3.629     .  0  0 "[    .    1]" 1 
        895 1 112 ILE MG   1 113 ASP H    . . 3.590 2.389 2.216 2.616     .  0  0 "[    .    1]" 1 
        896 1 112 ILE MG   1 116 GLU H    . . 4.490 4.221 4.061 4.392     .  0  0 "[    .    1]" 1 
        897 1 112 ILE MG   1 116 GLU HB2  . . 4.180 2.702 2.364 3.099     .  0  0 "[    .    1]" 1 
        898 1 112 ILE MG   1 116 GLU QB   . . 3.400 2.481 2.162 2.792     .  0  0 "[    .    1]" 1 
        899 1 112 ILE MG   1 116 GLU HB3  . . 4.180 3.086 2.267 3.821     .  0  0 "[    .    1]" 1 
        900 1 112 ILE MG   1 117 LEU H    . . 4.040 3.255 2.676 3.739     .  0  0 "[    .    1]" 1 
        901 1 112 ILE MG   1 117 LEU HA   . . 3.870 3.747 3.165 4.075 0.205  5  0 "[    .    1]" 1 
        902 1 112 ILE MG   1 117 LEU HG   . . 3.530 3.059 2.304 3.565 0.035  2  0 "[    .    1]" 1 
        903 1 113 ASP H    1 113 ASP QB   . . 3.530 2.368 2.233 2.494     .  0  0 "[    .    1]" 1 
        904 1 113 ASP H    1 116 GLU H    . . 4.080 3.793 3.647 3.983     .  0  0 "[    .    1]" 1 
        905 1 113 ASP H    1 116 GLU QB   . . 3.880 2.447 1.918 3.211     .  0  0 "[    .    1]" 1 
        906 1 113 ASP H    1 116 GLU QG   . . 4.510 3.620 2.750 4.013     .  0  0 "[    .    1]" 1 
        907 1 113 ASP H    1 117 LEU HG   . . 5.080 4.658 4.089 5.110 0.030  9  0 "[    .    1]" 1 
        908 1 113 ASP H    1 137 MET ME   . . 5.570 4.649 4.131 4.885     .  0  0 "[    .    1]" 1 
        909 1 113 ASP HA   1 114 LEU H    . . 3.310 2.328 2.185 2.453     .  0  0 "[    .    1]" 1 
        910 1 113 ASP HA   1 115 ASP H    . . 5.060 4.427 3.748 4.775     .  0  0 "[    .    1]" 1 
        911 1 113 ASP QB   1 114 LEU H    . . 3.180 3.030 2.646 3.175     .  0  0 "[    .    1]" 1 
        912 1 113 ASP QB   1 115 ASP H    . . 4.210 2.966 2.247 3.812     .  0  0 "[    .    1]" 1 
        913 1 113 ASP QB   1 116 GLU H    . . 4.210 2.848 2.510 3.856     .  0  0 "[    .    1]" 1 
        914 1 114 LEU H    1 114 LEU QB   . . 2.890 2.722 2.652 2.782     .  0  0 "[    .    1]" 1 
        915 1 114 LEU H    1 114 LEU MD2  . . 4.100 2.611 2.192 3.509     .  0  0 "[    .    1]" 1 
        916 1 114 LEU H    1 115 ASP H    . . 2.950 2.844 2.699 2.908     .  0  0 "[    .    1]" 1 
        917 1 114 LEU H    1 137 MET ME   . . 4.020 3.813 2.370 4.067 0.047  6  0 "[    .    1]" 1 
        918 1 114 LEU HA   1 114 LEU HG   . . 3.900 3.500 3.336 3.664     .  0  0 "[    .    1]" 1 
        919 1 114 LEU HA   1 117 LEU H    . . 4.130 3.371 3.041 3.645     .  0  0 "[    .    1]" 1 
        920 1 114 LEU HA   1 118 LYS H    . . 4.360 3.599 3.245 4.040     .  0  0 "[    .    1]" 1 
        921 1 114 LEU MD2  1 118 LYS QE   . . 4.220 4.040 3.882 4.244 0.024  3  0 "[    .    1]" 1 
        922 1 114 LEU MD2  1 137 MET H    . . 4.160 3.895 3.739 3.981     .  0  0 "[    .    1]" 1 
        923 1 114 LEU HG   1 115 ASP H    . . 3.340 3.592 3.022 3.807 0.467 10  0 "[    .    1]" 1 
        924 1 115 ASP H    1 115 ASP HB2  . . 3.600 2.390 2.129 2.590     .  0  0 "[    .    1]" 1 
        925 1 115 ASP H    1 115 ASP HB3  . . 3.600 3.561 3.444 3.595     .  0  0 "[    .    1]" 1 
        926 1 115 ASP H    1 116 GLU H    . . 3.290 2.717 2.402 2.901     .  0  0 "[    .    1]" 1 
        927 1 115 ASP H    1 117 LEU H    . . 4.820 4.334 3.864 4.656     .  0  0 "[    .    1]" 1 
        928 1 115 ASP HA   1 118 LYS QB   . . 4.110 3.691 2.108 4.146 0.036  7  0 "[    .    1]" 1 
        929 1 115 ASP HA   1 118 LYS QD   . . 4.090 2.336 1.945 2.786     .  0  0 "[    .    1]" 1 
        930 1 115 ASP HA   1 119 ILE H    . . 5.020 4.149 3.512 4.704     .  0  0 "[    .    1]" 1 
        931 1 115 ASP QB   1 116 GLU H    . . 3.540 2.823 2.385 3.026     .  0  0 "[    .    1]" 1 
        932 1 115 ASP QB   1 116 GLU HA   . . 4.190 3.945 3.845 4.031     .  0  0 "[    .    1]" 1 
        933 1 115 ASP QB   1 117 LEU H    . . 5.610 4.891 4.360 5.215     .  0  0 "[    .    1]" 1 
        934 1 115 ASP QB   1 118 LYS QG   . . 5.620 4.038 3.677 5.515     .  0  0 "[    .    1]" 1 
        935 1 115 ASP QB   1 119 ILE MD   . . 5.310 3.414 2.036 4.383     .  0  0 "[    .    1]" 1 
        936 1 115 ASP HB2  1 116 GLU H    . . 4.120 2.941 2.430 3.177     .  0  0 "[    .    1]" 1 
        937 1 115 ASP HB2  1 116 GLU HA   . . 5.070 4.567 4.269 4.955     .  0  0 "[    .    1]" 1 
        938 1 115 ASP HB3  1 116 GLU H    . . 4.120 3.698 3.146 4.059     .  0  0 "[    .    1]" 1 
        939 1 115 ASP HB3  1 116 GLU HA   . . 5.070 4.356 4.021 4.644     .  0  0 "[    .    1]" 1 
        940 1 116 GLU H    1 116 GLU HB2  . . 3.690 2.370 2.177 2.672     .  0  0 "[    .    1]" 1 
        941 1 116 GLU H    1 116 GLU QB   . . 3.090 2.335 2.155 2.606     .  0  0 "[    .    1]" 1 
        942 1 116 GLU H    1 116 GLU HB3  . . 3.690 3.557 3.468 3.626     .  0  0 "[    .    1]" 1 
        943 1 116 GLU H    1 116 GLU QG   . . 4.240 2.677 1.998 3.183     .  0  0 "[    .    1]" 1 
        944 1 116 GLU H    1 117 LEU H    . . 3.330 2.520 2.349 2.864     .  0  0 "[    .    1]" 1 
        945 1 116 GLU H    1 117 LEU QB   . . 5.180 4.813 4.531 5.222 0.042 10  0 "[    .    1]" 1 
        946 1 116 GLU H    1 119 ILE MD   . . 4.630 4.255 3.567 4.635 0.005  1  0 "[    .    1]" 1 
        947 1 116 GLU HA   1 119 ILE H    . . 4.270 3.782 3.624 3.976     .  0  0 "[    .    1]" 1 
        948 1 116 GLU HA   1 119 ILE HB   . . 4.170 3.129 2.531 4.103     .  0  0 "[    .    1]" 1 
        949 1 116 GLU HA   1 119 ILE MD   . . 3.880 2.290 1.897 2.787     .  0  0 "[    .    1]" 1 
        950 1 116 GLU HA   1 119 ILE MG   . . 4.930 4.107 3.611 5.163 0.233 10  0 "[    .    1]" 1 
        951 1 116 GLU QB   1 117 LEU H    . . 4.030 2.596 2.352 2.911     .  0  0 "[    .    1]" 1 
        952 1 116 GLU QB   1 117 LEU HA   . . 4.700 3.859 3.763 3.983     .  0  0 "[    .    1]" 1 
        953 1 116 GLU QB   1 119 ILE MD   . . 4.610 3.949 3.218 4.499     .  0  0 "[    .    1]" 1 
        954 1 116 GLU QG   1 117 LEU H    . . 5.810 4.196 3.824 4.285     .  0  0 "[    .    1]" 1 
        955 1 116 GLU QG   1 119 ILE MD   . . 5.520 3.405 3.032 4.073     .  0  0 "[    .    1]" 1 
        956 1 117 LEU H    1 117 LEU QB   . . 3.430 2.600 2.480 2.667     .  0  0 "[    .    1]" 1 
        957 1 117 LEU H    1 117 LEU HG   . . 3.400 2.014 1.820 2.347     .  0  0 "[    .    1]" 1 
        958 1 117 LEU H    1 118 LYS H    . . 3.760 2.607 2.521 2.667     .  0  0 "[    .    1]" 1 
        959 1 117 LEU H    1 118 LYS QB   . . 5.250 4.646 4.198 4.844     .  0  0 "[    .    1]" 1 
        960 1 117 LEU H    1 118 LYS QG   . . 5.550 4.160 3.475 5.842 0.292 10  0 "[    .    1]" 1 
        961 1 117 LEU H    1 119 ILE HB   . . 5.870 4.917 4.538 5.774     .  0  0 "[    .    1]" 1 
        962 1 117 LEU HA   1 118 LYS HA   . . 5.050 4.804 4.749 4.860     .  0  0 "[    .    1]" 1 
        963 1 117 LEU QB   1 118 LYS H    . . 4.040 2.903 2.319 3.563     .  0  0 "[    .    1]" 1 
        964 1 117 LEU HG   1 118 LYS H    . . 3.920 2.914 1.925 4.091 0.171  4  0 "[    .    1]" 1 
        965 1 118 LYS H    1 118 LYS QB   . . 3.020 2.347 2.057 2.598     .  0  0 "[    .    1]" 1 
        966 1 118 LYS H    1 118 LYS HG2  . . 4.390 2.584 1.878 4.582 0.192 10  0 "[    .    1]" 1 
        967 1 118 LYS H    1 118 LYS QG   . . 3.800 2.463 1.869 3.685     .  0  0 "[    .    1]" 1 
        968 1 118 LYS H    1 118 LYS HG3  . . 4.390 3.631 3.377 3.900     .  0  0 "[    .    1]" 1 
        969 1 118 LYS H    1 119 ILE H    . . 3.730 2.683 2.580 2.816     .  0  0 "[    .    1]" 1 
        970 1 118 LYS H    1 133 ILE MD   . . 4.490 3.208 2.691 3.979     .  0  0 "[    .    1]" 1 
        971 1 118 LYS HA   1 118 LYS HG2  . . 3.840 3.665 2.933 3.857 0.017  9  0 "[    .    1]" 1 
        972 1 118 LYS HA   1 118 LYS HG3  . . 3.840 3.573 2.181 3.919 0.079  4  0 "[    .    1]" 1 
        973 1 118 LYS HA   1 120 MET H    . . 4.790 3.831 3.667 4.238     .  0  0 "[    .    1]" 1 
        974 1 118 LYS HA   1 121 LEU H    . . 4.150 3.384 3.126 3.786     .  0  0 "[    .    1]" 1 
        975 1 118 LYS HA   1 133 ILE MD   . . 3.580 2.795 1.881 3.439     .  0  0 "[    .    1]" 1 
        976 1 118 LYS QD   1 122 GLN QB   . . 5.120 4.774 4.242 5.166 0.046 10  0 "[    .    1]" 1 
        977 1 118 LYS QG   1 119 ILE HA   . . 4.490 3.310 2.952 4.732 0.242 10  0 "[    .    1]" 1 
        978 1 118 LYS QG   1 119 ILE MD   . . 4.630 4.200 3.508 4.700 0.070 10  0 "[    .    1]" 1 
        979 1 118 LYS QG   1 122 GLN QB   . . 4.460 3.647 3.084 4.068     .  0  0 "[    .    1]" 1 
        980 1 119 ILE H    1 119 ILE HB   . . 3.050 2.335 2.103 2.605     .  0  0 "[    .    1]" 1 
        981 1 119 ILE H    1 119 ILE MD   . . 4.200 3.516 2.316 4.013     .  0  0 "[    .    1]" 1 
        982 1 119 ILE H    1 119 ILE MG   . . 4.150 3.602 3.312 3.768     .  0  0 "[    .    1]" 1 
        983 1 119 ILE H    1 121 LEU H    . . 4.900 4.612 4.105 4.841     .  0  0 "[    .    1]" 1 
        984 1 119 ILE HA   1 119 ILE MD   . . 3.910 3.723 3.407 3.839     .  0  0 "[    .    1]" 1 
        985 1 119 ILE HA   1 119 ILE HG12 . . 3.660 2.640 2.486 3.335     .  0  0 "[    .    1]" 1 
        986 1 119 ILE HA   1 119 ILE HG13 . . 3.660 2.533 2.175 3.020     .  0  0 "[    .    1]" 1 
        987 1 119 ILE HA   1 119 ILE MG   . . 3.340 2.620 2.327 2.962     .  0  0 "[    .    1]" 1 
        988 1 119 ILE HA   1 120 MET HA   . . 4.960 4.784 4.737 4.869     .  0  0 "[    .    1]" 1 
        989 1 119 ILE HA   1 122 GLN H    . . 4.370 3.445 3.008 3.703     .  0  0 "[    .    1]" 1 
        990 1 119 ILE HA   1 122 GLN QB   . . 3.720 2.317 1.990 2.632     .  0  0 "[    .    1]" 1 
        991 1 119 ILE HA   1 123 ALA H    . . 5.000 4.701 4.276 5.015 0.015  8  0 "[    .    1]" 1 
        992 1 119 ILE HB   1 119 ILE MD   . . 3.380 2.279 2.023 2.412     .  0  0 "[    .    1]" 1 
        993 1 119 ILE HB   1 120 MET H    . . 3.380 3.034 2.751 3.385 0.005  8  0 "[    .    1]" 1 
        994 1 119 ILE MD   1 120 MET H    . . 5.100 4.746 4.049 5.037     .  0  0 "[    .    1]" 1 
        995 1 119 ILE HG12 1 119 ILE MG   . . 3.560 2.282 1.956 2.369     .  0  0 "[    .    1]" 1 
        996 1 119 ILE HG13 1 119 ILE MG   . . 3.560 3.151 2.830 3.202     .  0  0 "[    .    1]" 1 
        997 1 119 ILE MG   1 120 MET H    . . 4.180 3.109 2.485 3.692     .  0  0 "[    .    1]" 1 
        998 1 119 ILE MG   1 120 MET HA   . . 4.630 3.218 2.823 3.705     .  0  0 "[    .    1]" 1 
        999 1 119 ILE MG   1 123 ALA H    . . 4.910 4.490 4.059 4.921 0.011  8  0 "[    .    1]" 1 
       1000 1 119 ILE MG   1 123 ALA MB   . . 4.140 3.888 3.102 4.160 0.020  4  0 "[    .    1]" 1 
       1001 1 120 MET H    1 121 LEU H    . . 3.660 2.742 2.531 2.886     .  0  0 "[    .    1]" 1 
       1002 1 120 MET HA   1 123 ALA H    . . 4.460 3.793 3.531 4.121     .  0  0 "[    .    1]" 1 
       1003 1 120 MET HA   1 123 ALA MB   . . 4.180 3.503 2.798 4.174     .  0  0 "[    .    1]" 1 
       1004 1 120 MET QG   1 121 LEU H    . . 4.090 3.192 1.940 3.922     .  0  0 "[    .    1]" 1 
       1005 1 120 MET QG   1 123 ALA H    . . 5.690 4.897 4.552 5.576     .  0  0 "[    .    1]" 1 
       1006 1 121 LEU H    1 121 LEU QB   . . 3.030 2.283 2.228 2.378     .  0  0 "[    .    1]" 1 
       1007 1 121 LEU H    1 121 LEU HG   . . 3.640 2.777 2.503 2.974     .  0  0 "[    .    1]" 1 
       1008 1 121 LEU H    1 122 GLN QB   . . 4.780 4.275 4.065 4.504     .  0  0 "[    .    1]" 1 
       1009 1 121 LEU HA   1 124 THR H    . . 4.980 4.101 3.108 4.983 0.003  1  0 "[    .    1]" 1 
       1010 1 121 LEU HA   1 124 THR MG   . . 4.090 2.556 1.893 3.577     .  0  0 "[    .    1]" 1 
       1011 1 121 LEU HG   1 122 GLN H    . . 4.060 2.405 2.238 2.567     .  0  0 "[    .    1]" 1 
       1012 1 121 LEU HG   1 123 ALA H    . . 4.820 4.696 4.604 4.827 0.007  4  0 "[    .    1]" 1 
       1013 1 122 GLN H    1 122 GLN QB   . . 3.030 2.210 2.081 2.279     .  0  0 "[    .    1]" 1 
       1014 1 122 GLN H    1 122 GLN HG2  . . 4.580 4.228 2.868 4.510     .  0  0 "[    .    1]" 1 
       1015 1 122 GLN H    1 122 GLN QG   . . 3.970 3.776 2.774 3.973 0.003  7  0 "[    .    1]" 1 
       1016 1 122 GLN H    1 122 GLN HG3  . . 4.580 4.290 3.690 4.522     .  0  0 "[    .    1]" 1 
       1017 1 122 GLN H    1 123 ALA H    . . 3.190 2.536 2.352 2.664     .  0  0 "[    .    1]" 1 
       1018 1 122 GLN H    1 123 ALA MB   . . 4.570 4.247 4.024 4.533     .  0  0 "[    .    1]" 1 
       1019 1 122 GLN H    1 124 THR MG   . . 5.270 4.548 3.908 5.288 0.018 10  0 "[    .    1]" 1 
       1020 1 122 GLN HA   1 122 GLN QG   . . 3.530 2.351 2.030 2.550     .  0  0 "[    .    1]" 1 
       1021 1 122 GLN QB   1 123 ALA H    . . 4.080 2.978 2.872 3.152     .  0  0 "[    .    1]" 1 
       1022 1 122 GLN QG   1 123 ALA H    . . 4.860 4.177 3.708 4.597     .  0  0 "[    .    1]" 1 
       1023 1 123 ALA H    1 123 ALA MB   . . 2.950 2.299 2.157 2.550     .  0  0 "[    .    1]" 1 
       1024 1 123 ALA H    1 124 THR H    . . 3.590 2.916 2.307 3.589     .  0  0 "[    .    1]" 1 
       1025 1 123 ALA H    1 124 THR MG   . . 4.450 3.561 2.922 4.025     .  0  0 "[    .    1]" 1 
       1026 1 123 ALA MB   1 124 THR H    . . 3.900 3.099 2.028 3.708     .  0  0 "[    .    1]" 1 
       1027 1 123 ALA MB   1 125 GLY H    . . 5.260 4.778 4.234 5.255     .  0  0 "[    .    1]" 1 
       1028 1 124 THR H    1 124 THR MG   . . 3.580 2.289 1.894 2.964     .  0  0 "[    .    1]" 1 
       1029 1 124 THR H    1 125 GLY H    . . 3.320 2.230 1.894 3.023     .  0  0 "[    .    1]" 1 
       1030 1 124 THR MG   1 125 GLY H    . . 4.810 2.491 1.883 3.891     .  0  0 "[    .    1]" 1 
       1031 1 124 THR MG   1 126 GLU H    . . 4.330 2.664 1.931 4.334 0.004  7  0 "[    .    1]" 1 
       1032 1 124 THR MG   1 126 GLU QB   . . 4.720 3.627 2.283 4.686     .  0  0 "[    .    1]" 1 
       1033 1 126 GLU H    1 127 THR H    . . 4.770 3.992 3.229 4.631     .  0  0 "[    .    1]" 1 
       1034 1 126 GLU HA   1 126 GLU QG   . . 3.520 2.364 2.072 3.243     .  0  0 "[    .    1]" 1 
       1035 1 126 GLU QB   1 126 GLU QG   . . 2.190 2.040 2.014 2.084     .  0  0 "[    .    1]" 1 
       1036 1 126 GLU QB   1 127 THR H    . . 4.430 2.357 1.884 3.809     .  0  0 "[    .    1]" 1 
       1037 1 126 GLU QB   1 127 THR HA   . . 4.830 4.235 4.002 4.535     .  0  0 "[    .    1]" 1 
       1038 1 126 GLU QB   1 127 THR MG   . . 4.960 4.080 2.475 4.873     .  0  0 "[    .    1]" 1 
       1039 1 127 THR H    1 127 THR HB   . . 3.970 3.437 3.031 3.809     .  0  0 "[    .    1]" 1 
       1040 1 127 THR H    1 128 ILE H    . . 3.970 2.789 1.888 3.565     .  0  0 "[    .    1]" 1 
       1041 1 127 THR H    1 128 ILE MG   . . 4.130 3.035 2.628 3.873     .  0  0 "[    .    1]" 1 
       1042 1 127 THR HA   1 127 THR MG   . . 3.460 2.653 1.985 3.195     .  0  0 "[    .    1]" 1 
       1043 1 127 THR HA   1 128 ILE H    . . 3.410 2.712 2.318 3.432 0.022  2  0 "[    .    1]" 1 
       1044 1 127 THR HA   1 128 ILE HA   . . 4.570 4.439 4.380 4.596 0.026 10  0 "[    .    1]" 1 
       1045 1 127 THR HA   1 128 ILE MG   . . 4.790 4.328 4.091 4.707     .  0  0 "[    .    1]" 1 
       1046 1 127 THR HB   1 128 ILE H    . . 4.720 4.355 3.903 4.631     .  0  0 "[    .    1]" 1 
       1047 1 127 THR MG   1 128 ILE H    . . 4.460 4.073 3.453 4.417     .  0  0 "[    .    1]" 1 
       1048 1 128 ILE H    1 128 ILE HB   . . 4.020 3.806 3.673 3.861     .  0  0 "[    .    1]" 1 
       1049 1 128 ILE H    1 128 ILE HG12 . . 4.070 2.504 2.113 3.234     .  0  0 "[    .    1]" 1 
       1050 1 128 ILE H    1 128 ILE HG13 . . 4.070 3.258 2.311 3.909     .  0  0 "[    .    1]" 1 
       1051 1 128 ILE H    1 128 ILE MG   . . 3.560 2.852 2.579 3.080     .  0  0 "[    .    1]" 1 
       1052 1 128 ILE H    1 129 THR H    . . 4.590 4.463 4.422 4.556     .  0  0 "[    .    1]" 1 
       1053 1 128 ILE HA   1 128 ILE MD   . . 4.220 3.875 3.554 4.180     .  0  0 "[    .    1]" 1 
       1054 1 128 ILE HA   1 128 ILE MG   . . 3.550 2.337 2.210 2.400     .  0  0 "[    .    1]" 1 
       1055 1 128 ILE HA   1 129 THR H    . . 2.960 2.447 2.259 2.561     .  0  0 "[    .    1]" 1 
       1056 1 128 ILE HB   1 129 THR H    . . 3.930 2.304 2.055 2.782     .  0  0 "[    .    1]" 1 
       1057 1 128 ILE HB   1 132 ASP HB2  . . 4.850 3.425 2.288 4.368     .  0  0 "[    .    1]" 1 
       1058 1 128 ILE HB   1 132 ASP HB3  . . 4.850 3.243 2.308 4.139     .  0  0 "[    .    1]" 1 
       1059 1 128 ILE MG   1 129 THR H    . . 3.900 3.658 3.538 3.910 0.010  8  0 "[    .    1]" 1 
       1060 1 129 THR H    1 129 THR MG   . . 3.300 2.950 2.622 3.302 0.002  1  0 "[    .    1]" 1 
       1061 1 129 THR H    1 132 ASP H    . . 4.410 3.983 3.482 4.311     .  0  0 "[    .    1]" 1 
       1062 1 129 THR H    1 132 ASP HB2  . . 3.700 2.900 1.952 3.594     .  0  0 "[    .    1]" 1 
       1063 1 129 THR H    1 132 ASP HB3  . . 4.430 3.650 2.736 4.252     .  0  0 "[    .    1]" 1 
       1064 1 129 THR HA   1 129 THR MG   . . 2.710 2.205 2.040 2.310     .  0  0 "[    .    1]" 1 
       1065 1 129 THR HA   1 130 GLU H    . . 3.110 2.441 2.367 2.562     .  0  0 "[    .    1]" 1 
       1066 1 129 THR HB   1 131 ASP H    . . 3.490 2.562 2.357 2.731     .  0  0 "[    .    1]" 1 
       1067 1 129 THR MG   1 130 GLU H    . . 4.250 3.339 2.583 3.771     .  0  0 "[    .    1]" 1 
       1068 1 129 THR MG   1 131 ASP H    . . 4.510 4.095 3.468 4.316     .  0  0 "[    .    1]" 1 
       1069 1 130 GLU H    1 130 GLU QB   . . 3.190 2.325 2.151 2.652     .  0  0 "[    .    1]" 1 
       1070 1 130 GLU H    1 130 GLU QG   . . 4.540 2.864 2.019 3.926     .  0  0 "[    .    1]" 1 
       1071 1 130 GLU H    1 131 ASP H    . . 3.650 2.540 2.453 2.706     .  0  0 "[    .    1]" 1 
       1072 1 130 GLU HA   1 130 GLU QG   . . 3.180 2.434 2.090 3.319 0.139  5  0 "[    .    1]" 1 
       1073 1 130 GLU QB   1 131 ASP H    . . 3.300 2.848 2.531 3.354 0.054  5  0 "[    .    1]" 1 
       1074 1 130 GLU QG   1 131 ASP H    . . 4.510 4.058 1.924 4.424     .  0  0 "[    .    1]" 1 
       1075 1 131 ASP H    1 131 ASP HB2  . . 3.730 2.379 2.090 3.585     .  0  0 "[    .    1]" 1 
       1076 1 131 ASP H    1 131 ASP QB   . . 3.000 2.198 2.071 2.367     .  0  0 "[    .    1]" 1 
       1077 1 131 ASP H    1 131 ASP HB3  . . 3.730 3.138 2.401 3.576     .  0  0 "[    .    1]" 1 
       1078 1 131 ASP H    1 132 ASP H    . . 3.260 2.583 2.419 2.784     .  0  0 "[    .    1]" 1 
       1079 1 131 ASP H    1 132 ASP HB2  . . 4.870 4.573 4.219 4.817     .  0  0 "[    .    1]" 1 
       1080 1 131 ASP H    1 133 ILE H    . . 4.690 4.343 4.211 4.463     .  0  0 "[    .    1]" 1 
       1081 1 131 ASP QB   1 132 ASP H    . . 4.390 3.043 2.812 3.668     .  0  0 "[    .    1]" 1 
       1082 1 131 ASP QB   1 134 GLU H    . . 5.410 4.931 4.709 5.102     .  0  0 "[    .    1]" 1 
       1083 1 132 ASP H    1 132 ASP HB2  . . 3.210 2.288 2.087 2.550     .  0  0 "[    .    1]" 1 
       1084 1 132 ASP H    1 132 ASP HB3  . . 3.390 2.911 2.510 3.392 0.002  6  0 "[    .    1]" 1 
       1085 1 132 ASP H    1 133 ILE H    . . 3.500 2.573 2.439 2.769     .  0  0 "[    .    1]" 1 
       1086 1 132 ASP H    1 133 ILE MG   . . 5.710 4.379 4.033 4.613     .  0  0 "[    .    1]" 1 
       1087 1 132 ASP HA   1 134 GLU H    . . 3.840 3.818 3.725 3.874 0.034  8  0 "[    .    1]" 1 
       1088 1 132 ASP HA   1 135 GLU H    . . 3.910 3.546 3.418 3.718     .  0  0 "[    .    1]" 1 
       1089 1 132 ASP HA   1 135 GLU QB   . . 4.330 3.470 3.093 4.169     .  0  0 "[    .    1]" 1 
       1090 1 132 ASP HB2  1 133 ILE H    . . 3.900 3.567 3.170 3.902 0.002  1  0 "[    .    1]" 1 
       1091 1 132 ASP HB3  1 133 ILE H    . . 3.880 2.784 2.587 3.205     .  0  0 "[    .    1]" 1 
       1092 1 132 ASP HB3  1 133 ILE MG   . . 5.120 5.074 4.610 5.207 0.087  4  0 "[    .    1]" 1 
       1093 1 132 ASP HB3  1 134 GLU H    . . 5.880 4.864 4.760 4.989     .  0  0 "[    .    1]" 1 
       1094 1 133 ILE H    1 133 ILE HB   . . 3.540 2.239 2.127 2.403     .  0  0 "[    .    1]" 1 
       1095 1 133 ILE H    1 133 ILE MD   . . 4.410 4.136 3.790 4.377     .  0  0 "[    .    1]" 1 
       1096 1 133 ILE H    1 133 ILE MG   . . 3.630 2.721 2.310 3.012     .  0  0 "[    .    1]" 1 
       1097 1 133 ILE HA   1 133 ILE MG   . . 3.220 3.134 3.080 3.196     .  0  0 "[    .    1]" 1 
       1098 1 133 ILE HA   1 135 GLU H    . . 4.910 4.036 3.687 4.497     .  0  0 "[    .    1]" 1 
       1099 1 133 ILE HA   1 136 LEU H    . . 4.140 3.189 3.073 3.287     .  0  0 "[    .    1]" 1 
       1100 1 133 ILE HA   1 136 LEU HB2  . . 4.410 2.530 2.072 2.775     .  0  0 "[    .    1]" 1 
       1101 1 133 ILE HA   1 136 LEU HB3  . . 4.410 3.866 2.255 4.428 0.018  5  0 "[    .    1]" 1 
       1102 1 133 ILE HA   1 136 LEU HG   . . 4.350 4.218 3.745 4.357 0.007  3  0 "[    .    1]" 1 
       1103 1 133 ILE HA   1 137 MET H    . . 5.360 4.692 3.939 5.108     .  0  0 "[    .    1]" 1 
       1104 1 133 ILE HB   1 133 ILE MD   . . 3.260 2.859 2.041 3.230     .  0  0 "[    .    1]" 1 
       1105 1 133 ILE HB   1 134 GLU H    . . 4.320 3.764 3.613 3.968     .  0  0 "[    .    1]" 1 
       1106 1 133 ILE MG   1 134 GLU H    . . 3.710 2.191 1.999 2.306     .  0  0 "[    .    1]" 1 
       1107 1 133 ILE MG   1 134 GLU HA   . . 3.750 2.973 2.863 3.156     .  0  0 "[    .    1]" 1 
       1108 1 133 ILE MG   1 134 GLU QG   . . 4.310 3.646 3.062 4.219     .  0  0 "[    .    1]" 1 
       1109 1 133 ILE MG   1 137 MET H    . . 4.680 4.669 4.476 4.759 0.079 10  0 "[    .    1]" 1 
       1110 1 133 ILE MG   1 137 MET QB   . . 4.720 4.572 4.258 4.793 0.073  4  0 "[    .    1]" 1 
       1111 1 134 GLU H    1 134 GLU QG   . . 4.100 3.553 3.152 3.917     .  0  0 "[    .    1]" 1 
       1112 1 134 GLU H    1 135 GLU H    . . 3.200 2.712 2.585 2.853     .  0  0 "[    .    1]" 1 
       1113 1 134 GLU HA   1 134 GLU HG2  . . 4.080 2.455 2.026 3.213     .  0  0 "[    .    1]" 1 
       1114 1 134 GLU HA   1 134 GLU QG   . . 3.510 2.157 2.007 2.374     .  0  0 "[    .    1]" 1 
       1115 1 134 GLU HA   1 134 GLU HG3  . . 4.080 2.803 2.042 3.384     .  0  0 "[    .    1]" 1 
       1116 1 134 GLU HA   1 137 MET H    . . 4.190 3.971 3.764 4.200 0.010  2  0 "[    .    1]" 1 
       1117 1 135 GLU H    1 135 GLU QB   . . 2.550 2.171 2.072 2.396     .  0  0 "[    .    1]" 1 
       1118 1 135 GLU H    1 135 GLU QG   . . 4.590 3.471 2.440 4.013     .  0  0 "[    .    1]" 1 
       1119 1 135 GLU HA   1 135 GLU QG   . . 3.650 2.268 2.052 2.469     .  0  0 "[    .    1]" 1 
       1120 1 135 GLU QB   1 136 LEU H    . . 3.420 2.862 2.717 2.923     .  0  0 "[    .    1]" 1 
       1121 1 135 GLU QG   1 136 LEU H    . . 5.030 4.487 4.222 4.674     .  0  0 "[    .    1]" 1 
       1122 1 136 LEU H    1 136 LEU HB2  . . 3.470 2.098 2.040 2.560     .  0  0 "[    .    1]" 1 
       1123 1 136 LEU H    1 136 LEU HB3  . . 3.470 3.182 2.446 3.348     .  0  0 "[    .    1]" 1 
       1124 1 136 LEU H    1 136 LEU MD1  . . 4.130 3.726 3.562 3.988     .  0  0 "[    .    1]" 1 
       1125 1 136 LEU H    1 137 MET H    . . 3.240 2.900 2.693 3.002     .  0  0 "[    .    1]" 1 
       1126 1 136 LEU HA   1 156 PHE QE   . . 5.370 3.780 3.241 4.503     .  0  0 "[    .    1]" 1 
       1127 1 136 LEU QB   1 137 MET H    . . 3.120 2.373 2.210 2.928     .  0  0 "[    .    1]" 1 
       1128 1 136 LEU QB   1 156 PHE QE   . . 5.040 3.960 2.863 4.682     .  0  0 "[    .    1]" 1 
       1129 1 136 LEU HB2  1 137 MET H    . . 3.580 3.050 2.787 3.704 0.124  6  0 "[    .    1]" 1 
       1130 1 136 LEU HB3  1 137 MET H    . . 3.580 2.501 2.228 3.174     .  0  0 "[    .    1]" 1 
       1131 1 136 LEU MD2  1 156 PHE HE1  . . 3.920 2.365 1.910 2.953     .  0  0 "[    .    1]" 1 
       1132 1 137 MET H    1 137 MET QB   . . 3.400 2.205 2.040 2.255     .  0  0 "[    .    1]" 1 
       1133 1 137 MET H    1 138 LYS H    . . 3.270 2.771 2.628 2.910     .  0  0 "[    .    1]" 1 
       1134 1 137 MET HA   1 140 GLY H    . . 4.090 3.420 2.982 3.784     .  0  0 "[    .    1]" 1 
       1135 1 137 MET HA   1 148 ILE MD   . . 3.870 3.140 2.383 3.659     .  0  0 "[    .    1]" 1 
       1136 1 137 MET QB   1 140 GLY H    . . 5.750 4.916 4.494 5.389     .  0  0 "[    .    1]" 1 
       1137 1 137 MET ME   1 140 GLY H    . . 5.620 5.451 5.048 5.639 0.019  2  0 "[    .    1]" 1 
       1138 1 137 MET ME   1 141 ASP H    . . 5.250 4.660 3.998 5.250     .  8  0 "[    .    1]" 1 
       1139 1 137 MET ME   1 147 ARG H    . . 4.810 4.490 4.114 4.816 0.006  9  0 "[    .    1]" 1 
       1140 1 137 MET ME   1 147 ARG HA   . . 3.050 2.276 1.914 3.060 0.010  4  0 "[    .    1]" 1 
       1141 1 137 MET ME   1 148 ILE H    . . 3.820 2.540 2.319 2.831     .  0  0 "[    .    1]" 1 
       1142 1 137 MET ME   1 148 ILE MD   . . 3.930 2.644 1.933 3.587     .  0  0 "[    .    1]" 1 
       1143 1 138 LYS H    1 138 LYS QG   . . 4.420 3.450 2.267 4.046     .  0  0 "[    .    1]" 1 
       1144 1 138 LYS HA   1 138 LYS QD   . . 3.050 2.429 1.965 3.021     .  0  0 "[    .    1]" 1 
       1145 1 138 LYS HA   1 138 LYS QG   . . 3.510 2.471 2.172 2.719     .  0  0 "[    .    1]" 1 
       1146 1 138 LYS HA   1 139 ASP HA   . . 4.710 4.710 4.665 4.771 0.061  4  0 "[    .    1]" 1 
       1147 1 139 ASP H    1 139 ASP QB   . . 2.940 2.258 2.084 2.549     .  0  0 "[    .    1]" 1 
       1148 1 139 ASP H    1 140 GLY H    . . 3.030 2.515 2.333 2.760     .  0  0 "[    .    1]" 1 
       1149 1 139 ASP QB   1 140 GLY H    . . 4.230 2.866 2.278 3.389     .  0  0 "[    .    1]" 1 
       1150 1 140 GLY H    1 141 ASP QB   . . 5.120 4.407 3.816 4.685     .  0  0 "[    .    1]" 1 
       1151 1 140 GLY H    1 148 ILE MD   . . 4.670 3.925 3.053 4.352     .  0  0 "[    .    1]" 1 
       1152 1 140 GLY QA   1 148 ILE MD   . . 3.870 2.325 1.875 2.586     .  0  0 "[    .    1]" 1 
       1153 1 140 GLY QA   1 156 PHE QB   . . 4.670 3.914 3.291 4.573     .  0  0 "[    .    1]" 1 
       1154 1 140 GLY QA   1 156 PHE HD1  . . 3.800 2.846 2.377 3.297     .  0  0 "[    .    1]" 1 
       1155 1 141 ASP H    1 141 ASP HB2  . . 4.030 2.588 2.195 3.697     .  0  0 "[    .    1]" 1 
       1156 1 141 ASP H    1 141 ASP QB   . . 3.220 2.256 2.137 2.692     .  0  0 "[    .    1]" 1 
       1157 1 141 ASP H    1 141 ASP HB3  . . 4.030 2.663 2.278 2.939     .  0  0 "[    .    1]" 1 
       1158 1 141 ASP H    1 148 ILE MD   . . 4.480 3.604 2.686 4.250     .  0  0 "[    .    1]" 1 
       1159 1 141 ASP HA   1 142 LYS H    . . 3.030 2.328 2.149 2.817     .  0  0 "[    .    1]" 1 
       1160 1 141 ASP HA   1 143 ASN H    . . 4.270 3.668 3.219 4.128     .  0  0 "[    .    1]" 1 
       1161 1 141 ASP HA   1 148 ILE MD   . . 4.530 3.910 3.291 4.649 0.119  3  0 "[    .    1]" 1 
       1162 1 141 ASP QB   1 148 ILE MD   . . 5.090 4.016 2.984 5.015     .  0  0 "[    .    1]" 1 
       1163 1 142 LYS H    1 142 LYS QB   . . 3.210 2.520 2.258 2.860     .  0  0 "[    .    1]" 1 
       1164 1 142 LYS H    1 142 LYS QG   . . 4.310 4.145 3.994 4.309     .  0  0 "[    .    1]" 1 
       1165 1 142 LYS H    1 143 ASN H    . . 2.920 2.046 1.870 2.696     .  0  0 "[    .    1]" 1 
       1166 1 142 LYS H    1 152 GLU QB   . . 4.310 3.808 3.186 4.324 0.014  8  0 "[    .    1]" 1 
       1167 1 142 LYS H    1 152 GLU QG   . . 4.110 2.280 1.869 3.974     .  0  0 "[    .    1]" 1 
       1168 1 142 LYS HA   1 142 LYS QD   . . 3.410 2.453 1.948 3.074     .  0  0 "[    .    1]" 1 
       1169 1 142 LYS HA   1 142 LYS QG   . . 3.630 2.522 2.143 3.021     .  0  0 "[    .    1]" 1 
       1170 1 142 LYS QB   1 143 ASN H    . . 3.610 3.009 2.566 3.633 0.023  2  0 "[    .    1]" 1 
       1171 1 142 LYS QB   1 143 ASN QB   . . 5.020 4.314 3.985 4.574     .  0  0 "[    .    1]" 1 
       1172 1 142 LYS QB   1 144 ASN H    . . 5.620 4.615 2.731 5.712 0.092 10  0 "[    .    1]" 1 
       1173 1 142 LYS QD   1 143 ASN H    . . 5.130 4.660 4.123 5.103     .  0  0 "[    .    1]" 1 
       1174 1 142 LYS QG   1 143 ASN H    . . 5.200 4.379 3.904 4.841     .  0  0 "[    .    1]" 1 
       1175 1 143 ASN H    1 143 ASN HB2  . . 4.030 2.567 2.089 3.520     .  0  0 "[    .    1]" 1 
       1176 1 143 ASN H    1 143 ASN QB   . . 3.450 2.366 2.070 3.326     .  0  0 "[    .    1]" 1 
       1177 1 143 ASN H    1 143 ASN HB3  . . 4.030 3.152 2.404 4.092 0.062  8  0 "[    .    1]" 1 
       1178 1 143 ASN H    1 144 ASN H    . . 3.080 2.723 2.469 3.113 0.033  5  0 "[    .    1]" 1 
       1179 1 143 ASN H    1 144 ASN HA   . . 4.950 4.848 4.652 5.108 0.158  8  0 "[    .    1]" 1 
       1180 1 143 ASN H    1 144 ASN QB   . . 5.400 5.023 4.900 5.284     .  0  0 "[    .    1]" 1 
       1181 1 143 ASN H    1 145 ASP H    . . 4.860 4.292 3.291 4.898 0.038 10  0 "[    .    1]" 1 
       1182 1 143 ASN H    1 152 GLU QB   . . 4.550 4.533 4.329 4.747 0.197  8  0 "[    .    1]" 1 
       1183 1 143 ASN H    1 152 GLU QG   . . 4.610 2.898 2.527 4.317     .  0  0 "[    .    1]" 1 
       1184 1 143 ASN QB   1 144 ASN H    . . 4.180 3.010 1.968 3.716     .  0  0 "[    .    1]" 1 
       1185 1 143 ASN HB2  1 144 ASN H    . . 4.780 3.582 2.152 4.499     .  0  0 "[    .    1]" 1 
       1186 1 143 ASN HB3  1 144 ASN H    . . 4.780 3.416 1.978 4.397     .  0  0 "[    .    1]" 1 
       1187 1 144 ASN H    1 144 ASN HA   . . 2.900 2.476 2.274 2.794     .  0  0 "[    .    1]" 1 
       1188 1 144 ASN H    1 144 ASN HB2  . . 4.140 3.244 2.960 3.758     .  0  0 "[    .    1]" 1 
       1189 1 144 ASN H    1 144 ASN QB   . . 3.510 2.982 2.870 3.117     .  0  0 "[    .    1]" 1 
       1190 1 144 ASN H    1 144 ASN HB3  . . 4.140 3.668 3.150 4.087     .  0  0 "[    .    1]" 1 
       1191 1 144 ASN H    1 145 ASP H    . . 3.470 2.460 1.742 3.283     .  0  0 "[    .    1]" 1 
       1192 1 144 ASN HA   1 145 ASP H    . . 3.530 2.972 2.272 3.517     .  0  0 "[    .    1]" 1 
       1193 1 144 ASN HA   1 146 GLY H    . . 4.020 3.765 3.217 4.064 0.044  9  0 "[    .    1]" 1 
       1194 1 145 ASP H    1 146 GLY H    . . 3.180 2.216 1.654 2.787     .  0  0 "[    .    1]" 1 
       1195 1 145 ASP H    1 146 GLY QA   . . 4.880 4.089 3.567 4.626     .  0  0 "[    .    1]" 1 
       1196 1 145 ASP HA   1 147 ARG QD   . . 4.810 4.710 4.465 4.824 0.014  9  0 "[    .    1]" 1 
       1197 1 145 ASP QB   1 147 ARG QD   . . 4.510 2.728 1.966 3.468     .  0  0 "[    .    1]" 1 
       1198 1 145 ASP HB2  1 146 GLY H    . . 4.740 3.674 2.624 4.428     .  0  0 "[    .    1]" 1 
       1199 1 145 ASP HB3  1 146 GLY H    . . 4.740 4.147 3.719 4.543     .  0  0 "[    .    1]" 1 
       1200 1 146 GLY H    1 147 ARG H    . . 3.240 2.379 1.989 2.816     .  0  0 "[    .    1]" 1 
       1201 1 147 ARG H    1 147 ARG QB   . . 3.560 3.038 2.574 3.255     .  0  0 "[    .    1]" 1 
       1202 1 147 ARG H    1 147 ARG QG   . . 3.500 2.454 2.029 3.718 0.218  8  0 "[    .    1]" 1 
       1203 1 147 ARG H    1 148 ILE H    . . 5.020 4.382 4.180 4.519     .  0  0 "[    .    1]" 1 
       1204 1 147 ARG HA   1 148 ILE H    . . 3.340 2.319 2.166 2.429     .  0  0 "[    .    1]" 1 
       1205 1 147 ARG HB2  1 148 ILE H    . . 4.460 2.816 2.419 4.334     .  0  0 "[    .    1]" 1 
       1206 1 147 ARG HB3  1 148 ILE H    . . 4.460 3.843 3.249 4.151     .  0  0 "[    .    1]" 1 
       1207 1 147 ARG QG   1 148 ILE H    . . 4.440 3.628 3.374 4.202     .  0  0 "[    .    1]" 1 
       1208 1 148 ILE H    1 148 ILE HB   . . 3.400 2.619 2.292 2.761     .  0  0 "[    .    1]" 1 
       1209 1 148 ILE H    1 148 ILE MD   . . 4.520 3.575 3.253 3.899     .  0  0 "[    .    1]" 1 
       1210 1 148 ILE H    1 148 ILE HG12 . . 4.280 2.838 2.068 4.144     .  0  0 "[    .    1]" 1 
       1211 1 148 ILE H    1 148 ILE HG13 . . 4.280 2.868 2.071 3.619     .  0  0 "[    .    1]" 1 
       1212 1 148 ILE H    1 148 ILE MG   . . 4.780 3.778 3.641 3.817     .  0  0 "[    .    1]" 1 
       1213 1 148 ILE HA   1 148 ILE MD   . . 4.150 3.125 2.099 3.810     .  0  0 "[    .    1]" 1 
       1214 1 148 ILE HA   1 148 ILE MG   . . 3.470 2.293 2.216 2.573     .  0  0 "[    .    1]" 1 
       1215 1 148 ILE HA   1 149 ASP H    . . 3.100 2.186 2.153 2.202     .  0  0 "[    .    1]" 1 
       1216 1 148 ILE HA   1 152 GLU H    . . 5.300 4.569 4.081 4.913     .  0  0 "[    .    1]" 1 
       1217 1 148 ILE HA   1 152 GLU QB   . . 4.490 2.502 2.228 2.904     .  0  0 "[    .    1]" 1 
       1218 1 148 ILE HB   1 148 ILE MD   . . 3.750 2.760 2.337 3.226     .  0  0 "[    .    1]" 1 
       1219 1 148 ILE MD   1 148 ILE MG   . . 3.280 1.936 1.874 2.030     .  0  0 "[    .    1]" 1 
       1220 1 148 ILE MD   1 156 PHE HE1  . . 4.350 4.030 3.467 4.230     .  0  0 "[    .    1]" 1 
       1221 1 148 ILE MG   1 149 ASP H    . . 3.920 2.712 2.297 3.152     .  0  0 "[    .    1]" 1 
       1222 1 148 ILE MG   1 151 ASP H    . . 5.400 4.298 3.786 5.494 0.094  9  0 "[    .    1]" 1 
       1223 1 148 ILE MG   1 152 GLU H    . . 4.610 3.624 3.089 3.954     .  0  0 "[    .    1]" 1 
       1224 1 148 ILE MG   1 152 GLU QB   . . 3.490 2.180 1.912 2.542     .  0  0 "[    .    1]" 1 
       1225 1 148 ILE MG   1 152 GLU QG   . . 5.070 3.947 3.387 4.402     .  0  0 "[    .    1]" 1 
       1226 1 149 ASP H    1 152 GLU H    . . 4.340 3.167 2.794 3.673     .  0  0 "[    .    1]" 1 
       1227 1 149 ASP H    1 152 GLU QB   . . 3.750 2.278 1.819 3.105     .  0  0 "[    .    1]" 1 
       1228 1 149 ASP H    1 152 GLU QG   . . 4.670 3.736 3.249 4.263     .  0  0 "[    .    1]" 1 
       1229 1 149 ASP HA   1 150 TYR H    . . 3.500 2.717 2.578 2.832     .  0  0 "[    .    1]" 1 
       1230 1 149 ASP QB   1 151 ASP H    . . 4.840 3.635 2.293 4.544     .  0  0 "[    .    1]" 1 
       1231 1 149 ASP HB2  1 150 TYR H    . . 3.880 3.050 1.961 3.706     .  0  0 "[    .    1]" 1 
       1232 1 149 ASP HB3  1 150 TYR H    . . 3.880 2.663 1.949 3.765     .  0  0 "[    .    1]" 1 
       1233 1 150 TYR H    1 150 TYR HD1  . . 4.910 4.706 4.568 4.869     .  0  0 "[    .    1]" 1 
       1234 1 150 TYR H    1 151 ASP H    . . 3.630 3.405 2.457 3.661 0.031  4  0 "[    .    1]" 1 
       1235 1 150 TYR HD1  1 151 ASP H    . . 4.110 3.770 3.616 4.145 0.035  9  0 "[    .    1]" 1 
       1236 1 150 TYR HD1  1 151 ASP HA   . . 4.420 3.679 3.477 4.127     .  0  0 "[    .    1]" 1 
       1237 1 150 TYR HD1  1 154 LEU MD1  . . 3.780 3.503 3.020 3.695     .  0  0 "[    .    1]" 1 
       1238 1 150 TYR HD1  1 154 LEU MD2  . . 4.120 3.591 3.358 3.972     .  0  0 "[    .    1]" 1 
       1239 1 150 TYR HE1  1 154 LEU MD1  . . 4.000 3.794 3.635 3.852     .  0  0 "[    .    1]" 1 
       1240 1 151 ASP H    1 152 GLU H    . . 3.390 1.970 1.882 2.272     .  0  0 "[    .    1]" 1 
       1241 1 151 ASP H    1 152 GLU QB   . . 3.770 3.796 3.664 3.977 0.207  8  0 "[    .    1]" 1 
       1242 1 151 ASP H    1 154 LEU HG   . . 5.700 4.042 3.601 4.663     .  0  0 "[    .    1]" 1 
       1243 1 151 ASP HA   1 154 LEU H    . . 4.190 3.921 3.683 4.147     .  0  0 "[    .    1]" 1 
       1244 1 151 ASP HA   1 154 LEU QB   . . 4.420 4.034 3.646 4.359     .  0  0 "[    .    1]" 1 
       1245 1 151 ASP HA   1 154 LEU MD1  . . 4.760 2.520 1.923 2.843     .  0  0 "[    .    1]" 1 
       1246 1 151 ASP HA   1 154 LEU MD2  . . 4.760 3.926 3.646 4.519     .  0  0 "[    .    1]" 1 
       1247 1 151 ASP HA   1 154 LEU HG   . . 4.830 2.750 2.346 3.590     .  0  0 "[    .    1]" 1 
       1248 1 151 ASP HA   1 155 GLU H    . . 5.640 5.090 4.632 5.561     .  0  0 "[    .    1]" 1 
       1249 1 152 GLU H    1 152 GLU QB   . . 3.290 2.242 2.088 2.513     .  0  0 "[    .    1]" 1 
       1250 1 152 GLU H    1 152 GLU QG   . . 4.120 3.166 2.349 3.796     .  0  0 "[    .    1]" 1 
       1251 1 152 GLU H    1 154 LEU HG   . . 5.280 4.497 4.206 5.040     .  0  0 "[    .    1]" 1 
       1252 1 152 GLU HA   1 152 GLU QG   . . 3.420 2.254 2.000 2.528     .  0  0 "[    .    1]" 1 
       1253 1 154 LEU H    1 154 LEU QB   . . 3.330 2.684 2.562 2.730     .  0  0 "[    .    1]" 1 
       1254 1 154 LEU H    1 154 LEU MD1  . . 4.330 3.523 3.004 3.636     .  0  0 "[    .    1]" 1 
       1255 1 154 LEU H    1 154 LEU MD2  . . 4.330 2.749 2.494 3.631     .  0  0 "[    .    1]" 1 
       1256 1 154 LEU H    1 155 GLU H    . . 3.790 2.612 2.471 2.754     .  0  0 "[    .    1]" 1 
       1257 1 154 LEU H    1 156 PHE H    . . 4.490 3.597 3.521 3.710     .  0  0 "[    .    1]" 1 
       1258 1 154 LEU HA   1 154 LEU HG   . . 3.590 3.409 2.926 3.540     .  0  0 "[    .    1]" 1 
       1259 1 154 LEU HA   1 157 MET H    . . 5.120 4.798 4.610 5.021     .  0  0 "[    .    1]" 1 
       1260 1 154 LEU QB   1 155 GLU H    . . 3.820 2.359 2.148 2.700     .  0  0 "[    .    1]" 1 
       1261 1 154 LEU QB   1 156 PHE H    . . 4.900 4.232 4.119 4.422     .  0  0 "[    .    1]" 1 
       1262 1 154 LEU MD1  1 155 GLU H    . . 5.260 4.144 3.885 4.459     .  0  0 "[    .    1]" 1 
       1263 1 154 LEU MD2  1 155 GLU H    . . 5.260 4.399 4.277 4.869     .  0  0 "[    .    1]" 1 
       1264 1 154 LEU HG   1 155 GLU H    . . 4.180 3.698 3.515 4.151     .  0  0 "[    .    1]" 1 
       1265 1 154 LEU HG   1 156 PHE H    . . 5.400 5.325 5.214 5.460 0.060  8  0 "[    .    1]" 1 
       1266 1 155 GLU H    1 155 GLU QB   . . 3.190 2.295 2.111 2.526     .  0  0 "[    .    1]" 1 
       1267 1 155 GLU H    1 155 GLU QG   . . 4.300 2.994 2.026 3.856     .  0  0 "[    .    1]" 1 
       1268 1 155 GLU H    1 156 PHE H    . . 3.550 2.525 2.386 2.586     .  0  0 "[    .    1]" 1 
       1269 1 155 GLU H    1 156 PHE QB   . . 5.140 4.237 4.111 4.288     .  0  0 "[    .    1]" 1 
       1270 1 155 GLU H    1 157 MET H    . . 5.330 5.260 5.207 5.315     .  0  0 "[    .    1]" 1 
       1271 1 155 GLU QB   1 156 PHE H    . . 3.700 3.384 3.206 3.764 0.064  2  0 "[    .    1]" 1 
       1272 1 155 GLU QB   1 158 LYS H    . . 5.810 4.783 4.435 5.576     .  0  0 "[    .    1]" 1 
       1273 1 155 GLU QG   1 156 PHE H    . . 4.880 3.956 2.624 4.724     .  0  0 "[    .    1]" 1 
       1274 1 156 PHE H    1 156 PHE HB2  . . 3.400 2.124 2.105 2.179     .  0  0 "[    .    1]" 1 
       1275 1 156 PHE H    1 156 PHE HB3  . . 3.400 3.129 2.998 3.186     .  0  0 "[    .    1]" 1 
       1276 1 156 PHE H    1 156 PHE HD1  . . 4.650 4.550 4.485 4.594     .  0  0 "[    .    1]" 1 
       1277 1 156 PHE H    1 157 MET H    . . 3.670 3.180 3.115 3.214     .  0  0 "[    .    1]" 1 
       1278 1 156 PHE H    1 158 LYS H    . . 5.300 4.429 3.911 5.097     .  0  0 "[    .    1]" 1 
       1279 1 156 PHE HA   1 156 PHE HD1  . . 3.530 2.120 2.026 2.188     .  0  0 "[    .    1]" 1 
       1280 1 156 PHE HA   1 156 PHE HE1  . . 4.110 4.267 4.239 4.295 0.185  5  0 "[    .    1]" 1 
       1281 1 156 PHE QB   1 156 PHE HD1  . . 3.260 2.954 2.917 3.022     .  0  0 "[    .    1]" 1 
       1282 1 156 PHE QB   1 157 MET H    . . 3.410 2.053 2.007 2.096     .  0  0 "[    .    1]" 1 
       1283 1 156 PHE HB2  1 157 MET H    . . 4.160 3.168 3.096 3.301     .  0  0 "[    .    1]" 1 
       1284 1 156 PHE HB3  1 157 MET H    . . 4.160 2.080 2.024 2.130     .  0  0 "[    .    1]" 1 
       1285 1 156 PHE HD1  1 157 MET H    . . 3.990 4.196 4.107 4.251 0.261  1  0 "[    .    1]" 1 
       1286 1 156 PHE HD1  1 157 MET HA   . . 4.830 4.319 4.136 4.421     .  0  0 "[    .    1]" 1 
       1287 1 156 PHE HD1  1 157 MET ME   . . 5.040 3.628 3.286 4.168     .  0  0 "[    .    1]" 1 
       1288 1 156 PHE QE   1 157 MET ME   . . 4.180 4.109 3.847 4.286 0.106  3  0 "[    .    1]" 1 
       1289 1 157 MET H    1 158 LYS H    . . 3.580 2.916 2.232 3.623 0.043  1  0 "[    .    1]" 1 
       1290 1 157 MET H    1 158 LYS QD   . . 5.750 4.957 4.004 5.759 0.009  4  0 "[    .    1]" 1 
       1291 1 157 MET HA   1 157 MET ME   . . 4.050 3.752 3.369 3.869     .  0  0 "[    .    1]" 1 
       1292 1 158 LYS H    1 158 LYS QD   . . 3.720 3.388 2.581 3.828 0.108  9  0 "[    .    1]" 1 
       1293 1 158 LYS H    1 159 GLY H    . . 4.150 3.518 2.397 4.360 0.210  2  0 "[    .    1]" 1 
       1294 1 158 LYS HA   1 159 GLY H    . . 3.360 2.760 2.145 3.557 0.197  7  0 "[    .    1]" 1 
       1295 1 158 LYS QB   1 159 GLY QA   . . 4.480 4.071 3.573 4.439     .  0  0 "[    .    1]" 1 
       1296 1 159 GLY H    1 160 VAL H    . . 3.720 2.612 1.908 3.722 0.002  2  0 "[    .    1]" 1 
       1297 1 159 GLY QA   1 160 VAL H    . . 3.100 2.604 2.116 2.863     .  0  0 "[    .    1]" 1 
       1298 1 160 VAL H    1 160 VAL HB   . . 3.820 2.941 2.595 3.638     .  0  0 "[    .    1]" 1 
       1299 1 160 VAL H    1 161 GLU H    . . 4.780 4.550 4.434 4.626     .  0  0 "[    .    1]" 1 
       1300 1 160 VAL HA   1 160 VAL MG1  . . 3.600 2.393 2.220 3.184     .  0  0 "[    .    1]" 1 
       1301 1 160 VAL HA   1 160 VAL MG2  . . 3.600 2.622 2.305 3.203     .  0  0 "[    .    1]" 1 
       1302 1 160 VAL HA   1 161 GLU H    . . 2.780 2.225 2.143 2.393     .  0  0 "[    .    1]" 1 
       1303 1 160 VAL HB   1 161 GLU H    . . 4.170 3.600 2.426 4.172 0.002  7  0 "[    .    1]" 1 
       1304 1 160 VAL MG1  1 161 GLU H    . . 4.630 2.977 2.035 3.932     .  0  0 "[    .    1]" 1 
       1305 1 160 VAL MG2  1 161 GLU H    . . 4.630 3.715 2.211 4.153     .  0  0 "[    .    1]" 1 
    stop_

save_



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