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
416684 2dk9 7058 cing 4-filtered-FRED Wattos check violation distance


data_2dk9


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              1533
    _Distance_constraint_stats_list.Viol_count                    652
    _Distance_constraint_stats_list.Viol_total                    170.673
    _Distance_constraint_stats_list.Viol_max                      0.075
    _Distance_constraint_stats_list.Viol_rms                      0.0027
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0003
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0131
    _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  10 GLY 0.020 0.011  7 0 "[    .    1    .    2]" 
       1  11 SER 0.021 0.010  4 0 "[    .    1    .    2]" 
       1  12 ALA 0.009 0.009  4 0 "[    .    1    .    2]" 
       1  13 GLY 0.020 0.011  7 0 "[    .    1    .    2]" 
       1  14 THR 0.039 0.010  4 0 "[    .    1    .    2]" 
       1  15 GLN 0.009 0.009  4 0 "[    .    1    .    2]" 
       1  16 GLU 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  17 GLU 0.035 0.011  9 0 "[    .    1    .    2]" 
       1  18 LEU 0.009 0.003 17 0 "[    .    1    .    2]" 
       1  19 LEU 0.017 0.011  9 0 "[    .    1    .    2]" 
       1  20 ARG 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  21 TRP 0.001 0.001  4 0 "[    .    1    .    2]" 
       1  22 CYS 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  23 GLN 0.210 0.033  9 0 "[    .    1    .    2]" 
       1  24 GLU 0.001 0.001  4 0 "[    .    1    .    2]" 
       1  25 GLN 0.020 0.006  8 0 "[    .    1    .    2]" 
       1  26 THR 0.220 0.033  9 0 "[    .    1    .    2]" 
       1  27 ALA 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  28 GLY 0.008 0.005 18 0 "[    .    1    .    2]" 
       1  29 TYR 0.286 0.019 11 0 "[    .    1    .    2]" 
       1  30 PRO 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  31 GLY 0.541 0.060 15 0 "[    .    1    .    2]" 
       1  32 VAL 0.096 0.026  8 0 "[    .    1    .    2]" 
       1  33 HIS 0.547 0.060 15 0 "[    .    1    .    2]" 
       1  34 VAL 0.158 0.025  3 0 "[    .    1    .    2]" 
       1  35 SER 0.487 0.043  4 0 "[    .    1    .    2]" 
       1  36 ASP 0.548 0.043  4 0 "[    .    1    .    2]" 
       1  37 LEU 0.307 0.026 13 0 "[    .    1    .    2]" 
       1  38 SER 0.258 0.019 11 0 "[    .    1    .    2]" 
       1  39 SER 0.008 0.005 11 0 "[    .    1    .    2]" 
       1  40 SER 0.011 0.005 10 0 "[    .    1    .    2]" 
       1  41 TRP 0.019 0.007  6 0 "[    .    1    .    2]" 
       1  42 ALA 0.145 0.015 14 0 "[    .    1    .    2]" 
       1  43 ASP 0.605 0.048 16 0 "[    .    1    .    2]" 
       1  44 GLY 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  45 LEU 0.153 0.019 14 0 "[    .    1    .    2]" 
       1  46 ALA 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  47 LEU 0.005 0.004 17 0 "[    .    1    .    2]" 
       1  48 CYS 0.009 0.005 11 0 "[    .    1    .    2]" 
       1  49 ALA 0.294 0.019 11 0 "[    .    1    .    2]" 
       1  50 LEU 0.065 0.014 18 0 "[    .    1    .    2]" 
       1  51 VAL 0.039 0.009 20 0 "[    .    1    .    2]" 
       1  52 TYR 0.177 0.020 19 0 "[    .    1    .    2]" 
       1  53 ARG 0.012 0.004 20 0 "[    .    1    .    2]" 
       1  54 LEU 0.113 0.017 19 0 "[    .    1    .    2]" 
       1  55 GLN 0.566 0.035 18 0 "[    .    1    .    2]" 
       1  56 PRO 0.288 0.055  2 0 "[    .    1    .    2]" 
       1  57 GLY 0.353 0.055  2 0 "[    .    1    .    2]" 
       1  58 LEU 0.415 0.035 18 0 "[    .    1    .    2]" 
       1  59 LEU 0.177 0.022 18 0 "[    .    1    .    2]" 
       1  60 GLU 0.049 0.010 19 0 "[    .    1    .    2]" 
       1  61 PRO 0.072 0.014  1 0 "[    .    1    .    2]" 
       1  62 SER 0.461 0.042  6 0 "[    .    1    .    2]" 
       1  63 GLU 0.499 0.042  6 0 "[    .    1    .    2]" 
       1  64 LEU 0.167 0.019 14 0 "[    .    1    .    2]" 
       1  65 GLN 1.639 0.075 12 0 "[    .    1    .    2]" 
       1  66 GLY 1.048 0.048 16 0 "[    .    1    .    2]" 
       1  67 LEU 1.151 0.075 12 0 "[    .    1    .    2]" 
       1  68 GLY 1.111 0.055 13 0 "[    .    1    .    2]" 
       1  69 ALA 0.052 0.015 13 0 "[    .    1    .    2]" 
       1  70 LEU 0.006 0.004  5 0 "[    .    1    .    2]" 
       1  71 GLU 0.005 0.003  9 0 "[    .    1    .    2]" 
       1  72 ALA 0.148 0.038 14 0 "[    .    1    .    2]" 
       1  73 THR 0.002 0.001 14 0 "[    .    1    .    2]" 
       1  74 ALA 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  75 TRP 0.013 0.008  2 0 "[    .    1    .    2]" 
       1  76 ALA 0.009 0.005 11 0 "[    .    1    .    2]" 
       1  77 LEU 0.032 0.006  5 0 "[    .    1    .    2]" 
       1  78 LYS 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  79 VAL 0.863 0.061  2 0 "[    .    1    .    2]" 
       1  80 ALA 0.241 0.024  2 0 "[    .    1    .    2]" 
       1  81 GLU 0.016 0.007 12 0 "[    .    1    .    2]" 
       1  82 ASN 1.019 0.061  2 0 "[    .    1    .    2]" 
       1  83 GLU 0.019 0.011  2 0 "[    .    1    .    2]" 
       1  84 LEU 0.149 0.021  2 0 "[    .    1    .    2]" 
       1  85 GLY 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  86 ILE 0.022 0.005 20 0 "[    .    1    .    2]" 
       1  87 THR 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  88 PRO 0.048 0.007 12 0 "[    .    1    .    2]" 
       1  89 VAL 0.003 0.001 13 0 "[    .    1    .    2]" 
       1  90 VAL 0.004 0.004  8 0 "[    .    1    .    2]" 
       1  91 SER 0.004 0.004  8 0 "[    .    1    .    2]" 
       1  92 ALA 0.004 0.004  5 0 "[    .    1    .    2]" 
       1  93 GLN 0.004 0.004 11 0 "[    .    1    .    2]" 
       1  94 ALA 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  95 VAL 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  96 VAL 0.058 0.015 13 0 "[    .    1    .    2]" 
       1  97 ALA 0.146 0.015 14 0 "[    .    1    .    2]" 
       1  98 GLY 0.008 0.005 11 0 "[    .    1    .    2]" 
       1  99 SER 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 100 ASP 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 101 PRO 0.014 0.006 17 0 "[    .    1    .    2]" 
       1 102 LEU 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 103 GLY 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 104 LEU 0.011 0.006 17 0 "[    .    1    .    2]" 
       1 105 ILE 0.009 0.003 17 0 "[    .    1    .    2]" 
       1 106 ALA 0.001 0.001 13 0 "[    .    1    .    2]" 
       1 107 TYR 0.021 0.005 20 0 "[    .    1    .    2]" 
       1 108 LEU 0.003 0.003  3 0 "[    .    1    .    2]" 
       1 109 SER 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 110 HIS 0.003 0.002 15 0 "[    .    1    .    2]" 
       1 111 PHE 0.099 0.014 18 0 "[    .    1    .    2]" 
       1 112 HIS 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 113 SER 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 114 ALA 0.016 0.014 18 0 "[    .    1    .    2]" 
       1 115 PHE 0.026 0.008 20 0 "[    .    1    .    2]" 
       1 116 LYS 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 117 SER 0.017 0.014 18 0 "[    .    1    .    2]" 
       1 118 MET 0.002 0.002 20 0 "[    .    1    .    2]" 
    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  10 GLY QA   1  11 SER H    1.800 . 4.000 2.618 2.268 2.904     .  0 0 "[    .    1    .    2]" 1 
          2 1  10 GLY QA   1  13 GLY H    1.800 . 4.000 3.820 3.444 4.011 0.011  7 0 "[    .    1    .    2]" 1 
          3 1  10 GLY QA   1  14 THR H    1.800 . 5.000 4.187 3.546 4.952     .  0 0 "[    .    1    .    2]" 1 
          4 1  10 GLY H    1  11 SER H    1.800 . 3.000 2.576 1.996 2.975     .  0 0 "[    .    1    .    2]" 1 
          5 1  10 GLY H    1  12 ALA H    1.800 . 5.000 3.268 2.603 4.793     .  0 0 "[    .    1    .    2]" 1 
          6 1  11 SER HA   1  12 ALA H    1.800 . 4.000 3.513 3.081 3.569     .  0 0 "[    .    1    .    2]" 1 
          7 1  11 SER HA   1  13 GLY H    1.800 . 5.000 4.333 3.717 4.765     .  0 0 "[    .    1    .    2]" 1 
          8 1  11 SER HA   1  14 THR H    1.800 . 4.000 3.831 3.558 4.010 0.010  4 0 "[    .    1    .    2]" 1 
          9 1  11 SER QB   1  12 ALA H    1.800 . 4.000 2.741 2.061 3.702     .  0 0 "[    .    1    .    2]" 1 
         10 1  11 SER H    1  12 ALA H    1.800 . 3.000 2.429 1.980 2.867     .  0 0 "[    .    1    .    2]" 1 
         11 1  11 SER H    1  13 GLY H    1.800 . 5.000 3.664 2.800 4.394     .  0 0 "[    .    1    .    2]" 1 
         12 1  12 ALA HA   1  13 GLY H    1.800 . 4.000 3.460 3.071 3.542     .  0 0 "[    .    1    .    2]" 1 
         13 1  12 ALA HA   1  15 GLN H    1.800 . 4.000 3.632 3.131 4.009 0.009  4 0 "[    .    1    .    2]" 1 
         14 1  12 ALA H    1  12 ALA MB   1.800 . 3.000 2.206 2.098 2.392     .  0 0 "[    .    1    .    2]" 1 
         15 1  12 ALA MB   1  13 GLY H    1.800 . 4.000 2.844 2.545 3.543     .  0 0 "[    .    1    .    2]" 1 
         16 1  12 ALA H    1  13 GLY H    1.800 . 3.000 2.462 1.947 2.682     .  0 0 "[    .    1    .    2]" 1 
         17 1  12 ALA H    1  14 THR H    1.800 . 5.000 4.078 3.254 4.515     .  0 0 "[    .    1    .    2]" 1 
         18 1  13 GLY QA   1  14 THR H    1.800 . 4.000 2.787 2.614 2.853     .  0 0 "[    .    1    .    2]" 1 
         19 1  13 GLY QA   1  15 GLN H    1.800 . 5.000 4.123 3.671 4.407     .  0 0 "[    .    1    .    2]" 1 
         20 1  13 GLY QA   1  16 GLU H    1.800 . 4.000 3.589 3.169 3.937     .  0 0 "[    .    1    .    2]" 1 
         21 1  13 GLY H    1  14 THR H    1.800 . 3.000 2.532 1.975 2.856     .  0 0 "[    .    1    .    2]" 1 
         22 1  13 GLY H    1  15 GLN H    1.800 . 5.000 4.145 3.173 4.866     .  0 0 "[    .    1    .    2]" 1 
         23 1  14 THR HA   1  15 GLN H    1.800 . 4.000 3.522 3.445 3.570     .  0 0 "[    .    1    .    2]" 1 
         24 1  14 THR HA   1  16 GLU H    1.800 . 5.000 4.168 3.835 4.383     .  0 0 "[    .    1    .    2]" 1 
         25 1  14 THR HA   1  17 GLU H    1.800 . 4.000 3.576 3.349 3.798     .  0 0 "[    .    1    .    2]" 1 
         26 1  14 THR H    1  14 THR HB   1.800 . 4.000 3.310 2.519 3.637     .  0 0 "[    .    1    .    2]" 1 
         27 1  14 THR HB   1  15 GLN H    1.800 . 4.000 3.350 2.360 3.990     .  0 0 "[    .    1    .    2]" 1 
         28 1  14 THR H    1  14 THR MG   1.800 . 5.000 2.859 1.954 3.778     .  0 0 "[    .    1    .    2]" 1 
         29 1  14 THR H    1  15 GLN QB   1.800 . 6.000 4.286 3.921 4.598     .  0 0 "[    .    1    .    2]" 1 
         30 1  14 THR H    1  15 GLN H    1.800 . 3.000 2.525 2.235 2.918     .  0 0 "[    .    1    .    2]" 1 
         31 1  14 THR H    1  16 GLU H    1.800 . 5.000 3.995 3.656 4.376     .  0 0 "[    .    1    .    2]" 1 
         32 1  14 THR H    1  16 GLU QB   1.800 . 6.000 4.856 4.502 5.338     .  0 0 "[    .    1    .    2]" 1 
         33 1  14 THR H    1  17 GLU H    1.800 . 6.000 5.074 4.780 5.487     .  0 0 "[    .    1    .    2]" 1 
         34 1  14 THR H    1  17 GLU QG   1.800 . 6.000 4.645 4.416 4.883     .  0 0 "[    .    1    .    2]" 1 
         35 1  14 THR HB   1  16 GLU H    1.800 . 6.000 5.282 4.726 5.943     .  0 0 "[    .    1    .    2]" 1 
         36 1  15 GLN HA   1  16 GLU H    1.800 . 4.000 3.505 3.498 3.546     .  0 0 "[    .    1    .    2]" 1 
         37 1  15 GLN HA   1  17 GLU H    1.800 . 5.000 4.518 4.301 4.645     .  0 0 "[    .    1    .    2]" 1 
         38 1  15 GLN HA   1  18 LEU H    1.800 . 4.000 3.442 3.342 3.619     .  0 0 "[    .    1    .    2]" 1 
         39 1  15 GLN HB3  1  16 GLU H    1.800 . 4.000 3.210 2.807 3.818     .  0 0 "[    .    1    .    2]" 1 
         40 1  15 GLN HB2  1  16 GLU H    1.800 . 4.000 3.264 2.763 3.998     .  0 0 "[    .    1    .    2]" 1 
         41 1  15 GLN H    1  15 GLN QG   1.800 . 5.000 3.313 2.151 4.029     .  0 0 "[    .    1    .    2]" 1 
         42 1  15 GLN QG   1  16 GLU H    1.800 . 5.000 4.310 3.780 4.634     .  0 0 "[    .    1    .    2]" 1 
         43 1  15 GLN QB   1  15 GLN QE   1.800 . 6.000 3.022 1.966 3.666     .  0 0 "[    .    1    .    2]" 1 
         44 1  15 GLN H    1  16 GLU QB   1.800 . 5.000 4.398 4.290 4.627     .  0 0 "[    .    1    .    2]" 1 
         45 1  15 GLN H    1  16 GLU H    1.800 . 3.000 2.647 2.623 2.741     .  0 0 "[    .    1    .    2]" 1 
         46 1  15 GLN H    1  17 GLU H    1.800 . 5.000 4.418 4.232 4.493     .  0 0 "[    .    1    .    2]" 1 
         47 1  15 GLN HE21 1 105 ILE MD   1.800 . 6.000 3.677 2.227 5.572     .  0 0 "[    .    1    .    2]" 1 
         48 1  15 GLN HE22 1 105 ILE MD   1.800 . 6.000 3.750 2.102 5.157     .  0 0 "[    .    1    .    2]" 1 
         49 1  16 GLU HA   1  17 GLU H    1.800 . 4.000 3.556 3.528 3.562     .  0 0 "[    .    1    .    2]" 1 
         50 1  16 GLU HA   1  18 LEU H    1.800 . 5.000 4.290 4.189 4.546     .  0 0 "[    .    1    .    2]" 1 
         51 1  16 GLU HA   1  19 LEU H    1.800 . 4.000 3.633 3.440 3.778     .  0 0 "[    .    1    .    2]" 1 
         52 1  16 GLU H    1  16 GLU HB3  1.800 . 4.000 3.132 2.709 3.580     .  0 0 "[    .    1    .    2]" 1 
         53 1  16 GLU H    1  16 GLU HB2  1.800 . 4.000 2.222 2.080 2.416     .  0 0 "[    .    1    .    2]" 1 
         54 1  16 GLU H    1  16 GLU QB   1.800 . 3.000 2.167 2.052 2.380     .  0 0 "[    .    1    .    2]" 1 
         55 1  16 GLU HB3  1  17 GLU H    1.800 . 5.000 2.804 2.462 3.460     .  0 0 "[    .    1    .    2]" 1 
         56 1  16 GLU HB2  1  17 GLU H    1.800 . 5.000 3.200 2.531 3.685     .  0 0 "[    .    1    .    2]" 1 
         57 1  16 GLU QB   1  17 GLU H    1.800 . 3.000 2.510 2.426 2.684     .  0 0 "[    .    1    .    2]" 1 
         58 1  16 GLU H    1  16 GLU QG   1.800 . 5.000 3.492 2.297 4.033     .  0 0 "[    .    1    .    2]" 1 
         59 1  16 GLU H    1  17 GLU H    1.800 . 3.000 2.729 2.635 2.757     .  0 0 "[    .    1    .    2]" 1 
         60 1  16 GLU H    1  18 LEU H    1.800 . 5.000 3.998 3.861 4.307     .  0 0 "[    .    1    .    2]" 1 
         61 1  17 GLU HA   1  18 LEU H    1.800 . 4.000 3.501 3.491 3.552     .  0 0 "[    .    1    .    2]" 1 
         62 1  17 GLU HA   1  19 LEU H    1.800 . 5.000 4.556 4.323 4.720     .  0 0 "[    .    1    .    2]" 1 
         63 1  17 GLU HA   1  20 ARG H    1.800 . 4.000 3.550 3.392 3.779     .  0 0 "[    .    1    .    2]" 1 
         64 1  17 GLU HA   1  21 TRP H    1.800 . 5.000 4.277 4.041 4.434     .  0 0 "[    .    1    .    2]" 1 
         65 1  17 GLU QB   1  18 LEU H    1.800 . 4.000 3.382 2.440 3.544     .  0 0 "[    .    1    .    2]" 1 
         66 1  17 GLU H    1  17 GLU QG   1.800 . 5.000 2.279 1.972 2.547     .  0 0 "[    .    1    .    2]" 1 
         67 1  17 GLU QG   1  18 LEU H    1.800 . 6.000 2.357 1.983 3.928     .  0 0 "[    .    1    .    2]" 1 
         68 1  17 GLU H    1  18 LEU H    1.800 . 3.000 2.604 2.497 2.728     .  0 0 "[    .    1    .    2]" 1 
         69 1  17 GLU H    1  19 LEU H    1.800 . 5.000 4.315 3.994 4.466     .  0 0 "[    .    1    .    2]" 1 
         70 1  18 LEU HA   1  19 LEU H    1.800 . 4.000 3.547 3.516 3.558     .  0 0 "[    .    1    .    2]" 1 
         71 1  18 LEU HA   1  20 ARG H    1.800 . 5.000 4.381 4.257 4.634     .  0 0 "[    .    1    .    2]" 1 
         72 1  18 LEU HA   1  21 TRP H    1.800 . 4.000 3.569 3.435 3.681     .  0 0 "[    .    1    .    2]" 1 
         73 1  18 LEU H    1  18 LEU HB3  1.800 . 4.000 3.257 2.474 3.599     .  0 0 "[    .    1    .    2]" 1 
         74 1  18 LEU H    1  18 LEU HB2  1.800 . 4.000 2.320 2.094 2.570     .  0 0 "[    .    1    .    2]" 1 
         75 1  18 LEU H    1  18 LEU QB   1.800 . 3.000 2.251 2.075 2.463     .  0 0 "[    .    1    .    2]" 1 
         76 1  18 LEU HB3  1  19 LEU H    1.800 . 5.000 3.053 2.406 3.568     .  0 0 "[    .    1    .    2]" 1 
         77 1  18 LEU HB2  1  19 LEU H    1.800 . 5.000 2.966 2.419 3.792     .  0 0 "[    .    1    .    2]" 1 
         78 1  18 LEU QB   1  19 LEU H    1.800 . 4.000 2.495 2.376 2.686     .  0 0 "[    .    1    .    2]" 1 
         79 1  18 LEU H    1  18 LEU MD1  1.800 . 6.000 3.643 2.475 4.224     .  0 0 "[    .    1    .    2]" 1 
         80 1  18 LEU H    1  18 LEU MD2  1.800 . 6.000 3.731 2.478 4.363     .  0 0 "[    .    1    .    2]" 1 
         81 1  18 LEU QD   1  22 CYS H    1.800 . 6.000 4.784 3.353 5.636     .  0 0 "[    .    1    .    2]" 1 
         82 1  18 LEU H    1  19 LEU H    1.800 . 3.000 2.636 2.547 2.709     .  0 0 "[    .    1    .    2]" 1 
         83 1  18 LEU H    1  20 ARG H    1.800 . 5.000 4.018 3.860 4.281     .  0 0 "[    .    1    .    2]" 1 
         84 1  19 LEU HA   1  20 ARG H    1.800 . 4.000 3.522 3.505 3.554     .  0 0 "[    .    1    .    2]" 1 
         85 1  19 LEU HA   1  21 TRP H    1.800 . 5.000 4.381 4.264 4.503     .  0 0 "[    .    1    .    2]" 1 
         86 1  19 LEU HA   1  22 CYS H    1.800 . 4.000 3.478 3.369 3.673     .  0 0 "[    .    1    .    2]" 1 
         87 1  19 LEU H    1  19 LEU HB3  1.800 . 4.000 3.156 2.506 3.540     .  0 0 "[    .    1    .    2]" 1 
         88 1  19 LEU H    1  19 LEU HB2  1.800 . 4.000 2.182 2.071 2.511     .  0 0 "[    .    1    .    2]" 1 
         89 1  19 LEU H    1  19 LEU QB   1.800 . 3.000 2.126 2.043 2.256     .  0 0 "[    .    1    .    2]" 1 
         90 1  19 LEU HB3  1  20 ARG H    1.800 . 5.000 2.991 2.475 3.546     .  0 0 "[    .    1    .    2]" 1 
         91 1  19 LEU HB2  1  20 ARG H    1.800 . 5.000 3.264 2.736 3.902     .  0 0 "[    .    1    .    2]" 1 
         92 1  19 LEU QB   1  20 ARG H    1.800 . 4.000 2.682 2.442 2.784     .  0 0 "[    .    1    .    2]" 1 
         93 1  19 LEU HG   1  20 ARG H    1.800 . 6.000 4.824 3.972 5.163     .  0 0 "[    .    1    .    2]" 1 
         94 1  19 LEU H    1  19 LEU MD1  1.800 . 6.000 3.657 2.432 4.258     .  0 0 "[    .    1    .    2]" 1 
         95 1  19 LEU H    1  19 LEU MD2  1.800 . 6.000 4.071 2.231 4.411     .  0 0 "[    .    1    .    2]" 1 
         96 1  19 LEU H    1  19 LEU QD   1.800 . 6.000 3.313 2.220 3.728     .  0 0 "[    .    1    .    2]" 1 
         97 1  19 LEU MD1  1  20 ARG H    1.800 . 6.000 4.627 3.774 4.976     .  0 0 "[    .    1    .    2]" 1 
         98 1  19 LEU MD2  1  20 ARG H    1.800 . 6.000 4.398 3.354 4.891     .  0 0 "[    .    1    .    2]" 1 
         99 1  19 LEU QD   1  23 GLN H    1.800 . 6.000 4.244 3.281 5.223     .  0 0 "[    .    1    .    2]" 1 
        100 1  19 LEU H    1  20 ARG H    1.800 . 3.000 2.654 2.622 2.718     .  0 0 "[    .    1    .    2]" 1 
        101 1  19 LEU H    1  21 TRP H    1.800 . 5.000 4.219 3.971 4.339     .  0 0 "[    .    1    .    2]" 1 
        102 1  19 LEU H    1  37 LEU QD   1.800 . 6.000 4.444 3.800 4.983     .  0 0 "[    .    1    .    2]" 1 
        103 1  20 ARG HA   1  21 TRP H    1.800 . 4.000 3.534 3.499 3.546     .  0 0 "[    .    1    .    2]" 1 
        104 1  20 ARG HA   1  22 CYS H    1.800 . 5.000 4.480 4.333 4.720     .  0 0 "[    .    1    .    2]" 1 
        105 1  20 ARG QB   1  21 TRP H    1.800 . 4.000 2.724 2.483 3.532     .  0 0 "[    .    1    .    2]" 1 
        106 1  20 ARG HA   1  23 GLN H    1.800 . 4.000 3.654 3.478 3.785     .  0 0 "[    .    1    .    2]" 1 
        107 1  20 ARG H    1  20 ARG HB3  1.800 . 4.000 3.398 2.454 3.597     .  0 0 "[    .    1    .    2]" 1 
        108 1  20 ARG H    1  20 ARG HB2  1.800 . 4.000 2.554 2.139 3.604     .  0 0 "[    .    1    .    2]" 1 
        109 1  20 ARG H    1  20 ARG HG3  1.800 . 4.000 3.236 2.703 3.938     .  0 0 "[    .    1    .    2]" 1 
        110 1  20 ARG H    1  20 ARG HG2  1.800 . 4.000 2.679 2.082 3.575     .  0 0 "[    .    1    .    2]" 1 
        111 1  20 ARG H    1  20 ARG QD   1.800 . 6.000 4.134 3.511 4.526     .  0 0 "[    .    1    .    2]" 1 
        112 1  20 ARG H    1  21 TRP H    1.800 . 3.000 2.671 2.594 2.747     .  0 0 "[    .    1    .    2]" 1 
        113 1  20 ARG H    1  22 CYS H    1.800 . 5.000 4.166 3.995 4.395     .  0 0 "[    .    1    .    2]" 1 
        114 1  21 TRP HA   1  22 CYS H    1.800 . 4.000 3.534 3.518 3.558     .  0 0 "[    .    1    .    2]" 1 
        115 1  21 TRP HA   1  23 GLN H    1.800 . 5.000 4.588 4.512 4.643     .  0 0 "[    .    1    .    2]" 1 
        116 1  21 TRP HA   1  24 GLU H    1.800 . 4.000 3.568 3.467 3.691     .  0 0 "[    .    1    .    2]" 1 
        117 1  21 TRP QB   1  22 CYS H    1.800 . 4.000 2.565 2.362 2.675     .  0 0 "[    .    1    .    2]" 1 
        118 1  21 TRP H    1  21 TRP HD1  1.800 . 6.000 4.901 4.751 5.017     .  0 0 "[    .    1    .    2]" 1 
        119 1  21 TRP H    1  21 TRP HE3  1.800 . 6.000 4.767 4.609 4.953     .  0 0 "[    .    1    .    2]" 1 
        120 1  21 TRP H    1  22 CYS H    1.800 . 3.000 2.630 2.582 2.697     .  0 0 "[    .    1    .    2]" 1 
        121 1  21 TRP H    1  23 GLN H    1.800 . 5.000 4.225 4.105 4.287     .  0 0 "[    .    1    .    2]" 1 
        122 1  21 TRP HE1  1  25 GLN QG   1.800 . 5.000 4.030 3.343 4.956     .  0 0 "[    .    1    .    2]" 1 
        123 1  21 TRP HE1  1 112 HIS HA   1.800 . 6.000 5.379 4.174 5.953     .  0 0 "[    .    1    .    2]" 1 
        124 1  21 TRP HE1  1 116 LYS HA   1.800 . 6.000 5.320 4.508 5.910     .  0 0 "[    .    1    .    2]" 1 
        125 1  21 TRP HZ2  1 116 LYS H    1.800 . 6.000 4.563 3.823 5.836     .  0 0 "[    .    1    .    2]" 1 
        126 1  21 TRP HE3  1  22 CYS H    1.800 . 5.000 3.226 2.777 3.631     .  0 0 "[    .    1    .    2]" 1 
        127 1  22 CYS HA   1  23 GLN H    1.800 . 4.000 3.551 3.545 3.558     .  0 0 "[    .    1    .    2]" 1 
        128 1  22 CYS HA   1  24 GLU H    1.800 . 5.000 4.369 4.240 4.496     .  0 0 "[    .    1    .    2]" 1 
        129 1  22 CYS HA   1  25 GLN H    1.800 . 4.000 3.594 3.518 3.677     .  0 0 "[    .    1    .    2]" 1 
        130 1  22 CYS QB   1  23 GLN H    1.800 . 4.000 2.511 2.457 2.640     .  0 0 "[    .    1    .    2]" 1 
        131 1  22 CYS H    1  23 GLN H    1.800 . 3.000 2.691 2.620 2.756     .  0 0 "[    .    1    .    2]" 1 
        132 1  22 CYS H    1  24 GLU H    1.800 . 5.000 4.060 3.974 4.205     .  0 0 "[    .    1    .    2]" 1 
        133 1  23 GLN HA   1  24 GLU H    1.800 . 4.000 3.523 3.511 3.548     .  0 0 "[    .    1    .    2]" 1 
        134 1  23 GLN HA   1  25 GLN H    1.800 . 5.000 4.561 4.495 4.632     .  0 0 "[    .    1    .    2]" 1 
        135 1  23 GLN HA   1  26 THR H    1.800 . 5.000 3.444 3.351 3.486     .  0 0 "[    .    1    .    2]" 1 
        136 1  23 GLN HA   1  27 ALA H    1.800 . 6.000 4.755 4.549 5.047     .  0 0 "[    .    1    .    2]" 1 
        137 1  23 GLN QB   1  24 GLU H    1.800 . 4.000 2.878 2.512 3.477     .  0 0 "[    .    1    .    2]" 1 
        138 1  23 GLN H    1  24 GLU H    1.800 . 3.000 2.652 2.583 2.732     .  0 0 "[    .    1    .    2]" 1 
        139 1  23 GLN H    1  25 GLN H    1.800 . 5.000 4.281 4.213 4.342     .  0 0 "[    .    1    .    2]" 1 
        140 1  23 GLN H    1  34 VAL QG   1.800 . 6.000 3.354 2.703 4.261     .  0 0 "[    .    1    .    2]" 1 
        141 1  24 GLU HA   1  25 GLN H    1.800 . 4.000 3.546 3.544 3.549     .  0 0 "[    .    1    .    2]" 1 
        142 1  24 GLU HA   1  27 ALA H    1.800 . 4.000 3.678 3.568 3.842     .  0 0 "[    .    1    .    2]" 1 
        143 1  24 GLU H    1  24 GLU HB3  1.800 . 4.000 2.912 2.511 3.469     .  0 0 "[    .    1    .    2]" 1 
        144 1  24 GLU H    1  24 GLU HB2  1.800 . 4.000 2.257 2.071 2.544     .  0 0 "[    .    1    .    2]" 1 
        145 1  24 GLU HB3  1  25 GLN H    1.800 . 5.000 2.607 2.479 3.136     .  0 0 "[    .    1    .    2]" 1 
        146 1  24 GLU HB2  1  25 GLN H    1.800 . 5.000 3.453 2.769 3.828     .  0 0 "[    .    1    .    2]" 1 
        147 1  24 GLU QB   1  25 GLN H    1.800 . 4.000 2.503 2.443 2.626     .  0 0 "[    .    1    .    2]" 1 
        148 1  24 GLU H    1  24 GLU HG3  1.800 . 5.000 4.195 3.071 4.531     .  0 0 "[    .    1    .    2]" 1 
        149 1  24 GLU H    1  24 GLU HG2  1.800 . 5.000 4.423 3.427 4.656     .  0 0 "[    .    1    .    2]" 1 
        150 1  24 GLU QG   1  25 GLN H    1.800 . 6.000 4.084 3.519 4.431     .  0 0 "[    .    1    .    2]" 1 
        151 1  24 GLU H    1  25 GLN H    1.800 . 3.000 2.657 2.648 2.687     .  0 0 "[    .    1    .    2]" 1 
        152 1  24 GLU H    1  26 THR H    1.800 . 5.000 3.896 3.808 3.992     .  0 0 "[    .    1    .    2]" 1 
        153 1  25 GLN HA   1  26 THR H    1.800 . 4.000 3.494 3.472 3.519     .  0 0 "[    .    1    .    2]" 1 
        154 1  25 GLN HB3  1  26 THR H    1.800 . 5.000 3.547 2.976 3.954     .  0 0 "[    .    1    .    2]" 1 
        155 1  25 GLN HB2  1  26 THR H    1.800 . 5.000 3.035 2.742 3.689     .  0 0 "[    .    1    .    2]" 1 
        156 1  25 GLN QB   1  26 THR H    1.800 . 3.000 2.830 2.668 2.940     .  0 0 "[    .    1    .    2]" 1 
        157 1  25 GLN H    1  25 GLN HG3  1.800 . 5.000 3.775 3.146 4.534     .  0 0 "[    .    1    .    2]" 1 
        158 1  25 GLN H    1  25 GLN HG2  1.800 . 5.000 3.051 2.134 4.538     .  0 0 "[    .    1    .    2]" 1 
        159 1  25 GLN H    1  26 THR H    1.800 . 3.000 2.560 2.477 2.630     .  0 0 "[    .    1    .    2]" 1 
        160 1  25 GLN H    1  27 ALA H    1.800 . 5.000 3.976 3.912 4.076     .  0 0 "[    .    1    .    2]" 1 
        161 1  26 THR HA   1  27 ALA H    1.800 . 4.000 3.203 3.197 3.241     .  0 0 "[    .    1    .    2]" 1 
        162 1  26 THR HA   1  29 TYR H    1.800 . 6.000 5.292 4.844 5.642     .  0 0 "[    .    1    .    2]" 1 
        163 1  26 THR H    1  26 THR HB   1.800 . 4.000 2.714 2.495 3.609     .  0 0 "[    .    1    .    2]" 1 
        164 1  26 THR H    1  26 THR MG   1.800 . 5.000 3.412 2.037 3.810     .  0 0 "[    .    1    .    2]" 1 
        165 1  26 THR MG   1  27 ALA H    1.800 . 5.000 4.054 3.023 4.428     .  0 0 "[    .    1    .    2]" 1 
        166 1  26 THR MG   1  50 LEU H    1.800 . 6.000 4.304 2.889 5.643     .  0 0 "[    .    1    .    2]" 1 
        167 1  26 THR H    1  27 ALA MB   1.800 . 6.000 4.001 3.863 4.083     .  0 0 "[    .    1    .    2]" 1 
        168 1  26 THR H    1  27 ALA H    1.800 . 3.000 2.554 2.475 2.602     .  0 0 "[    .    1    .    2]" 1 
        169 1  27 ALA HA   1  28 GLY H    1.800 . 3.000 2.176 2.150 2.267     .  0 0 "[    .    1    .    2]" 1 
        170 1  27 ALA H    1  27 ALA MB   1.800 . 3.000 2.191 2.084 2.277     .  0 0 "[    .    1    .    2]" 1 
        171 1  27 ALA MB   1  28 GLY H    1.800 . 4.000 3.052 2.698 3.183     .  0 0 "[    .    1    .    2]" 1 
        172 1  27 ALA H    1  28 GLY H    1.800 . 5.000 4.535 4.493 4.609     .  0 0 "[    .    1    .    2]" 1 
        173 1  27 ALA H    1  29 TYR H    1.800 . 6.000 5.326 5.101 5.481     .  0 0 "[    .    1    .    2]" 1 
        174 1  27 ALA H    1  29 TYR QD   1.800 . 6.000 4.787 4.445 5.139     .  0 0 "[    .    1    .    2]" 1 
        175 1  28 GLY HA3  1  29 TYR H    1.800 . 4.000 2.975 2.846 3.124     .  0 0 "[    .    1    .    2]" 1 
        176 1  28 GLY HA2  1  29 TYR H    1.800 . 4.000 3.486 3.416 3.531     .  0 0 "[    .    1    .    2]" 1 
        177 1  28 GLY QA   1  29 TYR H    1.800 . 3.000 2.815 2.734 2.893     .  0 0 "[    .    1    .    2]" 1 
        178 1  28 GLY H    1  29 TYR H    1.800 . 3.000 2.297 1.995 2.638     .  0 0 "[    .    1    .    2]" 1 
        179 1  29 TYR H    1  29 TYR HB3  1.800 . 4.000 3.630 3.596 3.671     .  0 0 "[    .    1    .    2]" 1 
        180 1  29 TYR H    1  29 TYR HB2  1.800 . 4.000 2.582 2.525 2.672     .  0 0 "[    .    1    .    2]" 1 
        181 1  29 TYR H    1  29 TYR QB   1.800 . 3.000 2.530 2.478 2.610     .  0 0 "[    .    1    .    2]" 1 
        182 1  29 TYR QB   1  32 VAL H    1.800 . 5.000 3.464 2.496 3.958     .  0 0 "[    .    1    .    2]" 1 
        183 1  29 TYR H    1  29 TYR HD2  1.800 . 5.000 4.672 4.594 4.741     .  0 0 "[    .    1    .    2]" 1 
        184 1  29 TYR H    1  29 TYR HD1  1.800 . 3.000 1.965 1.927 1.996     .  0 0 "[    .    1    .    2]" 1 
        185 1  29 TYR H    1  29 TYR HE2  1.800 . 6.000 5.872 5.791 5.963     .  0 0 "[    .    1    .    2]" 1 
        186 1  29 TYR H    1  29 TYR HE1  1.800 . 6.000 4.057 3.982 4.110     .  0 0 "[    .    1    .    2]" 1 
        187 1  29 TYR H    1  30 PRO HD3  1.800 . 6.000 4.687 4.403 5.041     .  0 0 "[    .    1    .    2]" 1 
        188 1  29 TYR H    1  30 PRO HD2  1.800 . 6.000 5.071 4.856 5.355     .  0 0 "[    .    1    .    2]" 1 
        189 1  29 TYR H    1  32 VAL HB   1.800 . 6.000 3.859 3.074 4.239     .  0 0 "[    .    1    .    2]" 1 
        190 1  29 TYR H    1  32 VAL H    1.800 . 6.000 4.979 4.533 5.377     .  0 0 "[    .    1    .    2]" 1 
        191 1  29 TYR H    1  32 VAL QG   1.800 . 6.000 3.164 1.894 4.172     .  0 0 "[    .    1    .    2]" 1 
        192 1  30 PRO HA   1  31 GLY H    1.800 . 3.000 2.409 2.157 2.683     .  0 0 "[    .    1    .    2]" 1 
        193 1  30 PRO HB3  1  31 GLY H    1.800 . 5.000 4.396 3.743 4.665     .  0 0 "[    .    1    .    2]" 1 
        194 1  30 PRO HB2  1  31 GLY H    1.800 . 5.000 4.181 3.695 4.355     .  0 0 "[    .    1    .    2]" 1 
        195 1  31 GLY H    1  31 GLY HA2  1.800 . 3.000 2.553 2.414 2.695     .  0 0 "[    .    1    .    2]" 1 
        196 1  31 GLY HA3  1  32 VAL H    1.800 . 5.000 3.321 2.969 3.542     .  0 0 "[    .    1    .    2]" 1 
        197 1  31 GLY HA2  1  32 VAL H    1.800 . 5.000 3.125 2.809 3.488     .  0 0 "[    .    1    .    2]" 1 
        198 1  31 GLY QA   1  32 VAL H    1.800 . 4.000 2.801 2.706 2.928     .  0 0 "[    .    1    .    2]" 1 
        199 1  31 GLY H    1  32 VAL H    1.800 . 3.000 2.126 1.868 2.708     .  0 0 "[    .    1    .    2]" 1 
        200 1  31 GLY H    1  33 HIS H    1.800 . 6.000 6.014 5.765 6.060 0.060 15 0 "[    .    1    .    2]" 1 
        201 1  31 GLY H    1  32 VAL MG1  1.800 . 6.000 4.432 2.911 5.819     .  0 0 "[    .    1    .    2]" 1 
        202 1  32 VAL HA   1  33 HIS H    1.800 . 3.000 2.128 2.120 2.141     .  0 0 "[    .    1    .    2]" 1 
        203 1  32 VAL H    1  32 VAL HB   1.800 . 3.000 2.761 2.575 3.026 0.026  8 0 "[    .    1    .    2]" 1 
        204 1  32 VAL HB   1  33 HIS H    1.800 . 6.000 4.233 4.154 4.318     .  0 0 "[    .    1    .    2]" 1 
        205 1  32 VAL H    1  32 VAL MG1  1.800 . 6.000 3.005 1.933 3.955     .  0 0 "[    .    1    .    2]" 1 
        206 1  32 VAL H    1  32 VAL MG2  1.800 . 6.000 3.017 1.981 3.895     .  0 0 "[    .    1    .    2]" 1 
        207 1  32 VAL H    1  32 VAL QG   1.800 . 4.000 2.167 1.928 2.814     .  0 0 "[    .    1    .    2]" 1 
        208 1  32 VAL QG   1  33 HIS H    1.800 . 5.000 2.672 2.552 2.778     .  0 0 "[    .    1    .    2]" 1 
        209 1  32 VAL QG   1  34 VAL H    1.800 . 6.000 3.168 2.380 4.576     .  0 0 "[    .    1    .    2]" 1 
        210 1  32 VAL QG   1  46 ALA H    1.800 . 6.000 4.676 3.985 5.995     .  0 0 "[    .    1    .    2]" 1 
        211 1  32 VAL QG   1  49 ALA H    1.800 . 6.000 4.966 4.251 6.009 0.009  2 0 "[    .    1    .    2]" 1 
        212 1  32 VAL H    1  33 HIS H    1.800 . 5.500 4.362 4.137 4.485     .  0 0 "[    .    1    .    2]" 1 
        213 1  33 HIS HA   1  34 VAL H    1.800 . 3.000 2.330 2.144 2.813     .  0 0 "[    .    1    .    2]" 1 
        214 1  33 HIS HB3  1  34 VAL H    1.800 . 6.000 4.060 3.033 4.383     .  0 0 "[    .    1    .    2]" 1 
        215 1  33 HIS HB2  1  34 VAL H    1.800 . 6.000 4.469 3.490 4.672     .  0 0 "[    .    1    .    2]" 1 
        216 1  33 HIS H    1  34 VAL H    1.800 . 6.000 3.685 2.408 4.505     .  0 0 "[    .    1    .    2]" 1 
        217 1  34 VAL HA   1  35 SER H    1.800 . 3.000 2.255 2.148 2.847     .  0 0 "[    .    1    .    2]" 1 
        218 1  34 VAL HA   1  36 ASP H    1.800 . 4.000 3.372 3.067 3.469     .  0 0 "[    .    1    .    2]" 1 
        219 1  34 VAL H    1  34 VAL HB   1.800 . 4.000 2.656 2.560 2.778     .  0 0 "[    .    1    .    2]" 1 
        220 1  34 VAL H    1  34 VAL MG1  1.800 . 6.000 3.818 3.760 3.911     .  0 0 "[    .    1    .    2]" 1 
        221 1  34 VAL H    1  34 VAL MG2  1.800 . 5.000 2.288 1.954 2.718     .  0 0 "[    .    1    .    2]" 1 
        222 1  34 VAL MG1  1  35 SER H    1.800 . 5.000 3.322 2.971 4.143     .  0 0 "[    .    1    .    2]" 1 
        223 1  34 VAL MG2  1  35 SER H    1.800 . 6.000 4.291 4.205 4.337     .  0 0 "[    .    1    .    2]" 1 
        224 1  34 VAL MG1  1  36 ASP H    1.800 . 4.000 3.309 2.874 3.617     .  0 0 "[    .    1    .    2]" 1 
        225 1  34 VAL MG2  1  36 ASP H    1.800 . 6.000 5.110 4.943 5.235     .  0 0 "[    .    1    .    2]" 1 
        226 1  34 VAL QG   1  41 TRP HE1  1.800 . 5.000 3.875 2.923 4.555     .  0 0 "[    .    1    .    2]" 1 
        227 1  34 VAL H    1  35 SER H    1.800 . 6.000 4.052 2.941 4.358     .  0 0 "[    .    1    .    2]" 1 
        228 1  34 VAL H    1  40 SER QB   1.800 . 6.000 5.514 4.532 6.005 0.005 20 0 "[    .    1    .    2]" 1 
        229 1  35 SER HA   1  36 ASP H    1.800 . 3.000 3.024 3.001 3.043 0.043  4 0 "[    .    1    .    2]" 1 
        230 1  35 SER H    1  35 SER QB   1.800 . 3.000 2.746 2.363 2.929     .  0 0 "[    .    1    .    2]" 1 
        231 1  35 SER QB   1  36 ASP H    1.800 . 5.000 3.710 3.671 3.767     .  0 0 "[    .    1    .    2]" 1 
        232 1  35 SER H    1  36 ASP H    1.800 . 3.000 1.984 1.889 2.648     .  0 0 "[    .    1    .    2]" 1 
        233 1  35 SER H    1  40 SER QB   1.800 . 4.000 3.228 2.596 3.602     .  0 0 "[    .    1    .    2]" 1 
        234 1  36 ASP HA   1  37 LEU H    1.800 . 4.000 2.247 2.189 2.377     .  0 0 "[    .    1    .    2]" 1 
        235 1  36 ASP HB3  1  37 LEU H    1.800 . 4.000 2.946 2.675 3.103     .  0 0 "[    .    1    .    2]" 1 
        236 1  36 ASP HB2  1  37 LEU H    1.800 . 4.000 3.895 3.730 4.026 0.026 13 0 "[    .    1    .    2]" 1 
        237 1  36 ASP QB   1  37 LEU H    1.800 . 3.000 2.862 2.622 3.006 0.006 13 0 "[    .    1    .    2]" 1 
        238 1  36 ASP QB   1  38 SER H    1.800 . 4.000 2.719 2.615 2.772     .  0 0 "[    .    1    .    2]" 1 
        239 1  36 ASP H    1  37 LEU H    1.800 . 5.000 4.367 4.315 4.422     .  0 0 "[    .    1    .    2]" 1 
        240 1  36 ASP H    1  40 SER QB   1.800 . 5.000 2.528 2.222 3.055     .  0 0 "[    .    1    .    2]" 1 
        241 1  37 LEU HA   1  38 SER H    1.800 . 4.000 2.832 2.766 2.867     .  0 0 "[    .    1    .    2]" 1 
        242 1  37 LEU HA   1  41 TRP HE1  1.800 . 4.000 2.404 1.978 3.341     .  0 0 "[    .    1    .    2]" 1 
        243 1  37 LEU H    1  37 LEU QB   1.800 . 4.000 2.298 2.158 2.523     .  0 0 "[    .    1    .    2]" 1 
        244 1  37 LEU H    1  37 LEU MD1  1.800 . 6.000 3.463 2.351 4.111     .  0 0 "[    .    1    .    2]" 1 
        245 1  37 LEU H    1  37 LEU MD2  1.800 . 6.000 3.990 2.030 4.505     .  0 0 "[    .    1    .    2]" 1 
        246 1  37 LEU QD   1  38 SER H    1.800 . 6.000 4.423 3.862 4.617     .  0 0 "[    .    1    .    2]" 1 
        247 1  37 LEU QD   1  41 TRP HE1  1.800 . 5.000 3.525 2.623 4.462     .  0 0 "[    .    1    .    2]" 1 
        248 1  37 LEU H    1  37 LEU HG   1.800 . 5.000 3.644 2.660 4.367     .  0 0 "[    .    1    .    2]" 1 
        249 1  37 LEU HG   1  38 SER H    1.800 . 6.000 5.083 4.797 6.009 0.009 20 0 "[    .    1    .    2]" 1 
        250 1  37 LEU H    1  38 SER H    1.800 . 3.000 3.010 2.976 3.019 0.019 11 0 "[    .    1    .    2]" 1 
        251 1  38 SER HA   1  39 SER H    1.800 . 5.000 3.552 3.543 3.567     .  0 0 "[    .    1    .    2]" 1 
        252 1  38 SER HA   1  40 SER H    1.800 . 6.000 4.474 4.108 4.803     .  0 0 "[    .    1    .    2]" 1 
        253 1  38 SER HA   1  41 TRP H    1.800 . 6.000 3.907 3.734 4.148     .  0 0 "[    .    1    .    2]" 1 
        254 1  38 SER H    1  38 SER QB   1.800 . 3.000 2.888 2.810 2.953     .  0 0 "[    .    1    .    2]" 1 
        255 1  38 SER HB3  1  39 SER H    1.800 . 5.000 2.371 2.003 2.945     .  0 0 "[    .    1    .    2]" 1 
        256 1  38 SER HB2  1  39 SER H    1.800 . 5.000 2.812 1.995 3.653     .  0 0 "[    .    1    .    2]" 1 
        257 1  38 SER QB   1  39 SER H    1.800 . 3.000 2.073 1.946 2.219     .  0 0 "[    .    1    .    2]" 1 
        258 1  38 SER H    1  39 SER H    1.800 . 4.000 2.825 2.612 3.003     .  0 0 "[    .    1    .    2]" 1 
        259 1  38 SER H    1  40 SER H    1.800 . 4.000 2.636 2.385 2.865     .  0 0 "[    .    1    .    2]" 1 
        260 1  38 SER H    1  40 SER QB   1.800 . 5.000 3.108 2.724 3.495     .  0 0 "[    .    1    .    2]" 1 
        261 1  38 SER H    1  41 TRP H    1.800 . 5.000 3.556 3.378 3.748     .  0 0 "[    .    1    .    2]" 1 
        262 1  38 SER H    1  41 TRP HE1  1.800 . 6.000 3.841 3.417 4.320     .  0 0 "[    .    1    .    2]" 1 
        263 1  38 SER H    1  41 TRP HD1  1.800 . 4.000 2.626 2.335 2.981     .  0 0 "[    .    1    .    2]" 1 
        264 1  39 SER HA   1  40 SER H    1.800 . 4.000 3.504 3.441 3.548     .  0 0 "[    .    1    .    2]" 1 
        265 1  39 SER HA   1  41 TRP H    1.800 . 5.000 3.873 3.692 4.041     .  0 0 "[    .    1    .    2]" 1 
        266 1  39 SER HA   1  42 ALA H    1.800 . 4.000 3.333 3.099 3.594     .  0 0 "[    .    1    .    2]" 1 
        267 1  39 SER HB3  1  40 SER H    1.800 . 5.000 3.411 2.548 4.157     .  0 0 "[    .    1    .    2]" 1 
        268 1  39 SER HB2  1  40 SER H    1.800 . 5.000 3.267 2.672 4.231     .  0 0 "[    .    1    .    2]" 1 
        269 1  39 SER QB   1  40 SER H    1.800 . 4.000 2.799 2.510 3.197     .  0 0 "[    .    1    .    2]" 1 
        270 1  39 SER H    1  40 SER H    1.800 . 3.000 2.735 2.602 2.808     .  0 0 "[    .    1    .    2]" 1 
        271 1  39 SER H    1  98 GLY QA   1.800 . 5.000 4.725 4.264 5.005 0.005 11 0 "[    .    1    .    2]" 1 
        272 1  40 SER HA   1  41 TRP H    1.800 . 4.000 3.477 3.458 3.498     .  0 0 "[    .    1    .    2]" 1 
        273 1  40 SER H    1  40 SER QB   1.800 . 3.000 2.196 2.049 2.574     .  0 0 "[    .    1    .    2]" 1 
        274 1  40 SER QB   1  41 TRP H    1.800 . 4.000 2.966 2.803 3.502     .  0 0 "[    .    1    .    2]" 1 
        275 1  40 SER H    1  41 TRP H    1.800 . 3.000 2.682 2.555 2.783     .  0 0 "[    .    1    .    2]" 1 
        276 1  40 SER H    1  41 TRP HD1  1.800 . 5.000 3.321 2.988 3.786     .  0 0 "[    .    1    .    2]" 1 
        277 1  40 SER H    1  42 ALA H    1.800 . 5.000 4.054 3.891 4.196     .  0 0 "[    .    1    .    2]" 1 
        278 1  41 TRP HA   1  42 ALA H    1.800 . 4.000 3.176 3.053 3.292     .  0 0 "[    .    1    .    2]" 1 
        279 1  41 TRP HA   1  43 ASP H    1.800 . 5.000 4.270 3.997 4.514     .  0 0 "[    .    1    .    2]" 1 
        280 1  41 TRP HA   1  44 GLY H    1.800 . 4.000 3.089 2.825 3.234     .  0 0 "[    .    1    .    2]" 1 
        281 1  41 TRP QB   1  42 ALA H    1.800 . 4.000 3.566 3.392 3.702     .  0 0 "[    .    1    .    2]" 1 
        282 1  41 TRP H    1  42 ALA H    1.800 . 3.000 2.439 2.261 2.613     .  0 0 "[    .    1    .    2]" 1 
        283 1  41 TRP H    1  43 ASP H    1.800 . 6.000 5.157 4.767 5.312     .  0 0 "[    .    1    .    2]" 1 
        284 1  41 TRP H    1  41 TRP HE1  1.800 . 6.000 4.491 4.288 4.708     .  0 0 "[    .    1    .    2]" 1 
        285 1  41 TRP H    1  41 TRP HD1  1.800 . 4.000 2.110 1.966 2.417     .  0 0 "[    .    1    .    2]" 1 
        286 1  41 TRP H    1  42 ALA MB   1.800 . 6.000 4.023 3.923 4.184     .  0 0 "[    .    1    .    2]" 1 
        287 1  41 TRP HD1  1  42 ALA H    1.800 . 5.000 4.507 4.326 4.718     .  0 0 "[    .    1    .    2]" 1 
        288 1  41 TRP HA   1  46 ALA H    1.800 . 5.000 3.145 2.820 3.694     .  0 0 "[    .    1    .    2]" 1 
        289 1  41 TRP HE3  1  47 LEU H    1.800 . 5.000 3.119 2.538 3.570     .  0 0 "[    .    1    .    2]" 1 
        290 1  41 TRP HZ3  1  47 LEU H    1.800 . 4.000 3.635 3.109 4.001 0.001  6 0 "[    .    1    .    2]" 1 
        291 1  42 ALA HA   1  43 ASP H    1.800 . 5.000 3.573 3.560 3.577     .  0 0 "[    .    1    .    2]" 1 
        292 1  42 ALA HA   1  97 ALA H    1.800 . 6.000 5.356 5.140 5.536     .  0 0 "[    .    1    .    2]" 1 
        293 1  42 ALA H    1  42 ALA MB   1.800 . 3.000 2.155 2.083 2.226     .  0 0 "[    .    1    .    2]" 1 
        294 1  42 ALA MB   1  43 ASP H    1.800 . 4.000 2.281 2.035 2.478     .  0 0 "[    .    1    .    2]" 1 
        295 1  42 ALA MB   1  97 ALA H    1.800 . 6.000 6.005 5.954 6.015 0.015 14 0 "[    .    1    .    2]" 1 
        296 1  42 ALA H    1  43 ASP H    1.800 . 4.000 2.949 2.746 3.087     .  0 0 "[    .    1    .    2]" 1 
        297 1  42 ALA H    1  44 GLY H    1.800 . 6.000 3.710 3.666 3.791     .  0 0 "[    .    1    .    2]" 1 
        298 1  43 ASP HA   1  44 GLY H    1.800 . 4.000 3.269 3.177 3.343     .  0 0 "[    .    1    .    2]" 1 
        299 1  43 ASP H    1  43 ASP HB3  1.800 . 4.000 2.855 2.704 2.999     .  0 0 "[    .    1    .    2]" 1 
        300 1  43 ASP H    1  43 ASP HB2  1.800 . 4.000 3.608 3.592 3.644     .  0 0 "[    .    1    .    2]" 1 
        301 1  43 ASP H    1  44 GLY H    1.800 . 3.500 2.551 2.308 2.629     .  0 0 "[    .    1    .    2]" 1 
        302 1  43 ASP H    1  44 GLY QA   1.800 . 5.000 4.417 4.251 4.461     .  0 0 "[    .    1    .    2]" 1 
        303 1  43 ASP H    1  69 ALA MB   1.800 . 6.000 4.017 3.759 4.302     .  0 0 "[    .    1    .    2]" 1 
        304 1  44 GLY HA3  1  45 LEU H    1.800 . 5.000 3.503 3.455 3.527     .  0 0 "[    .    1    .    2]" 1 
        305 1  44 GLY HA2  1  45 LEU H    1.800 . 5.000 2.931 2.861 3.057     .  0 0 "[    .    1    .    2]" 1 
        306 1  44 GLY QA   1  47 LEU H    1.800 . 6.000 3.320 3.236 3.379     .  0 0 "[    .    1    .    2]" 1 
        307 1  44 GLY H    1  45 LEU H    1.800 . 4.000 2.582 2.466 2.759     .  0 0 "[    .    1    .    2]" 1 
        308 1  45 LEU HA   1  48 CYS H    1.800 . 4.000 3.620 3.417 3.932     .  0 0 "[    .    1    .    2]" 1 
        309 1  45 LEU H    1  45 LEU HB3  1.800 . 4.000 3.300 2.640 3.427     .  0 0 "[    .    1    .    2]" 1 
        310 1  45 LEU H    1  45 LEU HB2  1.800 . 4.000 2.105 2.056 2.411     .  0 0 "[    .    1    .    2]" 1 
        311 1  45 LEU QB   1  46 ALA H    1.800 . 4.000 2.740 2.568 2.921     .  0 0 "[    .    1    .    2]" 1 
        312 1  45 LEU H    1  45 LEU MD1  1.800 . 6.000 4.015 3.388 4.238     .  0 0 "[    .    1    .    2]" 1 
        313 1  45 LEU H    1  45 LEU MD2  1.800 . 6.000 3.145 2.466 4.427     .  0 0 "[    .    1    .    2]" 1 
        314 1  45 LEU QD   1  46 ALA H    1.800 . 6.000 3.996 3.836 4.173     .  0 0 "[    .    1    .    2]" 1 
        315 1  45 LEU H    1  45 LEU HG   1.800 . 5.000 4.075 3.343 4.536     .  0 0 "[    .    1    .    2]" 1 
        316 1  45 LEU H    1  46 ALA H    1.800 . 3.000 2.536 2.481 2.648     .  0 0 "[    .    1    .    2]" 1 
        317 1  45 LEU H    1  47 LEU H    1.800 . 5.000 4.250 4.130 4.395     .  0 0 "[    .    1    .    2]" 1 
        318 1  46 ALA HA   1  47 LEU H    1.800 . 4.000 3.556 3.555 3.561     .  0 0 "[    .    1    .    2]" 1 
        319 1  46 ALA HA   1  49 ALA H    1.800 . 4.000 3.700 3.536 3.870     .  0 0 "[    .    1    .    2]" 1 
        320 1  46 ALA H    1  46 ALA MB   1.800 . 4.000 2.149 2.031 2.234     .  0 0 "[    .    1    .    2]" 1 
        321 1  46 ALA MB   1  47 LEU H    1.800 . 4.000 2.497 2.408 2.599     .  0 0 "[    .    1    .    2]" 1 
        322 1  46 ALA H    1  47 LEU H    1.800 . 3.000 2.727 2.657 2.789     .  0 0 "[    .    1    .    2]" 1 
        323 1  46 ALA H    1  48 CYS H    1.800 . 5.000 4.157 3.876 4.282     .  0 0 "[    .    1    .    2]" 1 
        324 1  46 ALA H    1  49 ALA MB   1.800 . 6.000 4.439 4.253 4.625     .  0 0 "[    .    1    .    2]" 1 
        325 1  47 LEU HA   1  48 CYS H    1.800 . 4.000 3.545 3.501 3.561     .  0 0 "[    .    1    .    2]" 1 
        326 1  47 LEU HA   1  50 LEU H    1.800 . 4.000 3.703 3.534 3.804     .  0 0 "[    .    1    .    2]" 1 
        327 1  47 LEU H    1  47 LEU HB3  1.800 . 4.000 3.129 2.579 3.593     .  0 0 "[    .    1    .    2]" 1 
        328 1  47 LEU H    1  47 LEU HB2  1.800 . 4.000 2.242 2.051 2.703     .  0 0 "[    .    1    .    2]" 1 
        329 1  47 LEU HB3  1  48 CYS H    1.800 . 5.000 2.862 2.478 3.812     .  0 0 "[    .    1    .    2]" 1 
        330 1  47 LEU HB2  1  48 CYS H    1.800 . 5.000 3.192 2.464 3.772     .  0 0 "[    .    1    .    2]" 1 
        331 1  47 LEU QB   1  48 CYS H    1.800 . 4.000 2.528 2.427 2.758     .  0 0 "[    .    1    .    2]" 1 
        332 1  47 LEU H    1  47 LEU MD1  1.800 . 5.000 3.522 2.237 4.300     .  0 0 "[    .    1    .    2]" 1 
        333 1  47 LEU H    1  47 LEU MD2  1.800 . 6.000 4.130 3.362 4.395     .  0 0 "[    .    1    .    2]" 1 
        334 1  47 LEU QD   1  48 CYS H    1.800 . 6.000 3.850 3.562 4.089     .  0 0 "[    .    1    .    2]" 1 
        335 1  47 LEU H    1  47 LEU HG   1.800 . 5.000 3.839 2.000 4.523     .  0 0 "[    .    1    .    2]" 1 
        336 1  47 LEU H    1  48 CYS H    1.800 . 3.000 2.656 2.484 2.768     .  0 0 "[    .    1    .    2]" 1 
        337 1  47 LEU H    1  49 ALA H    1.800 . 5.000 4.088 3.930 4.246     .  0 0 "[    .    1    .    2]" 1 
        338 1  48 CYS HA   1  49 ALA H    1.800 . 4.000 3.534 3.501 3.557     .  0 0 "[    .    1    .    2]" 1 
        339 1  48 CYS HA   1  51 VAL H    1.800 . 5.000 3.564 3.397 3.723     .  0 0 "[    .    1    .    2]" 1 
        340 1  48 CYS H    1  48 CYS HB3  1.800 . 4.000 3.367 2.918 3.604     .  0 0 "[    .    1    .    2]" 1 
        341 1  48 CYS H    1  48 CYS HB2  1.800 . 4.000 2.235 2.062 2.544     .  0 0 "[    .    1    .    2]" 1 
        342 1  48 CYS HB3  1  49 ALA H    1.800 . 5.000 3.188 2.702 3.808     .  0 0 "[    .    1    .    2]" 1 
        343 1  48 CYS HB2  1  49 ALA H    1.800 . 5.000 2.968 2.579 3.584     .  0 0 "[    .    1    .    2]" 1 
        344 1  48 CYS QB   1  49 ALA H    1.800 . 4.000 2.636 2.489 2.861     .  0 0 "[    .    1    .    2]" 1 
        345 1  48 CYS H    1  49 ALA H    1.800 . 3.000 2.635 2.542 2.730     .  0 0 "[    .    1    .    2]" 1 
        346 1  48 CYS H    1  50 LEU H    1.800 . 5.000 4.226 4.070 4.371     .  0 0 "[    .    1    .    2]" 1 
        347 1  48 CYS H    1  76 ALA MB   1.800 . 6.000 3.783 3.217 4.136     .  0 0 "[    .    1    .    2]" 1 
        348 1  49 ALA HA   1  50 LEU H    1.800 . 4.000 3.544 3.524 3.558     .  0 0 "[    .    1    .    2]" 1 
        349 1  49 ALA HA   1  52 TYR H    1.800 . 4.000 3.749 3.639 3.998     .  0 0 "[    .    1    .    2]" 1 
        350 1  49 ALA H    1  49 ALA MB   1.800 . 4.000 2.162 2.089 2.232     .  0 0 "[    .    1    .    2]" 1 
        351 1  49 ALA MB   1  50 LEU H    1.800 . 4.000 2.580 2.373 2.684     .  0 0 "[    .    1    .    2]" 1 
        352 1  49 ALA H    1  50 LEU H    1.800 . 3.000 2.760 2.702 2.822     .  0 0 "[    .    1    .    2]" 1 
        353 1  49 ALA H    1  51 VAL H    1.800 . 5.000 4.418 4.249 4.503     .  0 0 "[    .    1    .    2]" 1 
        354 1  50 LEU HA   1  51 VAL H    1.800 . 4.000 3.563 3.552 3.568     .  0 0 "[    .    1    .    2]" 1 
        355 1  50 LEU HA   1  53 ARG H    1.800 . 4.000 3.603 3.463 3.737     .  0 0 "[    .    1    .    2]" 1 
        356 1  50 LEU H    1  50 LEU HB3  1.800 . 4.000 3.554 3.417 3.592     .  0 0 "[    .    1    .    2]" 1 
        357 1  50 LEU H    1  50 LEU HB2  1.800 . 4.000 2.391 2.113 2.620     .  0 0 "[    .    1    .    2]" 1 
        358 1  50 LEU HB3  1  51 VAL H    1.800 . 5.000 3.298 2.924 3.558     .  0 0 "[    .    1    .    2]" 1 
        359 1  50 LEU HB2  1  51 VAL H    1.800 . 5.000 2.449 2.314 2.750     .  0 0 "[    .    1    .    2]" 1 
        360 1  50 LEU QB   1  51 VAL H    1.800 . 4.000 2.372 2.285 2.523     .  0 0 "[    .    1    .    2]" 1 
        361 1  50 LEU H    1  50 LEU MD1  1.800 . 6.000 3.165 2.263 3.665     .  0 0 "[    .    1    .    2]" 1 
        362 1  50 LEU H    1  50 LEU MD2  1.800 . 6.000 3.801 3.490 4.333     .  0 0 "[    .    1    .    2]" 1 
        363 1  50 LEU H    1  50 LEU HG   1.800 . 5.000 2.604 2.055 3.957     .  0 0 "[    .    1    .    2]" 1 
        364 1  50 LEU H    1  51 VAL H    1.800 . 3.000 2.750 2.654 2.825     .  0 0 "[    .    1    .    2]" 1 
        365 1  51 VAL HA   1  52 TYR H    1.800 . 4.000 3.547 3.513 3.561     .  0 0 "[    .    1    .    2]" 1 
        366 1  51 VAL HA   1  54 LEU H    1.800 . 4.000 3.472 3.371 3.604     .  0 0 "[    .    1    .    2]" 1 
        367 1  51 VAL HA   1  55 GLN H    1.800 . 5.000 3.942 3.548 4.173     .  0 0 "[    .    1    .    2]" 1 
        368 1  51 VAL H    1  51 VAL HB   1.800 . 3.000 2.678 2.617 2.742     .  0 0 "[    .    1    .    2]" 1 
        369 1  51 VAL HB   1  52 TYR H    1.800 . 4.000 2.499 2.379 2.714     .  0 0 "[    .    1    .    2]" 1 
        370 1  51 VAL H    1  51 VAL MG1  1.800 . 5.000 3.759 3.750 3.769     .  0 0 "[    .    1    .    2]" 1 
        371 1  51 VAL H    1  51 VAL MG2  1.800 . 5.000 1.962 1.916 2.099     .  0 0 "[    .    1    .    2]" 1 
        372 1  51 VAL MG1  1  52 TYR H    1.800 . 6.000 3.552 3.399 3.749     .  0 0 "[    .    1    .    2]" 1 
        373 1  51 VAL MG2  1  52 TYR H    1.800 . 6.000 3.682 3.577 3.749     .  0 0 "[    .    1    .    2]" 1 
        374 1  51 VAL QG   1  55 GLN H    1.800 . 6.000 3.641 3.396 3.797     .  0 0 "[    .    1    .    2]" 1 
        375 1  51 VAL H    1  52 TYR H    1.800 . 3.000 2.755 2.685 2.796     .  0 0 "[    .    1    .    2]" 1 
        376 1  51 VAL H    1  53 ARG H    1.800 . 5.000 4.156 4.093 4.395     .  0 0 "[    .    1    .    2]" 1 
        377 1  51 VAL MG1  1  80 ALA H    1.800 . 6.000 3.719 3.468 4.256     .  0 0 "[    .    1    .    2]" 1 
        378 1  51 VAL MG2  1  80 ALA H    1.800 . 6.000 4.065 3.570 4.680     .  0 0 "[    .    1    .    2]" 1 
        379 1  52 TYR HA   1  53 ARG H    1.800 . 5.000 3.526 3.522 3.553     .  0 0 "[    .    1    .    2]" 1 
        380 1  52 TYR HA   1  55 GLN H    1.800 . 4.000 3.377 3.210 3.556     .  0 0 "[    .    1    .    2]" 1 
        381 1  52 TYR HA   1  59 LEU H    1.800 . 5.000 4.869 3.917 5.020 0.020 19 0 "[    .    1    .    2]" 1 
        382 1  52 TYR H    1  52 TYR HB3  1.800 . 4.000 2.593 2.488 2.701     .  0 0 "[    .    1    .    2]" 1 
        383 1  52 TYR H    1  52 TYR HB2  1.800 . 4.000 2.466 2.362 2.576     .  0 0 "[    .    1    .    2]" 1 
        384 1  52 TYR QB   1  53 ARG H    1.800 . 4.000 2.631 2.465 2.673     .  0 0 "[    .    1    .    2]" 1 
        385 1  52 TYR H    1  53 ARG H    1.800 . 3.000 2.713 2.597 2.777     .  0 0 "[    .    1    .    2]" 1 
        386 1  52 TYR H    1  54 LEU H    1.800 . 5.000 4.255 4.001 4.348     .  0 0 "[    .    1    .    2]" 1 
        387 1  52 TYR QE   1  58 LEU H    1.800 . 6.000 5.688 4.788 6.008 0.008 20 0 "[    .    1    .    2]" 1 
        388 1  52 TYR QD   1  53 ARG H    1.800 . 6.000 3.747 3.382 4.082     .  0 0 "[    .    1    .    2]" 1 
        389 1  52 TYR QD   1  59 LEU H    1.800 . 6.000 3.994 3.572 4.230     .  0 0 "[    .    1    .    2]" 1 
        390 1  53 ARG HA   1  54 LEU H    1.800 . 4.000 3.534 3.489 3.544     .  0 0 "[    .    1    .    2]" 1 
        391 1  53 ARG H    1  53 ARG HB3  1.800 . 4.000 3.009 2.577 3.353     .  0 0 "[    .    1    .    2]" 1 
        392 1  53 ARG H    1  53 ARG HB2  1.800 . 4.000 2.181 2.060 2.469     .  0 0 "[    .    1    .    2]" 1 
        393 1  53 ARG HB3  1  54 LEU H    1.800 . 4.000 2.773 2.582 3.020     .  0 0 "[    .    1    .    2]" 1 
        394 1  53 ARG HB2  1  54 LEU H    1.800 . 4.000 3.454 3.035 3.845     .  0 0 "[    .    1    .    2]" 1 
        395 1  53 ARG H    1  53 ARG QD   1.800 . 6.000 4.347 3.640 4.758     .  0 0 "[    .    1    .    2]" 1 
        396 1  53 ARG H    1  53 ARG HG3  1.800 . 6.000 4.187 3.415 4.522     .  0 0 "[    .    1    .    2]" 1 
        397 1  53 ARG H    1  53 ARG HG2  1.800 . 6.000 4.212 3.463 4.643     .  0 0 "[    .    1    .    2]" 1 
        398 1  53 ARG H    1  54 LEU H    1.800 . 3.000 2.670 2.629 2.694     .  0 0 "[    .    1    .    2]" 1 
        399 1  53 ARG H    1  55 GLN H    1.800 . 5.000 4.004 3.861 4.304     .  0 0 "[    .    1    .    2]" 1 
        400 1  54 LEU HA   1  55 GLN H    1.800 . 4.000 3.515 3.480 3.558     .  0 0 "[    .    1    .    2]" 1 
        401 1  54 LEU H    1  54 LEU HB3  1.800 . 4.000 3.504 3.397 3.661     .  0 0 "[    .    1    .    2]" 1 
        402 1  54 LEU H    1  54 LEU HB2  1.800 . 4.000 2.226 2.116 2.687     .  0 0 "[    .    1    .    2]" 1 
        403 1  54 LEU HB3  1  55 GLN H    1.800 . 5.000 3.435 3.109 3.672     .  0 0 "[    .    1    .    2]" 1 
        404 1  54 LEU HB2  1  55 GLN H    1.800 . 5.000 2.850 2.363 3.012     .  0 0 "[    .    1    .    2]" 1 
        405 1  54 LEU QB   1  55 GLN H    1.800 . 4.000 2.712 2.336 2.846     .  0 0 "[    .    1    .    2]" 1 
        406 1  54 LEU H    1  54 LEU MD1  1.800 . 5.000 3.735 2.341 4.153     .  0 0 "[    .    1    .    2]" 1 
        407 1  54 LEU H    1  54 LEU MD2  1.800 . 5.000 2.660 2.194 4.311     .  0 0 "[    .    1    .    2]" 1 
        408 1  54 LEU QD   1  55 GLN H    1.800 . 6.000 3.874 3.648 3.992     .  0 0 "[    .    1    .    2]" 1 
        409 1  54 LEU H    1  54 LEU HG   1.800 . 4.000 3.905 2.184 4.017 0.017 19 0 "[    .    1    .    2]" 1 
        410 1  54 LEU H    1  55 GLN H    1.800 . 3.000 2.431 2.284 2.501     .  0 0 "[    .    1    .    2]" 1 
        411 1  55 GLN HA   1  57 GLY H    1.800 . 4.000 3.431 3.211 3.970     .  0 0 "[    .    1    .    2]" 1 
        412 1  55 GLN HA   1  58 LEU H    1.800 . 4.000 4.015 4.001 4.035 0.035 18 0 "[    .    1    .    2]" 1 
        413 1  55 GLN H    1  55 GLN HB3  1.800 . 4.000 3.588 3.189 3.858     .  0 0 "[    .    1    .    2]" 1 
        414 1  55 GLN H    1  55 GLN HB2  1.800 . 4.000 2.872 2.571 3.850     .  0 0 "[    .    1    .    2]" 1 
        415 1  55 GLN QB   1  58 LEU H    1.800 . 4.000 2.977 2.807 3.195     .  0 0 "[    .    1    .    2]" 1 
        416 1  55 GLN H    1  56 PRO HD3  1.800 . 5.000 3.163 2.870 3.687     .  0 0 "[    .    1    .    2]" 1 
        417 1  55 GLN H    1  56 PRO HD2  1.800 . 5.000 3.959 3.761 4.243     .  0 0 "[    .    1    .    2]" 1 
        418 1  55 GLN H    1  56 PRO QD   1.800 . 4.000 3.042 2.785 3.474     .  0 0 "[    .    1    .    2]" 1 
        419 1  55 GLN HA   1  55 GLN HE21 1.800 . 6.000 4.424 1.991 5.132     .  0 0 "[    .    1    .    2]" 1 
        420 1  55 GLN HE21 1  58 LEU HG   1.800 . 5.000 4.403 3.524 4.997     .  0 0 "[    .    1    .    2]" 1 
        421 1  55 GLN HE21 1  58 LEU QD   1.800 . 6.000 2.971 1.964 4.551     .  0 0 "[    .    1    .    2]" 1 
        422 1  55 GLN HE22 1  58 LEU QD   1.800 . 6.000 3.367 1.907 5.397     .  0 0 "[    .    1    .    2]" 1 
        423 1  55 GLN QE   1  58 LEU QD   1.800 . 5.000 2.651 1.883 4.157     .  0 0 "[    .    1    .    2]" 1 
        424 1  56 PRO HA   1  57 GLY H    1.800 . 3.500 3.510 3.448 3.555 0.055  2 0 "[    .    1    .    2]" 1 
        425 1  56 PRO HA   1  58 LEU H    1.800 . 4.500 4.004 3.715 4.390     .  0 0 "[    .    1    .    2]" 1 
        426 1  56 PRO HA   1  59 LEU H    1.800 . 5.000 3.915 3.437 4.357     .  0 0 "[    .    1    .    2]" 1 
        427 1  56 PRO HB3  1  57 GLY H    1.800 . 4.500 4.157 3.878 4.340     .  0 0 "[    .    1    .    2]" 1 
        428 1  56 PRO HB2  1  57 GLY H    1.800 . 4.500 3.364 2.826 3.659     .  0 0 "[    .    1    .    2]" 1 
        429 1  56 PRO QB   1  57 GLY H    1.800 . 3.500 3.227 2.761 3.477     .  0 0 "[    .    1    .    2]" 1 
        430 1  56 PRO QG   1  57 GLY H    1.800 . 3.000 2.401 1.983 2.788     .  0 0 "[    .    1    .    2]" 1 
        431 1  56 PRO HD3  1  57 GLY H    1.800 . 5.000 3.846 3.752 3.963     .  0 0 "[    .    1    .    2]" 1 
        432 1  56 PRO HD2  1  57 GLY H    1.800 . 5.000 2.665 2.509 2.917     .  0 0 "[    .    1    .    2]" 1 
        433 1  56 PRO QD   1  57 GLY H    1.800 . 3.000 2.618 2.473 2.846     .  0 0 "[    .    1    .    2]" 1 
        434 1  56 PRO QD   1  58 LEU H    1.800 . 5.000 4.287 4.076 4.401     .  0 0 "[    .    1    .    2]" 1 
        435 1  57 GLY QA   1  58 LEU H    1.800 . 3.500 2.851 2.743 2.932     .  0 0 "[    .    1    .    2]" 1 
        436 1  57 GLY QA   1  59 LEU H    1.800 . 5.000 3.711 3.461 4.527     .  0 0 "[    .    1    .    2]" 1 
        437 1  57 GLY H    1  58 LEU H    1.800 . 3.000 2.572 2.351 2.702     .  0 0 "[    .    1    .    2]" 1 
        438 1  57 GLY H    1  59 LEU H    1.800 . 6.000 4.358 4.090 5.228     .  0 0 "[    .    1    .    2]" 1 
        439 1  58 LEU HA   1  59 LEU H    1.800 . 4.000 3.006 2.827 3.579     .  0 0 "[    .    1    .    2]" 1 
        440 1  58 LEU H    1  58 LEU HB3  1.800 . 4.000 3.563 3.095 3.793     .  0 0 "[    .    1    .    2]" 1 
        441 1  58 LEU H    1  58 LEU HB2  1.800 . 4.000 2.427 2.070 2.686     .  0 0 "[    .    1    .    2]" 1 
        442 1  58 LEU QB   1  59 LEU H    1.800 . 5.000 3.644 2.050 3.844     .  0 0 "[    .    1    .    2]" 1 
        443 1  58 LEU H    1  58 LEU MD1  1.800 . 5.000 4.054 3.622 4.441     .  0 0 "[    .    1    .    2]" 1 
        444 1  58 LEU H    1  58 LEU MD2  1.800 . 5.000 3.661 2.062 4.488     .  0 0 "[    .    1    .    2]" 1 
        445 1  58 LEU QD   1  83 GLU H    1.800 . 6.000 5.333 3.366 6.004 0.004  9 0 "[    .    1    .    2]" 1 
        446 1  58 LEU H    1  58 LEU HG   1.800 . 4.000 3.642 2.556 4.012 0.012 14 0 "[    .    1    .    2]" 1 
        447 1  58 LEU H    1  59 LEU H    1.800 . 4.000 2.624 2.310 3.093     .  0 0 "[    .    1    .    2]" 1 
        448 1  59 LEU HA   1  60 GLU H    1.800 . 3.000 2.405 2.157 2.546     .  0 0 "[    .    1    .    2]" 1 
        449 1  59 LEU H    1  59 LEU HB3  1.800 . 4.000 3.590 3.404 3.903     .  0 0 "[    .    1    .    2]" 1 
        450 1  59 LEU H    1  59 LEU HB2  1.800 . 4.000 2.767 2.636 2.979     .  0 0 "[    .    1    .    2]" 1 
        451 1  59 LEU H    1  59 LEU QB   1.800 . 3.000 2.677 2.575 2.862     .  0 0 "[    .    1    .    2]" 1 
        452 1  59 LEU H    1  59 LEU MD1  1.800 . 6.000 3.901 2.252 4.487     .  0 0 "[    .    1    .    2]" 1 
        453 1  59 LEU H    1  59 LEU MD2  1.800 . 6.000 4.106 3.133 4.899     .  0 0 "[    .    1    .    2]" 1 
        454 1  59 LEU QD   1  60 GLU H    1.800 . 6.000 2.651 1.830 4.220     .  0 0 "[    .    1    .    2]" 1 
        455 1  59 LEU H    1  59 LEU HG   1.800 . 5.000 4.600 3.224 5.022 0.022 18 0 "[    .    1    .    2]" 1 
        456 1  59 LEU HG   1  60 GLU H    1.800 . 5.000 3.768 2.390 4.631     .  0 0 "[    .    1    .    2]" 1 
        457 1  59 LEU H    1  60 GLU H    1.800 . 5.500 4.396 4.224 4.442     .  0 0 "[    .    1    .    2]" 1 
        458 1  60 GLU HA   1  62 SER H    1.800 . 5.000 3.421 3.126 3.890     .  0 0 "[    .    1    .    2]" 1 
        459 1  60 GLU HA   1  63 GLU H    1.800 . 5.000 4.171 3.834 4.490     .  0 0 "[    .    1    .    2]" 1 
        460 1  60 GLU H    1  60 GLU HB3  1.800 . 4.000 3.846 3.648 3.956     .  0 0 "[    .    1    .    2]" 1 
        461 1  60 GLU H    1  60 GLU HB2  1.800 . 4.000 2.836 2.428 3.007     .  0 0 "[    .    1    .    2]" 1 
        462 1  60 GLU H    1  60 GLU QB   1.800 . 3.000 2.765 2.394 2.920     .  0 0 "[    .    1    .    2]" 1 
        463 1  60 GLU QB   1  62 SER H    1.800 . 5.000 4.069 3.541 4.588     .  0 0 "[    .    1    .    2]" 1 
        464 1  60 GLU QB   1  63 GLU H    1.800 . 4.000 3.085 2.824 3.595     .  0 0 "[    .    1    .    2]" 1 
        465 1  60 GLU QB   1  64 LEU H    1.800 . 5.000 4.028 3.559 4.600     .  0 0 "[    .    1    .    2]" 1 
        466 1  60 GLU H    1  60 GLU HG3  1.800 . 5.000 3.931 2.912 4.897     .  0 0 "[    .    1    .    2]" 1 
        467 1  60 GLU H    1  60 GLU HG2  1.800 . 5.000 3.844 2.634 4.516     .  0 0 "[    .    1    .    2]" 1 
        468 1  60 GLU H    1  60 GLU QG   1.800 . 4.000 3.357 2.534 3.814     .  0 0 "[    .    1    .    2]" 1 
        469 1  60 GLU H    1  61 PRO HA   1.800 . 5.000 4.220 4.062 4.873     .  0 0 "[    .    1    .    2]" 1 
        470 1  60 GLU H    1  61 PRO QD   1.800 . 5.000 2.579 2.014 3.568     .  0 0 "[    .    1    .    2]" 1 
        471 1  60 GLU H    1  62 SER H    1.800 . 6.000 5.124 4.660 5.727     .  0 0 "[    .    1    .    2]" 1 
        472 1  61 PRO HA   1  62 SER H    1.800 . 4.000 3.516 3.456 3.573     .  0 0 "[    .    1    .    2]" 1 
        473 1  61 PRO HA   1  63 GLU H    1.800 . 5.000 4.205 4.033 4.457     .  0 0 "[    .    1    .    2]" 1 
        474 1  61 PRO HA   1  64 LEU H    1.800 . 3.500 3.409 3.127 3.514 0.014  1 0 "[    .    1    .    2]" 1 
        475 1  61 PRO QB   1  62 SER H    1.800 . 4.000 3.114 2.657 3.432     .  0 0 "[    .    1    .    2]" 1 
        476 1  61 PRO QG   1  62 SER H    1.800 . 3.500 2.546 2.145 2.884     .  0 0 "[    .    1    .    2]" 1 
        477 1  61 PRO HD3  1  62 SER H    1.800 . 5.000 4.086 4.042 4.141     .  0 0 "[    .    1    .    2]" 1 
        478 1  61 PRO HD2  1  62 SER H    1.800 . 5.000 3.102 3.022 3.220     .  0 0 "[    .    1    .    2]" 1 
        479 1  61 PRO QD   1  62 SER H    1.800 . 3.500 3.012 2.942 3.114     .  0 0 "[    .    1    .    2]" 1 
        480 1  61 PRO QD   1  63 GLU H    1.800 . 5.000 4.724 4.313 4.978     .  0 0 "[    .    1    .    2]" 1 
        481 1  62 SER HA   1  63 GLU H    1.800 . 3.500 3.522 3.486 3.542 0.042  6 0 "[    .    1    .    2]" 1 
        482 1  62 SER QB   1  63 GLU H    1.800 . 4.000 2.808 2.427 3.514     .  0 0 "[    .    1    .    2]" 1 
        483 1  62 SER H    1  63 GLU H    1.800 . 3.000 2.758 2.631 2.842     .  0 0 "[    .    1    .    2]" 1 
        484 1  62 SER H    1  64 LEU H    1.800 . 5.000 4.393 4.250 4.575     .  0 0 "[    .    1    .    2]" 1 
        485 1  62 SER H    1  64 LEU QB   1.800 . 6.000 5.442 4.935 5.937     .  0 0 "[    .    1    .    2]" 1 
        486 1  63 GLU HA   1  64 LEU H    1.800 . 4.000 3.559 3.549 3.564     .  0 0 "[    .    1    .    2]" 1 
        487 1  63 GLU H    1  63 GLU HB3  1.800 . 4.000 3.150 2.527 3.598     .  0 0 "[    .    1    .    2]" 1 
        488 1  63 GLU H    1  63 GLU HB2  1.800 . 4.000 2.241 2.084 2.540     .  0 0 "[    .    1    .    2]" 1 
        489 1  63 GLU QB   1  64 LEU H    1.800 . 4.000 2.448 2.348 2.538     .  0 0 "[    .    1    .    2]" 1 
        490 1  63 GLU H    1  63 GLU HG3  1.800 . 5.000 3.728 2.453 4.464     .  0 0 "[    .    1    .    2]" 1 
        491 1  63 GLU H    1  63 GLU HG2  1.800 . 5.000 4.216 2.971 4.662     .  0 0 "[    .    1    .    2]" 1 
        492 1  63 GLU QG   1  64 LEU H    1.800 . 6.000 4.087 3.503 4.371     .  0 0 "[    .    1    .    2]" 1 
        493 1  63 GLU H    1  64 LEU H    1.800 . 3.000 2.644 2.598 2.670     .  0 0 "[    .    1    .    2]" 1 
        494 1  64 LEU HA   1  65 GLN H    1.800 . 3.500 3.368 3.350 3.415     .  0 0 "[    .    1    .    2]" 1 
        495 1  64 LEU H    1  64 LEU HB3  1.800 . 4.000 3.583 3.518 3.623     .  0 0 "[    .    1    .    2]" 1 
        496 1  64 LEU H    1  64 LEU HB2  1.800 . 4.000 2.522 2.236 2.685     .  0 0 "[    .    1    .    2]" 1 
        497 1  64 LEU QB   1  65 GLN H    1.800 . 5.000 3.205 3.094 3.258     .  0 0 "[    .    1    .    2]" 1 
        498 1  64 LEU H    1  64 LEU MD1  1.800 . 6.000 3.205 1.956 3.723     .  0 0 "[    .    1    .    2]" 1 
        499 1  64 LEU H    1  64 LEU MD2  1.800 . 6.000 3.096 1.933 3.958     .  0 0 "[    .    1    .    2]" 1 
        500 1  64 LEU H    1  64 LEU HG   1.800 . 5.000 2.691 1.972 4.038     .  0 0 "[    .    1    .    2]" 1 
        501 1  64 LEU HG   1  65 GLN H    1.800 . 6.000 4.776 4.278 5.622     .  0 0 "[    .    1    .    2]" 1 
        502 1  64 LEU H    1  65 GLN H    1.800 . 4.500 2.577 2.433 2.677     .  0 0 "[    .    1    .    2]" 1 
        503 1  65 GLN HA   1  66 GLY H    1.800 . 3.500 3.521 3.497 3.531 0.031  6 0 "[    .    1    .    2]" 1 
        504 1  65 GLN HA   1  68 GLY H    1.800 . 5.000 5.030 5.011 5.055 0.055 13 0 "[    .    1    .    2]" 1 
        505 1  65 GLN H    1  65 GLN HB3  1.800 . 4.000 2.602 2.343 3.470     .  0 0 "[    .    1    .    2]" 1 
        506 1  65 GLN H    1  65 GLN HB2  1.800 . 4.000 2.487 2.090 2.699     .  0 0 "[    .    1    .    2]" 1 
        507 1  65 GLN H    1  65 GLN QB   1.800 . 3.000 2.215 2.055 2.245     .  0 0 "[    .    1    .    2]" 1 
        508 1  65 GLN QB   1  66 GLY H    1.800 . 5.000 2.688 2.594 2.814     .  0 0 "[    .    1    .    2]" 1 
        509 1  65 GLN H    1  65 GLN QG   1.800 . 4.000 3.857 2.894 4.002 0.002 10 0 "[    .    1    .    2]" 1 
        510 1  65 GLN QG   1  66 GLY H    1.800 . 6.000 3.959 3.343 4.450     .  0 0 "[    .    1    .    2]" 1 
        511 1  65 GLN H    1  66 GLY H    1.800 . 5.000 2.710 2.682 2.743     .  0 0 "[    .    1    .    2]" 1 
        512 1  65 GLN H    1  67 LEU H    1.800 . 6.000 3.776 3.658 3.913     .  0 0 "[    .    1    .    2]" 1 
        513 1  65 GLN H    1  72 ALA HA   1.800 . 6.000 5.969 5.678 6.038 0.038 14 0 "[    .    1    .    2]" 1 
        514 1  65 GLN H    1  72 ALA MB   1.800 . 5.000 4.293 3.978 4.579     .  0 0 "[    .    1    .    2]" 1 
        515 1  66 GLY HA3  1  67 LEU H    1.800 . 5.000 3.140 3.000 3.332     .  0 0 "[    .    1    .    2]" 1 
        516 1  66 GLY HA2  1  67 LEU H    1.800 . 5.000 3.403 3.244 3.483     .  0 0 "[    .    1    .    2]" 1 
        517 1  66 GLY H    1  67 LEU H    1.800 . 4.000 1.983 1.909 2.114     .  0 0 "[    .    1    .    2]" 1 
        518 1  66 GLY H    1  67 LEU QD   1.800 . 6.000 3.674 3.461 4.069     .  0 0 "[    .    1    .    2]" 1 
        519 1  67 LEU HA   1  68 GLY H    1.800 . 4.000 3.495 3.467 3.516     .  0 0 "[    .    1    .    2]" 1 
        520 1  67 LEU H    1  67 LEU HB3  1.800 . 4.000 3.385 3.320 3.509     .  0 0 "[    .    1    .    2]" 1 
        521 1  67 LEU H    1  67 LEU HB2  1.800 . 4.000 2.104 2.067 2.214     .  0 0 "[    .    1    .    2]" 1 
        522 1  67 LEU QB   1  68 GLY H    1.800 . 4.000 2.888 2.806 2.989     .  0 0 "[    .    1    .    2]" 1 
        523 1  67 LEU H    1  67 LEU MD1  1.800 . 5.000 2.768 2.287 3.265     .  0 0 "[    .    1    .    2]" 1 
        524 1  67 LEU H    1  67 LEU MD2  1.800 . 5.000 4.287 4.134 4.476     .  0 0 "[    .    1    .    2]" 1 
        525 1  67 LEU MD1  1  68 GLY H    1.800 . 5.000 4.591 4.416 4.771     .  0 0 "[    .    1    .    2]" 1 
        526 1  67 LEU MD2  1  68 GLY H    1.800 . 5.000 4.857 4.802 4.941     .  0 0 "[    .    1    .    2]" 1 
        527 1  67 LEU H    1  67 LEU HG   1.800 . 4.000 3.841 2.985 4.034 0.034  1 0 "[    .    1    .    2]" 1 
        528 1  67 LEU HG   1  68 GLY H    1.800 . 5.000 5.019 4.897 5.043 0.043 20 0 "[    .    1    .    2]" 1 
        529 1  67 LEU H    1  68 GLY H    1.800 . 4.000 2.651 2.271 2.829     .  0 0 "[    .    1    .    2]" 1 
        530 1  68 GLY QA   1  69 ALA H    1.800 . 3.000 2.183 2.107 2.274     .  0 0 "[    .    1    .    2]" 1 
        531 1  68 GLY QA   1  71 GLU H    1.800 . 5.000 3.263 3.106 3.364     .  0 0 "[    .    1    .    2]" 1 
        532 1  68 GLY H    1  69 ALA H    1.800 . 5.000 4.203 3.936 4.389     .  0 0 "[    .    1    .    2]" 1 
        533 1  69 ALA HA   1  70 LEU H    1.800 . 4.000 3.570 3.566 3.573     .  0 0 "[    .    1    .    2]" 1 
        534 1  69 ALA H    1  69 ALA MB   1.800 . 4.000 2.128 2.039 2.248     .  0 0 "[    .    1    .    2]" 1 
        535 1  69 ALA MB   1  70 LEU H    1.800 . 4.000 2.322 2.031 2.425     .  0 0 "[    .    1    .    2]" 1 
        536 1  69 ALA H    1  70 LEU H    1.800 . 3.000 2.723 2.598 2.975     .  0 0 "[    .    1    .    2]" 1 
        537 1  69 ALA H    1  71 GLU H    1.800 . 5.000 3.818 3.697 3.958     .  0 0 "[    .    1    .    2]" 1 
        538 1  70 LEU HA   1  71 GLU H    1.800 . 4.000 3.525 3.519 3.544     .  0 0 "[    .    1    .    2]" 1 
        539 1  70 LEU HA   1  73 THR H    1.800 . 4.000 3.574 3.450 3.716     .  0 0 "[    .    1    .    2]" 1 
        540 1  70 LEU H    1  70 LEU HB3  1.800 . 4.000 3.213 2.474 3.588     .  0 0 "[    .    1    .    2]" 1 
        541 1  70 LEU H    1  70 LEU HB2  1.800 . 4.000 2.335 2.116 2.720     .  0 0 "[    .    1    .    2]" 1 
        542 1  70 LEU QB   1  71 GLU H    1.800 . 4.000 2.649 2.528 2.760     .  0 0 "[    .    1    .    2]" 1 
        543 1  70 LEU QB   1  72 ALA H    1.800 . 6.000 4.799 4.608 4.890     .  0 0 "[    .    1    .    2]" 1 
        544 1  70 LEU H    1  70 LEU MD1  1.800 . 6.000 3.545 2.217 4.253     .  0 0 "[    .    1    .    2]" 1 
        545 1  70 LEU H    1  70 LEU MD2  1.800 . 6.000 3.626 1.883 4.285     .  0 0 "[    .    1    .    2]" 1 
        546 1  70 LEU QD   1  71 GLU H    1.800 . 5.000 3.798 2.903 4.150     .  0 0 "[    .    1    .    2]" 1 
        547 1  70 LEU QD   1  93 GLN H    1.800 . 5.000 3.414 2.498 4.388     .  0 0 "[    .    1    .    2]" 1 
        548 1  70 LEU H    1  70 LEU HG   1.800 . 5.000 3.594 1.959 4.538     .  0 0 "[    .    1    .    2]" 1 
        549 1  70 LEU H    1  71 GLU H    1.800 . 3.000 2.695 2.656 2.755     .  0 0 "[    .    1    .    2]" 1 
        550 1  70 LEU H    1  72 ALA H    1.800 . 5.000 4.290 4.074 4.366     .  0 0 "[    .    1    .    2]" 1 
        551 1  70 LEU H    1  96 VAL QG   1.800 . 6.000 3.352 2.791 3.759     .  0 0 "[    .    1    .    2]" 1 
        552 1  71 GLU HA   1  72 ALA H    1.800 . 4.000 3.545 3.511 3.556     .  0 0 "[    .    1    .    2]" 1 
        553 1  71 GLU HA   1  74 ALA H    1.800 . 4.000 3.735 3.604 3.894     .  0 0 "[    .    1    .    2]" 1 
        554 1  71 GLU H    1  71 GLU HB3  1.800 . 4.000 3.104 2.705 3.523     .  0 0 "[    .    1    .    2]" 1 
        555 1  71 GLU H    1  71 GLU HB2  1.800 . 4.000 2.201 2.103 2.360     .  0 0 "[    .    1    .    2]" 1 
        556 1  71 GLU HB3  1  72 ALA H    1.800 . 5.000 2.809 2.475 3.277     .  0 0 "[    .    1    .    2]" 1 
        557 1  71 GLU HB2  1  72 ALA H    1.800 . 5.000 3.266 2.665 3.723     .  0 0 "[    .    1    .    2]" 1 
        558 1  71 GLU QB   1  72 ALA H    1.800 . 4.000 2.563 2.432 2.754     .  0 0 "[    .    1    .    2]" 1 
        559 1  71 GLU H    1  71 GLU HG3  1.800 . 5.000 4.018 2.875 4.506     .  0 0 "[    .    1    .    2]" 1 
        560 1  71 GLU H    1  71 GLU HG2  1.800 . 5.000 4.293 2.751 4.657     .  0 0 "[    .    1    .    2]" 1 
        561 1  71 GLU HG3  1  72 ALA H    1.800 . 6.000 4.822 4.215 5.191     .  0 0 "[    .    1    .    2]" 1 
        562 1  71 GLU HG2  1  72 ALA H    1.800 . 6.000 4.685 4.148 5.174     .  0 0 "[    .    1    .    2]" 1 
        563 1  71 GLU H    1  72 ALA H    1.800 . 3.000 2.674 2.534 2.763     .  0 0 "[    .    1    .    2]" 1 
        564 1  71 GLU H    1  73 THR H    1.800 . 5.000 4.163 4.109 4.234     .  0 0 "[    .    1    .    2]" 1 
        565 1  72 ALA HA   1  73 THR H    1.800 . 4.000 3.543 3.532 3.548     .  0 0 "[    .    1    .    2]" 1 
        566 1  72 ALA HA   1  75 TRP H    1.800 . 4.000 3.776 3.672 3.845     .  0 0 "[    .    1    .    2]" 1 
        567 1  72 ALA HA   1  76 ALA H    1.800 . 5.000 3.742 3.461 4.025     .  0 0 "[    .    1    .    2]" 1 
        568 1  72 ALA H    1  72 ALA MB   1.800 . 3.000 2.178 2.062 2.236     .  0 0 "[    .    1    .    2]" 1 
        569 1  72 ALA MB   1  73 THR H    1.800 . 4.000 2.520 2.469 2.686     .  0 0 "[    .    1    .    2]" 1 
        570 1  72 ALA H    1  73 THR H    1.800 . 3.000 2.674 2.638 2.690     .  0 0 "[    .    1    .    2]" 1 
        571 1  72 ALA H    1  74 ALA H    1.800 . 5.000 4.297 4.207 4.360     .  0 0 "[    .    1    .    2]" 1 
        572 1  73 THR HA   1  74 ALA H    1.800 . 4.000 3.560 3.550 3.563     .  0 0 "[    .    1    .    2]" 1 
        573 1  73 THR HA   1  76 ALA H    1.800 . 4.000 3.694 3.554 3.845     .  0 0 "[    .    1    .    2]" 1 
        574 1  73 THR H    1  73 THR HB   1.800 . 4.000 2.835 2.534 3.485     .  0 0 "[    .    1    .    2]" 1 
        575 1  73 THR HB   1  74 ALA H    1.800 . 4.000 2.538 2.359 3.803     .  0 0 "[    .    1    .    2]" 1 
        576 1  73 THR H    1  73 THR MG   1.800 . 5.000 3.537 2.092 3.752     .  0 0 "[    .    1    .    2]" 1 
        577 1  73 THR MG   1  74 ALA H    1.800 . 5.000 3.638 1.914 4.055     .  0 0 "[    .    1    .    2]" 1 
        578 1  73 THR MG   1  92 ALA H    1.800 . 6.000 4.244 3.690 5.710     .  0 0 "[    .    1    .    2]" 1 
        579 1  73 THR MG   1  95 VAL H    1.800 . 6.000 4.422 4.052 5.113     .  0 0 "[    .    1    .    2]" 1 
        580 1  73 THR MG   1  96 VAL H    1.800 . 6.000 3.975 3.543 4.708     .  0 0 "[    .    1    .    2]" 1 
        581 1  73 THR H    1  74 ALA H    1.800 . 3.000 2.703 2.658 2.729     .  0 0 "[    .    1    .    2]" 1 
        582 1  73 THR H    1  75 TRP H    1.800 . 5.000 4.105 4.060 4.170     .  0 0 "[    .    1    .    2]" 1 
        583 1  74 ALA HA   1  75 TRP H    1.800 . 4.000 3.547 3.543 3.551     .  0 0 "[    .    1    .    2]" 1 
        584 1  74 ALA HA   1  77 LEU H    1.800 . 4.000 3.651 3.533 3.802     .  0 0 "[    .    1    .    2]" 1 
        585 1  74 ALA H    1  74 ALA MB   1.800 . 3.000 2.153 2.084 2.236     .  0 0 "[    .    1    .    2]" 1 
        586 1  74 ALA MB   1  75 TRP H    1.800 . 4.000 2.550 2.487 2.631     .  0 0 "[    .    1    .    2]" 1 
        587 1  74 ALA H    1  75 TRP H    1.800 . 3.000 2.718 2.666 2.766     .  0 0 "[    .    1    .    2]" 1 
        588 1  74 ALA H    1  76 ALA H    1.800 . 5.000 4.237 4.074 4.370     .  0 0 "[    .    1    .    2]" 1 
        589 1  74 ALA H    1  92 ALA MB   1.800 . 5.000 3.221 2.794 3.480     .  0 0 "[    .    1    .    2]" 1 
        590 1  74 ALA MB   1  92 ALA H    1.800 . 6.000 5.117 4.435 5.495     .  0 0 "[    .    1    .    2]" 1 
        591 1  75 TRP HA   1  76 ALA H    1.800 . 4.000 3.546 3.518 3.560     .  0 0 "[    .    1    .    2]" 1 
        592 1  75 TRP HA   1  78 LYS H    1.800 . 4.000 3.681 3.537 3.794     .  0 0 "[    .    1    .    2]" 1 
        593 1  75 TRP HA   1  79 VAL H    1.800 . 5.000 3.971 3.713 4.124     .  0 0 "[    .    1    .    2]" 1 
        594 1  75 TRP H    1  75 TRP HB3  1.800 . 4.000 2.821 2.675 3.056     .  0 0 "[    .    1    .    2]" 1 
        595 1  75 TRP H    1  75 TRP HB2  1.800 . 4.000 2.293 2.144 2.412     .  0 0 "[    .    1    .    2]" 1 
        596 1  75 TRP HB3  1  76 ALA H    1.800 . 5.000 2.522 2.385 2.734     .  0 0 "[    .    1    .    2]" 1 
        597 1  75 TRP HB2  1  76 ALA H    1.800 . 5.000 3.582 3.302 3.777     .  0 0 "[    .    1    .    2]" 1 
        598 1  75 TRP QB   1  76 ALA H    1.800 . 4.000 2.473 2.354 2.659     .  0 0 "[    .    1    .    2]" 1 
        599 1  75 TRP H    1  76 ALA H    1.800 . 3.000 2.659 2.595 2.726     .  0 0 "[    .    1    .    2]" 1 
        600 1  75 TRP H    1  77 LEU H    1.800 . 5.000 4.049 3.979 4.194     .  0 0 "[    .    1    .    2]" 1 
        601 1  75 TRP HE3  1  76 ALA HA   1.800 . 4.000 2.974 2.418 3.724     .  0 0 "[    .    1    .    2]" 1 
        602 1  75 TRP HE3  1  79 VAL QG   1.800 . 6.000 2.593 2.053 3.210     .  0 0 "[    .    1    .    2]" 1 
        603 1  75 TRP HE1  1  79 VAL QG   1.800 . 6.000 4.341 3.735 5.725     .  0 0 "[    .    1    .    2]" 1 
        604 1  75 TRP HA   1  75 TRP HE1  1.800 . 5.000 4.892 4.724 5.005 0.005 12 0 "[    .    1    .    2]" 1 
        605 1  75 TRP HZ3  1  79 VAL QG   1.800 . 6.000 2.658 1.994 3.210     .  0 0 "[    .    1    .    2]" 1 
        606 1  75 TRP HZ2  1  79 VAL QG   1.800 . 6.000 3.684 3.056 4.666     .  0 0 "[    .    1    .    2]" 1 
        607 1  58 LEU HA   1  75 TRP HH2  1.800 . 6.000 5.656 5.189 6.008 0.008  2 0 "[    .    1    .    2]" 1 
        608 1  59 LEU QD   1  75 TRP HZ3  1.800 . 6.000 2.451 1.922 3.854     .  0 0 "[    .    1    .    2]" 1 
        609 1  59 LEU QD   1  75 TRP HE3  1.800 . 6.000 3.287 1.868 3.890     .  0 0 "[    .    1    .    2]" 1 
        610 1  75 TRP H    1  75 TRP HD1  1.800 . 6.000 4.546 4.090 4.788     .  0 0 "[    .    1    .    2]" 1 
        611 1  75 TRP H    1  75 TRP HE3  1.800 . 6.000 5.118 4.906 5.437     .  0 0 "[    .    1    .    2]" 1 
        612 1  75 TRP HE3  1  76 ALA H    1.800 . 5.000 3.642 3.146 4.209     .  0 0 "[    .    1    .    2]" 1 
        613 1  76 ALA HA   1  77 LEU H    1.800 . 4.000 3.532 3.523 3.555     .  0 0 "[    .    1    .    2]" 1 
        614 1  76 ALA HA   1  78 LYS H    1.800 . 5.000 4.532 4.387 4.653     .  0 0 "[    .    1    .    2]" 1 
        615 1  76 ALA HA   1  79 VAL H    1.800 . 4.000 3.700 3.628 3.897     .  0 0 "[    .    1    .    2]" 1 
        616 1  76 ALA HA   1  80 ALA H    1.800 . 6.000 3.537 3.393 3.681     .  0 0 "[    .    1    .    2]" 1 
        617 1  76 ALA H    1  76 ALA MB   1.800 . 4.000 2.169 2.101 2.242     .  0 0 "[    .    1    .    2]" 1 
        618 1  76 ALA MB   1  77 LEU H    1.800 . 4.000 2.618 2.446 2.705     .  0 0 "[    .    1    .    2]" 1 
        619 1  76 ALA H    1  77 LEU H    1.800 . 3.000 2.636 2.559 2.761     .  0 0 "[    .    1    .    2]" 1 
        620 1  76 ALA H    1  78 LYS QB   1.800 . 6.000 5.122 5.004 5.235     .  0 0 "[    .    1    .    2]" 1 
        621 1  76 ALA H    1  78 LYS H    1.800 . 5.000 4.245 4.150 4.327     .  0 0 "[    .    1    .    2]" 1 
        622 1  77 LEU HA   1  78 LYS H    1.800 . 4.000 3.548 3.530 3.558     .  0 0 "[    .    1    .    2]" 1 
        623 1  77 LEU HA   1  80 ALA H    1.800 . 4.000 3.746 3.612 3.905     .  0 0 "[    .    1    .    2]" 1 
        624 1  77 LEU H    1  77 LEU HB3  1.800 . 4.000 3.262 2.584 3.580     .  0 0 "[    .    1    .    2]" 1 
        625 1  77 LEU H    1  77 LEU HB2  1.800 . 4.000 2.262 2.085 2.439     .  0 0 "[    .    1    .    2]" 1 
        626 1  77 LEU HB3  1  78 LYS H    1.800 . 5.000 3.059 2.469 3.573     .  0 0 "[    .    1    .    2]" 1 
        627 1  77 LEU HB2  1  78 LYS H    1.800 . 5.000 3.021 2.572 3.764     .  0 0 "[    .    1    .    2]" 1 
        628 1  77 LEU QB   1  78 LYS H    1.800 . 4.000 2.564 2.435 2.722     .  0 0 "[    .    1    .    2]" 1 
        629 1  77 LEU H    1  77 LEU MD1  1.800 . 6.000 3.516 2.628 4.013     .  0 0 "[    .    1    .    2]" 1 
        630 1  77 LEU H    1  77 LEU MD2  1.800 . 6.000 4.053 3.755 4.361     .  0 0 "[    .    1    .    2]" 1 
        631 1  77 LEU MD1  1  78 LYS H    1.800 . 6.000 4.569 4.303 4.911     .  0 0 "[    .    1    .    2]" 1 
        632 1  77 LEU MD2  1  78 LYS H    1.800 . 6.000 4.475 3.538 4.815     .  0 0 "[    .    1    .    2]" 1 
        633 1  77 LEU QD   1  90 VAL H    1.800 . 6.000 3.679 3.136 3.952     .  0 0 "[    .    1    .    2]" 1 
        634 1  77 LEU H    1  77 LEU HG   1.800 . 5.000 3.416 2.387 4.519     .  0 0 "[    .    1    .    2]" 1 
        635 1  77 LEU HG   1  78 LYS H    1.800 . 5.000 4.578 3.854 4.961     .  0 0 "[    .    1    .    2]" 1 
        636 1  77 LEU H    1  78 LYS H    1.800 . 3.000 2.684 2.621 2.720     .  0 0 "[    .    1    .    2]" 1 
        637 1  77 LEU H    1  79 VAL H    1.800 . 5.000 4.275 4.232 4.311     .  0 0 "[    .    1    .    2]" 1 
        638 1  77 LEU QD   1  92 ALA H    1.800 . 5.000 3.678 3.175 4.078     .  0 0 "[    .    1    .    2]" 1 
        639 1  78 LYS HA   1  79 VAL H    1.800 . 4.000 3.560 3.557 3.564     .  0 0 "[    .    1    .    2]" 1 
        640 1  78 LYS HA   1  81 GLU H    1.800 . 4.000 3.824 3.781 3.880     .  0 0 "[    .    1    .    2]" 1 
        641 1  78 LYS HA   1  82 ASN H    1.800 . 5.000 4.280 4.116 4.442     .  0 0 "[    .    1    .    2]" 1 
        642 1  78 LYS H    1  78 LYS HB3  1.800 . 4.000 3.035 2.510 3.576     .  0 0 "[    .    1    .    2]" 1 
        643 1  78 LYS H    1  78 LYS HB2  1.800 . 4.000 2.225 2.066 2.542     .  0 0 "[    .    1    .    2]" 1 
        644 1  78 LYS HB3  1  79 VAL H    1.800 . 4.000 2.653 2.421 3.388     .  0 0 "[    .    1    .    2]" 1 
        645 1  78 LYS HB2  1  79 VAL H    1.800 . 4.000 3.285 2.512 3.808     .  0 0 "[    .    1    .    2]" 1 
        646 1  78 LYS H    1  78 LYS HG3  1.800 . 6.000 3.938 2.563 4.579     .  0 0 "[    .    1    .    2]" 1 
        647 1  78 LYS H    1  78 LYS HG2  1.800 . 6.000 4.191 3.452 4.597     .  0 0 "[    .    1    .    2]" 1 
        648 1  78 LYS H    1  79 VAL H    1.800 . 3.000 2.695 2.640 2.746     .  0 0 "[    .    1    .    2]" 1 
        649 1  78 LYS H    1  79 VAL QG   1.800 . 6.000 3.733 3.480 4.060     .  0 0 "[    .    1    .    2]" 1 
        650 1  78 LYS H    1  80 ALA H    1.800 . 5.000 4.042 3.976 4.109     .  0 0 "[    .    1    .    2]" 1 
        651 1  78 LYS H    1  80 ALA MB   1.800 . 6.000 4.614 4.512 4.719     .  0 0 "[    .    1    .    2]" 1 
        652 1  79 VAL HA   1  80 ALA H    1.800 . 4.000 3.542 3.527 3.559     .  0 0 "[    .    1    .    2]" 1 
        653 1  79 VAL HA   1  81 GLU H    1.800 . 5.000 4.372 4.200 4.442     .  0 0 "[    .    1    .    2]" 1 
        654 1  79 VAL HA   1  82 ASN H    1.800 . 4.000 3.199 3.095 3.248     .  0 0 "[    .    1    .    2]" 1 
        655 1  79 VAL HA   1  83 GLU H    1.800 . 5.000 3.651 3.591 3.743     .  0 0 "[    .    1    .    2]" 1 
        656 1  79 VAL H    1  79 VAL HB   1.800 . 4.000 3.115 2.569 3.625     .  0 0 "[    .    1    .    2]" 1 
        657 1  79 VAL HB   1  80 ALA H    1.800 . 4.000 3.329 2.480 3.901     .  0 0 "[    .    1    .    2]" 1 
        658 1  79 VAL H    1  79 VAL MG1  1.800 . 5.000 2.770 1.992 3.776     .  0 0 "[    .    1    .    2]" 1 
        659 1  79 VAL H    1  79 VAL MG2  1.800 . 5.000 2.258 1.955 3.775     .  0 0 "[    .    1    .    2]" 1 
        660 1  79 VAL MG1  1  80 ALA H    1.800 . 6.000 3.499 1.900 3.929     .  0 0 "[    .    1    .    2]" 1 
        661 1  79 VAL MG2  1  80 ALA H    1.800 . 6.000 2.815 1.879 3.776     .  0 0 "[    .    1    .    2]" 1 
        662 1  79 VAL QG   1  83 GLU H    1.800 . 6.000 3.894 3.188 4.445     .  0 0 "[    .    1    .    2]" 1 
        663 1  79 VAL H    1  80 ALA H    1.800 . 3.000 2.618 2.589 2.662     .  0 0 "[    .    1    .    2]" 1 
        664 1  79 VAL H    1  81 GLU H    1.800 . 5.000 4.221 4.065 4.328     .  0 0 "[    .    1    .    2]" 1 
        665 1  80 ALA HA   1  81 GLU H    1.800 . 4.000 3.538 3.511 3.546     .  0 0 "[    .    1    .    2]" 1 
        666 1  80 ALA HA   1  83 GLU H    1.800 . 4.000 3.642 3.562 3.677     .  0 0 "[    .    1    .    2]" 1 
        667 1  80 ALA HA   1  84 LEU H    1.800 . 5.000 3.502 3.225 3.608     .  0 0 "[    .    1    .    2]" 1 
        668 1  80 ALA H    1  80 ALA MB   1.800 . 5.000 2.227 2.145 2.240     .  0 0 "[    .    1    .    2]" 1 
        669 1  80 ALA MB   1  81 GLU H    1.800 . 4.000 2.476 2.418 2.581     .  0 0 "[    .    1    .    2]" 1 
        670 1  80 ALA H    1  81 GLU H    1.800 . 3.000 2.764 2.697 2.799     .  0 0 "[    .    1    .    2]" 1 
        671 1  80 ALA H    1  82 ASN H    1.800 . 4.000 4.008 4.000 4.024 0.024  2 0 "[    .    1    .    2]" 1 
        672 1  81 GLU HA   1  82 ASN H    1.800 . 4.000 3.517 3.511 3.521     .  0 0 "[    .    1    .    2]" 1 
        673 1  81 GLU H    1  81 GLU HB3  1.800 . 4.000 2.517 2.388 2.648     .  0 0 "[    .    1    .    2]" 1 
        674 1  81 GLU H    1  81 GLU HB2  1.800 . 4.000 2.945 2.461 3.605     .  0 0 "[    .    1    .    2]" 1 
        675 1  81 GLU HB3  1  82 ASN H    1.800 . 5.000 3.135 2.681 3.977     .  0 0 "[    .    1    .    2]" 1 
        676 1  81 GLU HB2  1  82 ASN H    1.800 . 5.000 3.889 3.755 3.997     .  0 0 "[    .    1    .    2]" 1 
        677 1  81 GLU QB   1  82 ASN H    1.800 . 4.000 2.932 2.632 3.461     .  0 0 "[    .    1    .    2]" 1 
        678 1  81 GLU H    1  81 GLU QG   1.800 . 5.000 3.343 2.051 4.021     .  0 0 "[    .    1    .    2]" 1 
        679 1  81 GLU H    1  82 ASN H    1.800 . 3.000 2.529 2.517 2.537     .  0 0 "[    .    1    .    2]" 1 
        680 1  81 GLU H    1  83 GLU H    1.800 . 5.000 4.124 4.111 4.137     .  0 0 "[    .    1    .    2]" 1 
        681 1  82 ASN HA   1  83 GLU H    1.800 . 4.000 3.536 3.532 3.542     .  0 0 "[    .    1    .    2]" 1 
        682 1  82 ASN H    1  82 ASN HB3  1.800 . 4.000 3.251 2.525 3.582     .  0 0 "[    .    1    .    2]" 1 
        683 1  82 ASN H    1  82 ASN HB2  1.800 . 4.000 2.200 2.082 2.550     .  0 0 "[    .    1    .    2]" 1 
        684 1  82 ASN QB   1  83 GLU H    1.800 . 5.000 2.655 2.559 2.730     .  0 0 "[    .    1    .    2]" 1 
        685 1  82 ASN H    1  82 ASN QD   1.800 . 6.000 4.143 2.591 4.666     .  0 0 "[    .    1    .    2]" 1 
        686 1  82 ASN H    1  83 GLU H    1.800 . 3.000 2.603 2.565 2.627     .  0 0 "[    .    1    .    2]" 1 
        687 1  82 ASN H    1  84 LEU H    1.800 . 5.000 4.097 4.026 4.154     .  0 0 "[    .    1    .    2]" 1 
        688 1  83 GLU HA   1  84 LEU H    1.800 . 6.000 3.550 3.538 3.558     .  0 0 "[    .    1    .    2]" 1 
        689 1  83 GLU H    1  83 GLU HB3  1.800 . 4.000 3.324 2.847 3.615     .  0 0 "[    .    1    .    2]" 1 
        690 1  83 GLU H    1  83 GLU HB2  1.800 . 4.000 2.217 2.107 2.522     .  0 0 "[    .    1    .    2]" 1 
        691 1  83 GLU HB3  1  84 LEU H    1.800 . 5.000 3.109 2.625 3.707     .  0 0 "[    .    1    .    2]" 1 
        692 1  83 GLU HB2  1  84 LEU H    1.800 . 5.000 3.026 2.595 3.587     .  0 0 "[    .    1    .    2]" 1 
        693 1  83 GLU QB   1  84 LEU H    1.800 . 3.000 2.647 2.543 2.712     .  0 0 "[    .    1    .    2]" 1 
        694 1  83 GLU QB   1  85 GLY H    1.800 . 6.000 4.661 4.558 4.844     .  0 0 "[    .    1    .    2]" 1 
        695 1  83 GLU H    1  83 GLU QG   1.800 . 4.000 3.491 2.202 4.003 0.003  6 0 "[    .    1    .    2]" 1 
        696 1  83 GLU QG   1  84 LEU H    1.800 . 6.000 4.391 3.965 4.524     .  0 0 "[    .    1    .    2]" 1 
        697 1  83 GLU H    1  84 LEU H    1.800 . 3.000 2.502 2.464 2.529     .  0 0 "[    .    1    .    2]" 1 
        698 1  83 GLU H    1  85 GLY H    1.800 . 5.000 3.923 3.704 4.338     .  0 0 "[    .    1    .    2]" 1 
        699 1  84 LEU HA   1  85 GLY H    1.800 . 5.000 3.542 3.497 3.578     .  0 0 "[    .    1    .    2]" 1 
        700 1  84 LEU H    1  84 LEU HB3  1.800 . 4.000 3.228 2.607 3.675     .  0 0 "[    .    1    .    2]" 1 
        701 1  84 LEU H    1  84 LEU HB2  1.800 . 4.000 2.371 2.199 2.683     .  0 0 "[    .    1    .    2]" 1 
        702 1  84 LEU H    1  84 LEU MD1  1.800 . 5.000 3.676 2.036 4.376     .  0 0 "[    .    1    .    2]" 1 
        703 1  84 LEU H    1  84 LEU MD2  1.800 . 5.000 4.057 3.295 4.443     .  0 0 "[    .    1    .    2]" 1 
        704 1  84 LEU MD1  1  85 GLY H    1.800 . 6.000 4.388 3.682 4.985     .  0 0 "[    .    1    .    2]" 1 
        705 1  84 LEU MD2  1  85 GLY H    1.800 . 6.000 4.394 2.798 4.939     .  0 0 "[    .    1    .    2]" 1 
        706 1  84 LEU H    1  84 LEU HG   1.800 . 5.000 3.930 2.205 4.628     .  0 0 "[    .    1    .    2]" 1 
        707 1  84 LEU HG   1  85 GLY H    1.800 . 6.000 4.837 4.024 5.239     .  0 0 "[    .    1    .    2]" 1 
        708 1  84 LEU H    1  85 GLY H    1.800 . 3.000 2.336 2.271 2.506     .  0 0 "[    .    1    .    2]" 1 
        709 1  84 LEU H    1  86 ILE H    1.800 . 6.000 4.017 3.892 4.319     .  0 0 "[    .    1    .    2]" 1 
        710 1  85 GLY QA   1  86 ILE H    1.800 . 5.000 2.836 2.763 2.903     .  0 0 "[    .    1    .    2]" 1 
        711 1  85 GLY H    1  86 ILE H    1.800 . 4.000 2.175 1.981 2.398     .  0 0 "[    .    1    .    2]" 1 
        712 1  86 ILE HA   1  87 THR H    1.800 . 5.000 2.149 2.142 2.168     .  0 0 "[    .    1    .    2]" 1 
        713 1  86 ILE H    1  86 ILE HB   1.800 . 4.000 2.692 2.590 2.967     .  0 0 "[    .    1    .    2]" 1 
        714 1  86 ILE H    1  86 ILE HG13 1.800 . 6.000 3.370 2.110 4.631     .  0 0 "[    .    1    .    2]" 1 
        715 1  86 ILE H    1  86 ILE HG12 1.800 . 6.000 3.500 2.082 4.657     .  0 0 "[    .    1    .    2]" 1 
        716 1  86 ILE H    1  86 ILE MG   1.800 . 6.000 3.261 1.941 3.863     .  0 0 "[    .    1    .    2]" 1 
        717 1  86 ILE MG   1  87 THR H    1.800 . 6.000 3.085 2.385 3.997     .  0 0 "[    .    1    .    2]" 1 
        718 1  86 ILE MG   1 111 PHE H    1.800 . 6.000 4.807 3.996 5.972     .  0 0 "[    .    1    .    2]" 1 
        719 1  86 ILE H    1  87 THR H    1.800 . 5.000 4.426 4.309 4.530     .  0 0 "[    .    1    .    2]" 1 
        720 1  86 ILE MD   1 114 ALA H    1.800 . 6.000 4.672 4.010 5.395     .  0 0 "[    .    1    .    2]" 1 
        721 1  87 THR H    1  87 THR HB   1.800 . 3.000 2.673 2.498 2.927     .  0 0 "[    .    1    .    2]" 1 
        722 1  87 THR H    1  87 THR MG   1.800 . 6.000 3.049 1.933 3.762     .  0 0 "[    .    1    .    2]" 1 
        723 1  88 PRO HA   1  89 VAL H    1.800 . 3.000 2.207 2.152 2.308     .  0 0 "[    .    1    .    2]" 1 
        724 1  88 PRO HB3  1  89 VAL H    1.800 . 5.000 3.343 2.996 4.089     .  0 0 "[    .    1    .    2]" 1 
        725 1  88 PRO HB2  1  89 VAL H    1.800 . 5.000 3.654 3.238 3.859     .  0 0 "[    .    1    .    2]" 1 
        726 1  88 PRO QB   1  89 VAL H    1.800 . 4.000 3.079 2.797 3.426     .  0 0 "[    .    1    .    2]" 1 
        727 1  89 VAL HA   1  90 VAL H    1.800 . 5.000 3.332 3.041 3.484     .  0 0 "[    .    1    .    2]" 1 
        728 1  89 VAL H    1  89 VAL HB   1.800 . 3.000 2.737 2.674 2.924     .  0 0 "[    .    1    .    2]" 1 
        729 1  89 VAL HB   1  90 VAL H    1.800 . 4.000 3.379 2.941 3.963     .  0 0 "[    .    1    .    2]" 1 
        730 1  89 VAL H    1  89 VAL MG1  1.800 . 5.000 3.894 3.845 3.972     .  0 0 "[    .    1    .    2]" 1 
        731 1  89 VAL H    1  89 VAL MG2  1.800 . 4.000 2.585 2.401 2.810     .  0 0 "[    .    1    .    2]" 1 
        732 1  89 VAL MG1  1  90 VAL H    1.800 . 5.000 4.033 3.847 4.210     .  0 0 "[    .    1    .    2]" 1 
        733 1  89 VAL MG2  1  90 VAL H    1.800 . 5.000 3.989 3.809 4.203     .  0 0 "[    .    1    .    2]" 1 
        734 1  89 VAL QG   1 107 TYR H    1.800 . 6.000 3.934 3.103 4.742     .  0 0 "[    .    1    .    2]" 1 
        735 1  89 VAL H    1  90 VAL H    1.800 . 4.000 2.015 1.909 2.582     .  0 0 "[    .    1    .    2]" 1 
        736 1  89 VAL H    1 107 TYR QE   1.800 . 4.000 2.681 2.089 3.624     .  0 0 "[    .    1    .    2]" 1 
        737 1  90 VAL HA   1  91 SER H    1.800 . 3.000 2.339 2.250 2.379     .  0 0 "[    .    1    .    2]" 1 
        738 1  90 VAL H    1  90 VAL HB   1.800 . 4.000 3.456 2.823 3.919     .  0 0 "[    .    1    .    2]" 1 
        739 1  90 VAL HB   1  91 SER H    1.800 . 4.000 3.209 2.460 4.004 0.004  8 0 "[    .    1    .    2]" 1 
        740 1  90 VAL H    1  90 VAL MG1  1.800 . 5.000 3.148 2.155 3.974     .  0 0 "[    .    1    .    2]" 1 
        741 1  90 VAL H    1  90 VAL MG2  1.800 . 5.000 2.908 2.131 3.973     .  0 0 "[    .    1    .    2]" 1 
        742 1  90 VAL MG1  1  91 SER H    1.800 . 6.000 3.189 1.895 3.720     .  0 0 "[    .    1    .    2]" 1 
        743 1  90 VAL MG2  1  91 SER H    1.800 . 6.000 3.216 1.896 3.905     .  0 0 "[    .    1    .    2]" 1 
        744 1  90 VAL QG   1  95 VAL H    1.800 . 6.000 3.640 2.875 4.761     .  0 0 "[    .    1    .    2]" 1 
        745 1  90 VAL MG1  1 104 LEU H    1.800 . 6.000 4.066 3.288 5.522     .  0 0 "[    .    1    .    2]" 1 
        746 1  90 VAL MG2  1 104 LEU H    1.800 . 6.000 4.340 3.368 5.764     .  0 0 "[    .    1    .    2]" 1 
        747 1  90 VAL H    1  91 SER H    1.800 . 6.000 4.403 4.335 4.460     .  0 0 "[    .    1    .    2]" 1 
        748 1  90 VAL H    1 107 TYR QD   1.800 . 5.000 3.914 2.369 4.808     .  0 0 "[    .    1    .    2]" 1 
        749 1  90 VAL H    1 107 TYR QE   1.800 . 6.000 4.165 3.091 5.161     .  0 0 "[    .    1    .    2]" 1 
        750 1  91 SER HA   1  92 ALA H    1.800 . 4.000 2.309 2.244 2.375     .  0 0 "[    .    1    .    2]" 1 
        751 1  91 SER HA   1  93 GLN H    1.800 . 6.000 4.358 4.272 4.427     .  0 0 "[    .    1    .    2]" 1 
        752 1  91 SER H    1  91 SER HB3  1.800 . 4.000 3.202 2.519 3.664     .  0 0 "[    .    1    .    2]" 1 
        753 1  91 SER H    1  91 SER HB2  1.800 . 4.000 2.620 2.195 3.642     .  0 0 "[    .    1    .    2]" 1 
        754 1  91 SER HB3  1  92 ALA H    1.800 . 5.000 3.161 2.506 3.976     .  0 0 "[    .    1    .    2]" 1 
        755 1  91 SER HB2  1  92 ALA H    1.800 . 5.000 3.748 2.761 4.164     .  0 0 "[    .    1    .    2]" 1 
        756 1  91 SER QB   1  92 ALA H    1.800 . 4.000 2.892 2.467 3.480     .  0 0 "[    .    1    .    2]" 1 
        757 1  91 SER QB   1  93 GLN H    1.800 . 4.000 2.955 2.651 3.670     .  0 0 "[    .    1    .    2]" 1 
        758 1  91 SER QB   1  94 ALA H    1.800 . 4.000 2.657 2.309 3.389     .  0 0 "[    .    1    .    2]" 1 
        759 1  91 SER H    1  92 ALA H    1.800 . 6.000 4.591 4.511 4.620     .  0 0 "[    .    1    .    2]" 1 
        760 1  91 SER H    1  93 GLN H    1.800 . 6.000 5.524 5.396 5.644     .  0 0 "[    .    1    .    2]" 1 
        761 1  91 SER H    1  94 ALA H    1.800 . 5.000 4.197 4.007 4.364     .  0 0 "[    .    1    .    2]" 1 
        762 1  91 SER H    1  94 ALA MB   1.800 . 4.000 2.830 2.551 3.091     .  0 0 "[    .    1    .    2]" 1 
        763 1  92 ALA HA   1  93 GLN H    1.800 . 4.000 3.546 3.542 3.547     .  0 0 "[    .    1    .    2]" 1 
        764 1  92 ALA HA   1  95 VAL H    1.800 . 4.000 3.428 3.320 3.603     .  0 0 "[    .    1    .    2]" 1 
        765 1  92 ALA HA   1  96 VAL H    1.800 . 5.000 3.932 3.716 4.225     .  0 0 "[    .    1    .    2]" 1 
        766 1  92 ALA H    1  92 ALA MB   1.800 . 4.000 2.163 2.096 2.232     .  0 0 "[    .    1    .    2]" 1 
        767 1  92 ALA MB   1  93 GLN H    1.800 . 4.000 2.563 2.484 2.628     .  0 0 "[    .    1    .    2]" 1 
        768 1  92 ALA H    1  93 GLN H    1.800 . 3.000 2.712 2.663 2.767     .  0 0 "[    .    1    .    2]" 1 
        769 1  92 ALA H    1  94 ALA H    1.800 . 5.000 4.182 4.020 4.313     .  0 0 "[    .    1    .    2]" 1 
        770 1  93 GLN HA   1  94 ALA H    1.800 . 4.000 3.526 3.504 3.553     .  0 0 "[    .    1    .    2]" 1 
        771 1  93 GLN HA   1  95 VAL H    1.800 . 5.000 4.532 4.382 4.649     .  0 0 "[    .    1    .    2]" 1 
        772 1  93 GLN HA   1  96 VAL H    1.800 . 5.000 3.724 3.607 3.827     .  0 0 "[    .    1    .    2]" 1 
        773 1  93 GLN HA   1  97 ALA H    1.800 . 6.000 4.005 3.725 4.279     .  0 0 "[    .    1    .    2]" 1 
        774 1  93 GLN H    1  93 GLN HB3  1.800 . 4.000 3.015 2.506 3.590     .  0 0 "[    .    1    .    2]" 1 
        775 1  93 GLN H    1  93 GLN HB2  1.800 . 4.000 2.485 2.061 3.591     .  0 0 "[    .    1    .    2]" 1 
        776 1  93 GLN HB3  1  94 ALA H    1.800 . 5.000 3.142 2.591 4.003     .  0 0 "[    .    1    .    2]" 1 
        777 1  93 GLN HB2  1  94 ALA H    1.800 . 5.000 3.403 2.520 3.929     .  0 0 "[    .    1    .    2]" 1 
        778 1  93 GLN QB   1  94 ALA H    1.800 . 4.000 2.768 2.477 3.497     .  0 0 "[    .    1    .    2]" 1 
        779 1  93 GLN H    1  93 GLN HG3  1.800 . 5.000 3.745 2.244 4.472     .  0 0 "[    .    1    .    2]" 1 
        780 1  93 GLN H    1  93 GLN HG2  1.800 . 5.000 3.721 1.998 4.630     .  0 0 "[    .    1    .    2]" 1 
        781 1  93 GLN QG   1  94 ALA H    1.800 . 6.000 3.847 1.920 4.573     .  0 0 "[    .    1    .    2]" 1 
        782 1  93 GLN H    1  94 ALA H    1.800 . 3.000 2.735 2.627 2.819     .  0 0 "[    .    1    .    2]" 1 
        783 1  93 GLN H    1  95 VAL H    1.800 . 5.000 4.285 4.131 4.383     .  0 0 "[    .    1    .    2]" 1 
        784 1  94 ALA HA   1  95 VAL H    1.800 . 5.000 3.543 3.523 3.558     .  0 0 "[    .    1    .    2]" 1 
        785 1  94 ALA HA   1  96 VAL H    1.800 . 5.000 4.718 4.510 4.847     .  0 0 "[    .    1    .    2]" 1 
        786 1  94 ALA HA   1  97 ALA H    1.800 . 5.000 3.629 3.522 3.796     .  0 0 "[    .    1    .    2]" 1 
        787 1  94 ALA HA   1  98 GLY H    1.800 . 5.000 4.324 3.819 4.612     .  0 0 "[    .    1    .    2]" 1 
        788 1  94 ALA HA   1  99 SER H    1.800 . 6.000 3.479 2.799 3.976     .  0 0 "[    .    1    .    2]" 1 
        789 1  94 ALA H    1  94 ALA MB   1.800 . 3.000 2.138 2.069 2.234     .  0 0 "[    .    1    .    2]" 1 
        790 1  94 ALA MB   1  95 VAL H    1.800 . 4.000 2.575 2.433 2.736     .  0 0 "[    .    1    .    2]" 1 
        791 1  94 ALA MB   1 100 ASP H    1.800 . 6.000 4.230 2.792 4.759     .  0 0 "[    .    1    .    2]" 1 
        792 1  94 ALA H    1  95 VAL H    1.800 . 3.000 2.637 2.583 2.668     .  0 0 "[    .    1    .    2]" 1 
        793 1  94 ALA H    1  95 VAL QG   1.800 . 6.000 3.815 3.487 3.918     .  0 0 "[    .    1    .    2]" 1 
        794 1  94 ALA H    1  96 VAL H    1.800 . 5.000 4.250 4.045 4.389     .  0 0 "[    .    1    .    2]" 1 
        795 1  95 VAL HA   1  96 VAL H    1.800 . 5.000 3.559 3.541 3.566     .  0 0 "[    .    1    .    2]" 1 
        796 1  95 VAL HA   1  98 GLY H    1.800 . 5.000 3.382 3.289 3.619     .  0 0 "[    .    1    .    2]" 1 
        797 1  95 VAL H    1  95 VAL HB   1.800 . 4.000 2.739 2.605 3.626     .  0 0 "[    .    1    .    2]" 1 
        798 1  95 VAL H    1  95 VAL MG1  1.800 . 5.000 3.357 1.962 3.773     .  0 0 "[    .    1    .    2]" 1 
        799 1  95 VAL H    1  95 VAL MG2  1.800 . 5.000 2.317 1.930 3.778     .  0 0 "[    .    1    .    2]" 1 
        800 1  95 VAL H    1  95 VAL QG   1.800 . 5.000 2.030 1.853 2.137     .  0 0 "[    .    1    .    2]" 1 
        801 1  95 VAL H    1  96 VAL H    1.800 . 4.000 2.708 2.595 2.803     .  0 0 "[    .    1    .    2]" 1 
        802 1  96 VAL HA   1  97 ALA H    1.800 . 4.000 3.507 3.476 3.529     .  0 0 "[    .    1    .    2]" 1 
        803 1  96 VAL H    1  96 VAL HB   1.800 . 3.000 2.605 2.524 2.660     .  0 0 "[    .    1    .    2]" 1 
        804 1  96 VAL HB   1  97 ALA H    1.800 . 4.000 2.966 2.659 4.002 0.002  4 0 "[    .    1    .    2]" 1 
        805 1  96 VAL H    1  96 VAL MG1  1.800 . 4.000 3.510 2.054 3.773     .  0 0 "[    .    1    .    2]" 1 
        806 1  96 VAL H    1  96 VAL MG2  1.800 . 4.000 2.319 1.934 3.764     .  0 0 "[    .    1    .    2]" 1 
        807 1  96 VAL MG1  1  97 ALA H    1.800 . 5.000 3.480 2.140 3.875     .  0 0 "[    .    1    .    2]" 1 
        808 1  96 VAL MG2  1  97 ALA H    1.800 . 5.000 3.798 3.677 3.871     .  0 0 "[    .    1    .    2]" 1 
        809 1  96 VAL H    1  97 ALA H    1.800 . 4.000 2.630 2.533 2.675     .  0 0 "[    .    1    .    2]" 1 
        810 1  96 VAL H    1  98 GLY H    1.800 . 5.000 3.892 3.765 4.024     .  0 0 "[    .    1    .    2]" 1 
        811 1  97 ALA HA   1  98 GLY H    1.800 . 5.000 3.397 3.396 3.400     .  0 0 "[    .    1    .    2]" 1 
        812 1  97 ALA H    1  97 ALA MB   1.800 . 3.000 2.243 2.126 2.303     .  0 0 "[    .    1    .    2]" 1 
        813 1  97 ALA MB   1  98 GLY H    1.800 . 5.000 3.111 3.096 3.143     .  0 0 "[    .    1    .    2]" 1 
        814 1  97 ALA MB   1  99 SER H    1.800 . 5.000 2.756 2.555 2.973     .  0 0 "[    .    1    .    2]" 1 
        815 1  97 ALA H    1  98 GLY H    1.800 . 3.000 2.398 2.333 2.421     .  0 0 "[    .    1    .    2]" 1 
        816 1  98 GLY QA   1  99 SER H    1.800 . 5.000 2.796 2.749 2.845     .  0 0 "[    .    1    .    2]" 1 
        817 1  98 GLY QA   1 100 ASP H    1.800 . 5.000 3.248 3.110 3.538     .  0 0 "[    .    1    .    2]" 1 
        818 1  98 GLY H    1  99 SER H    1.800 . 3.000 2.723 2.645 2.787     .  0 0 "[    .    1    .    2]" 1 
        819 1  99 SER HA   1 100 ASP H    1.800 . 4.000 2.931 2.765 3.501     .  0 0 "[    .    1    .    2]" 1 
        820 1  99 SER HB3  1 100 ASP H    1.800 . 5.000 4.360 2.833 4.680     .  0 0 "[    .    1    .    2]" 1 
        821 1  99 SER HB2  1 100 ASP H    1.800 . 5.000 4.274 3.819 4.537     .  0 0 "[    .    1    .    2]" 1 
        822 1  99 SER H    1 100 ASP H    1.800 . 4.000 2.784 2.338 2.991     .  0 0 "[    .    1    .    2]" 1 
        823 1 100 ASP HA   1 102 LEU H    1.800 . 5.000 3.635 3.570 3.682     .  0 0 "[    .    1    .    2]" 1 
        824 1 100 ASP HA   1 103 GLY H    1.800 . 6.000 3.839 3.699 4.032     .  0 0 "[    .    1    .    2]" 1 
        825 1 100 ASP H    1 100 ASP HB3  1.800 . 4.000 3.466 3.113 3.788     .  0 0 "[    .    1    .    2]" 1 
        826 1 100 ASP H    1 100 ASP HB2  1.800 . 4.000 2.922 2.325 3.214     .  0 0 "[    .    1    .    2]" 1 
        827 1 100 ASP H    1 100 ASP QB   1.800 . 3.000 2.746 2.294 2.880     .  0 0 "[    .    1    .    2]" 1 
        828 1 100 ASP QB   1 102 LEU H    1.800 . 6.000 4.581 4.133 4.968     .  0 0 "[    .    1    .    2]" 1 
        829 1 100 ASP H    1 101 PRO HD3  1.800 . 5.000 2.769 2.316 3.695     .  0 0 "[    .    1    .    2]" 1 
        830 1 100 ASP H    1 101 PRO HD2  1.800 . 5.000 3.679 3.190 4.638     .  0 0 "[    .    1    .    2]" 1 
        831 1 100 ASP H    1 101 PRO QD   1.800 . 4.000 2.680 2.294 3.455     .  0 0 "[    .    1    .    2]" 1 
        832 1 100 ASP H    1 102 LEU H    1.800 . 6.000 5.378 5.152 5.829     .  0 0 "[    .    1    .    2]" 1 
        833 1 101 PRO HA   1 102 LEU H    1.800 . 4.000 3.557 3.545 3.560     .  0 0 "[    .    1    .    2]" 1 
        834 1 101 PRO HA   1 104 LEU H    1.800 . 4.000 3.486 3.364 3.647     .  0 0 "[    .    1    .    2]" 1 
        835 1 101 PRO HA   1 105 ILE H    1.800 . 6.000 4.277 3.946 4.499     .  0 0 "[    .    1    .    2]" 1 
        836 1 101 PRO HD3  1 102 LEU H    1.800 . 5.000 3.996 3.962 4.082     .  0 0 "[    .    1    .    2]" 1 
        837 1 101 PRO HD2  1 102 LEU H    1.800 . 5.000 2.860 2.609 2.932     .  0 0 "[    .    1    .    2]" 1 
        838 1 101 PRO QD   1 102 LEU H    1.800 . 4.000 2.799 2.575 2.861     .  0 0 "[    .    1    .    2]" 1 
        839 1 102 LEU HA   1 103 GLY H    1.800 . 4.000 3.530 3.514 3.549     .  0 0 "[    .    1    .    2]" 1 
        840 1 102 LEU HA   1 105 ILE H    1.800 . 4.000 3.735 3.595 3.871     .  0 0 "[    .    1    .    2]" 1 
        841 1 102 LEU H    1 102 LEU HB3  1.800 . 4.000 3.288 2.781 3.586     .  0 0 "[    .    1    .    2]" 1 
        842 1 102 LEU H    1 102 LEU HB2  1.800 . 4.000 2.224 2.057 2.790     .  0 0 "[    .    1    .    2]" 1 
        843 1 102 LEU HB3  1 103 GLY H    1.800 . 5.000 3.130 2.523 3.946     .  0 0 "[    .    1    .    2]" 1 
        844 1 102 LEU HB2  1 103 GLY H    1.800 . 5.000 3.099 2.608 3.732     .  0 0 "[    .    1    .    2]" 1 
        845 1 102 LEU H    1 102 LEU MD1  1.800 . 5.000 3.276 1.957 4.242     .  0 0 "[    .    1    .    2]" 1 
        846 1 102 LEU H    1 102 LEU MD2  1.800 . 5.000 3.937 2.281 4.426     .  0 0 "[    .    1    .    2]" 1 
        847 1 102 LEU QD   1 103 GLY H    1.800 . 6.000 3.938 3.332 4.173     .  0 0 "[    .    1    .    2]" 1 
        848 1 102 LEU H    1 102 LEU HG   1.800 . 5.000 3.660 2.141 4.565     .  0 0 "[    .    1    .    2]" 1 
        849 1 102 LEU HG   1 103 GLY H    1.800 . 6.000 4.802 4.307 5.136     .  0 0 "[    .    1    .    2]" 1 
        850 1 102 LEU H    1 103 GLY H    1.800 . 3.000 2.705 2.619 2.762     .  0 0 "[    .    1    .    2]" 1 
        851 1 102 LEU H    1 104 LEU H    1.800 . 5.000 4.206 4.061 4.315     .  0 0 "[    .    1    .    2]" 1 
        852 1 103 GLY QA   1 106 ALA H    1.800 . 4.000 3.383 3.331 3.466     .  0 0 "[    .    1    .    2]" 1 
        853 1 103 GLY HA3  1 104 LEU H    1.800 . 4.000 2.839 2.774 2.916     .  0 0 "[    .    1    .    2]" 1 
        854 1 103 GLY HA2  1 104 LEU H    1.800 . 4.000 3.533 3.506 3.550     .  0 0 "[    .    1    .    2]" 1 
        855 1 103 GLY H    1 104 LEU H    1.800 . 3.000 2.610 2.534 2.692     .  0 0 "[    .    1    .    2]" 1 
        856 1 103 GLY H    1 104 LEU QB   1.800 . 6.000 4.332 4.194 4.662     .  0 0 "[    .    1    .    2]" 1 
        857 1 103 GLY H    1 104 LEU QD   1.800 . 6.000 4.779 3.839 5.493     .  0 0 "[    .    1    .    2]" 1 
        858 1 103 GLY H    1 105 ILE H    1.800 . 5.000 4.232 4.128 4.347     .  0 0 "[    .    1    .    2]" 1 
        859 1 104 LEU HA   1 105 ILE H    1.800 . 4.000 3.542 3.537 3.547     .  0 0 "[    .    1    .    2]" 1 
        860 1 104 LEU HA   1 106 ALA H    1.800 . 5.000 4.549 4.444 4.704     .  0 0 "[    .    1    .    2]" 1 
        861 1 104 LEU HA   1 107 TYR H    1.800 . 4.000 3.668 3.506 3.812     .  0 0 "[    .    1    .    2]" 1 
        862 1 104 LEU H    1 104 LEU HB3  1.800 . 4.000 3.209 2.567 3.588     .  0 0 "[    .    1    .    2]" 1 
        863 1 104 LEU H    1 104 LEU HB2  1.800 . 4.000 2.181 2.049 2.563     .  0 0 "[    .    1    .    2]" 1 
        864 1 104 LEU HB3  1 105 ILE H    1.800 . 4.000 2.937 2.538 3.653     .  0 0 "[    .    1    .    2]" 1 
        865 1 104 LEU HB2  1 105 ILE H    1.800 . 4.000 3.143 2.547 3.842     .  0 0 "[    .    1    .    2]" 1 
        866 1 104 LEU H    1 104 LEU MD1  1.800 . 5.000 3.461 2.141 4.237     .  0 0 "[    .    1    .    2]" 1 
        867 1 104 LEU H    1 104 LEU MD2  1.800 . 5.000 3.944 2.100 4.445     .  0 0 "[    .    1    .    2]" 1 
        868 1 104 LEU H    1 104 LEU HG   1.800 . 5.000 3.855 2.092 4.558     .  0 0 "[    .    1    .    2]" 1 
        869 1 104 LEU H    1 105 ILE H    1.800 . 3.000 2.714 2.668 2.735     .  0 0 "[    .    1    .    2]" 1 
        870 1 104 LEU H    1 106 ALA H    1.800 . 5.000 4.182 4.109 4.271     .  0 0 "[    .    1    .    2]" 1 
        871 1 105 ILE HA   1 106 ALA H    1.800 . 4.000 3.542 3.535 3.555     .  0 0 "[    .    1    .    2]" 1 
        872 1 105 ILE HA   1 108 LEU H    1.800 . 4.000 3.500 3.370 3.669     .  0 0 "[    .    1    .    2]" 1 
        873 1 105 ILE HA   1 109 SER H    1.800 . 5.000 4.216 3.881 4.470     .  0 0 "[    .    1    .    2]" 1 
        874 1 105 ILE H    1 105 ILE HB   1.800 . 4.000 2.661 2.579 3.620     .  0 0 "[    .    1    .    2]" 1 
        875 1 105 ILE HB   1 106 ALA H    1.800 . 4.000 2.616 2.461 3.614     .  0 0 "[    .    1    .    2]" 1 
        876 1 105 ILE H    1 105 ILE MD   1.800 . 5.000 3.202 2.899 3.581     .  0 0 "[    .    1    .    2]" 1 
        877 1 105 ILE H    1 105 ILE HG13 1.800 . 4.000 2.754 1.922 3.545     .  0 0 "[    .    1    .    2]" 1 
        878 1 105 ILE H    1 105 ILE HG12 1.800 . 4.000 2.697 1.982 3.507     .  0 0 "[    .    1    .    2]" 1 
        879 1 105 ILE H    1 105 ILE MG   1.800 . 5.000 3.700 2.370 3.773     .  0 0 "[    .    1    .    2]" 1 
        880 1 105 ILE QG   1 106 ALA H    1.800 . 5.000 3.790 1.946 3.954     .  0 0 "[    .    1    .    2]" 1 
        881 1 105 ILE MG   1 106 ALA H    1.800 . 5.000 3.583 3.468 3.976     .  0 0 "[    .    1    .    2]" 1 
        882 1 105 ILE MG   1 109 SER H    1.800 . 6.000 4.163 3.808 5.835     .  0 0 "[    .    1    .    2]" 1 
        883 1 105 ILE H    1 106 ALA H    1.800 . 3.000 2.635 2.608 2.702     .  0 0 "[    .    1    .    2]" 1 
        884 1 105 ILE H    1 107 TYR H    1.800 . 5.000 4.163 4.001 4.324     .  0 0 "[    .    1    .    2]" 1 
        885 1 106 ALA HA   1 107 TYR H    1.800 . 4.000 3.538 3.505 3.555     .  0 0 "[    .    1    .    2]" 1 
        886 1 106 ALA HA   1 109 SER H    1.800 . 4.000 3.639 3.500 3.759     .  0 0 "[    .    1    .    2]" 1 
        887 1 106 ALA H    1 106 ALA MB   1.800 . 4.000 2.159 2.070 2.230     .  0 0 "[    .    1    .    2]" 1 
        888 1 106 ALA MB   1 107 TYR H    1.800 . 4.000 2.572 2.424 2.708     .  0 0 "[    .    1    .    2]" 1 
        889 1 106 ALA H    1 107 TYR H    1.800 . 3.000 2.715 2.614 2.826     .  0 0 "[    .    1    .    2]" 1 
        890 1 106 ALA H    1 108 LEU H    1.800 . 5.000 4.216 4.077 4.367     .  0 0 "[    .    1    .    2]" 1 
        891 1 107 TYR HA   1 108 LEU H    1.800 . 4.000 3.543 3.525 3.555     .  0 0 "[    .    1    .    2]" 1 
        892 1 107 TYR HA   1 109 SER H    1.800 . 5.000 4.192 4.084 4.423     .  0 0 "[    .    1    .    2]" 1 
        893 1 107 TYR HA   1 110 HIS H    1.800 . 4.000 3.474 3.379 3.591     .  0 0 "[    .    1    .    2]" 1 
        894 1 107 TYR H    1 107 TYR HB3  1.800 . 4.000 2.782 2.552 3.075     .  0 0 "[    .    1    .    2]" 1 
        895 1 107 TYR H    1 107 TYR HB2  1.800 . 4.000 2.326 2.131 2.523     .  0 0 "[    .    1    .    2]" 1 
        896 1 107 TYR HB3  1 108 LEU H    1.800 . 5.000 2.560 2.441 2.704     .  0 0 "[    .    1    .    2]" 1 
        897 1 107 TYR HB2  1 108 LEU H    1.800 . 5.000 3.628 3.300 3.880     .  0 0 "[    .    1    .    2]" 1 
        898 1 107 TYR QB   1 108 LEU H    1.800 . 4.000 2.509 2.405 2.627     .  0 0 "[    .    1    .    2]" 1 
        899 1 107 TYR QD   1 108 LEU H    1.800 . 6.000 4.061 3.210 4.468     .  0 0 "[    .    1    .    2]" 1 
        900 1 107 TYR QD   1 111 PHE H    1.800 . 6.000 4.833 3.881 5.375     .  0 0 "[    .    1    .    2]" 1 
        901 1 107 TYR H    1 107 TYR QD   1.800 . 6.000 4.047 3.711 4.202     .  0 0 "[    .    1    .    2]" 1 
        902 1 107 TYR H    1 108 LEU H    1.800 . 3.000 2.631 2.569 2.713     .  0 0 "[    .    1    .    2]" 1 
        903 1 107 TYR H    1 108 LEU QD   1.800 . 6.000 4.839 3.929 5.578     .  0 0 "[    .    1    .    2]" 1 
        904 1 107 TYR H    1 109 SER H    1.800 . 5.000 4.029 3.919 4.165     .  0 0 "[    .    1    .    2]" 1 
        905 1 108 LEU HA   1 109 SER H    1.800 . 4.000 3.510 3.498 3.538     .  0 0 "[    .    1    .    2]" 1 
        906 1 108 LEU HA   1 111 PHE H    1.800 . 4.000 3.408 3.232 3.597     .  0 0 "[    .    1    .    2]" 1 
        907 1 108 LEU HA   1 112 HIS H    1.800 . 5.000 3.933 3.614 4.420     .  0 0 "[    .    1    .    2]" 1 
        908 1 108 LEU H    1 108 LEU HB3  1.800 . 4.000 3.287 2.911 3.587     .  0 0 "[    .    1    .    2]" 1 
        909 1 108 LEU H    1 108 LEU HB2  1.800 . 4.000 2.142 2.051 2.617     .  0 0 "[    .    1    .    2]" 1 
        910 1 108 LEU HB3  1 109 SER H    1.800 . 4.000 3.153 2.611 3.887     .  0 0 "[    .    1    .    2]" 1 
        911 1 108 LEU HB2  1 109 SER H    1.800 . 4.000 3.199 2.794 3.658     .  0 0 "[    .    1    .    2]" 1 
        912 1 108 LEU H    1 108 LEU MD1  1.800 . 5.000 3.651 2.491 4.196     .  0 0 "[    .    1    .    2]" 1 
        913 1 108 LEU H    1 108 LEU MD2  1.800 . 5.000 3.731 2.122 4.440     .  0 0 "[    .    1    .    2]" 1 
        914 1 108 LEU QD   1 109 SER H    1.800 . 6.000 4.003 3.585 4.224     .  0 0 "[    .    1    .    2]" 1 
        915 1 108 LEU H    1 108 LEU HG   1.800 . 5.000 3.750 2.030 4.522     .  0 0 "[    .    1    .    2]" 1 
        916 1 108 LEU HG   1 109 SER H    1.800 . 6.000 4.999 4.216 5.301     .  0 0 "[    .    1    .    2]" 1 
        917 1 108 LEU H    1 109 SER H    1.800 . 3.000 2.685 2.638 2.744     .  0 0 "[    .    1    .    2]" 1 
        918 1 108 LEU H    1 110 HIS H    1.800 . 5.000 4.278 4.152 4.428     .  0 0 "[    .    1    .    2]" 1 
        919 1 109 SER HA   1 110 HIS H    1.800 . 4.000 3.528 3.516 3.550     .  0 0 "[    .    1    .    2]" 1 
        920 1 109 SER HA   1 112 HIS H    1.800 . 4.000 3.614 3.429 3.805     .  0 0 "[    .    1    .    2]" 1 
        921 1 109 SER HA   1 113 SER H    1.800 . 5.000 4.056 3.555 4.615     .  0 0 "[    .    1    .    2]" 1 
        922 1 109 SER H    1 109 SER HB3  1.800 . 4.000 3.120 2.304 3.593     .  0 0 "[    .    1    .    2]" 1 
        923 1 109 SER H    1 109 SER HB2  1.800 . 4.000 2.406 2.138 3.555     .  0 0 "[    .    1    .    2]" 1 
        924 1 109 SER QB   1 110 HIS H    1.800 . 4.000 2.673 2.456 3.435     .  0 0 "[    .    1    .    2]" 1 
        925 1 109 SER H    1 110 HIS H    1.800 . 3.000 2.670 2.589 2.749     .  0 0 "[    .    1    .    2]" 1 
        926 1 110 HIS HA   1 111 PHE H    1.800 . 4.000 3.543 3.526 3.556     .  0 0 "[    .    1    .    2]" 1 
        927 1 110 HIS HA   1 113 SER H    1.800 . 4.000 3.646 3.473 3.838     .  0 0 "[    .    1    .    2]" 1 
        928 1 110 HIS HA   1 114 ALA H    1.800 . 5.000 4.250 3.524 4.747     .  0 0 "[    .    1    .    2]" 1 
        929 1 110 HIS H    1 110 HIS HB3  1.800 . 4.000 3.097 2.767 3.443     .  0 0 "[    .    1    .    2]" 1 
        930 1 110 HIS H    1 110 HIS HB2  1.800 . 4.000 2.170 2.070 2.350     .  0 0 "[    .    1    .    2]" 1 
        931 1 110 HIS HB3  1 111 PHE H    1.800 . 4.000 2.769 2.445 3.211     .  0 0 "[    .    1    .    2]" 1 
        932 1 110 HIS HB2  1 111 PHE H    1.800 . 4.000 3.295 2.880 3.688     .  0 0 "[    .    1    .    2]" 1 
        933 1 110 HIS HD1  1 114 ALA H    1.800 . 6.000 4.825 3.327 6.001 0.001 15 0 "[    .    1    .    2]" 1 
        934 1 110 HIS H    1 111 PHE H    1.800 . 3.000 2.616 2.499 2.734     .  0 0 "[    .    1    .    2]" 1 
        935 1 110 HIS H    1 111 PHE QB   1.800 . 6.000 4.346 4.181 4.553     .  0 0 "[    .    1    .    2]" 1 
        936 1 110 HIS H    1 112 HIS H    1.800 . 5.000 4.031 3.848 4.202     .  0 0 "[    .    1    .    2]" 1 
        937 1 111 PHE HA   1 112 HIS H    1.800 . 4.000 3.526 3.497 3.550     .  0 0 "[    .    1    .    2]" 1 
        938 1 111 PHE HA   1 114 ALA H    1.800 . 4.000 3.581 3.374 3.839     .  0 0 "[    .    1    .    2]" 1 
        939 1 111 PHE H    1 111 PHE HB3  1.800 . 4.000 3.409 3.247 3.548     .  0 0 "[    .    1    .    2]" 1 
        940 1 111 PHE H    1 111 PHE HB2  1.800 . 4.000 2.140 2.068 2.286     .  0 0 "[    .    1    .    2]" 1 
        941 1 111 PHE HB3  1 112 HIS H    1.800 . 4.000 3.202 2.907 3.542     .  0 0 "[    .    1    .    2]" 1 
        942 1 111 PHE HB2  1 112 HIS H    1.800 . 4.000 2.988 2.632 3.189     .  0 0 "[    .    1    .    2]" 1 
        943 1 111 PHE QD   1 112 HIS H    1.800 . 6.000 4.565 4.266 4.700     .  0 0 "[    .    1    .    2]" 1 
        944 1 111 PHE H    1 111 PHE QD   1.800 . 4.000 3.008 2.022 3.634     .  0 0 "[    .    1    .    2]" 1 
        945 1 111 PHE H    1 112 HIS H    1.800 . 3.000 2.626 2.570 2.694     .  0 0 "[    .    1    .    2]" 1 
        946 1 111 PHE H    1 112 HIS QB   1.800 . 6.000 4.375 4.313 4.440     .  0 0 "[    .    1    .    2]" 1 
        947 1 112 HIS HA   1 113 SER H    1.800 . 4.000 3.549 3.536 3.563     .  0 0 "[    .    1    .    2]" 1 
        948 1 112 HIS HA   1 115 PHE H    1.800 . 4.000 3.499 3.291 3.745     .  0 0 "[    .    1    .    2]" 1 
        949 1 112 HIS HA   1 116 LYS H    1.800 . 5.000 3.956 3.391 4.577     .  0 0 "[    .    1    .    2]" 1 
        950 1 112 HIS H    1 112 HIS HB3  1.800 . 4.000 2.674 2.438 2.930     .  0 0 "[    .    1    .    2]" 1 
        951 1 112 HIS H    1 112 HIS HB2  1.800 . 4.000 2.406 2.193 2.628     .  0 0 "[    .    1    .    2]" 1 
        952 1 112 HIS HB3  1 113 SER H    1.800 . 4.000 2.502 2.354 2.646     .  0 0 "[    .    1    .    2]" 1 
        953 1 112 HIS HB2  1 113 SER H    1.800 . 4.000 3.708 3.441 3.845     .  0 0 "[    .    1    .    2]" 1 
        954 1 112 HIS H    1 113 SER H    1.800 . 3.000 2.695 2.607 2.782     .  0 0 "[    .    1    .    2]" 1 
        955 1 112 HIS H    1 114 ALA H    1.800 . 5.000 4.110 3.892 4.292     .  0 0 "[    .    1    .    2]" 1 
        956 1 113 SER HA   1 114 ALA H    1.800 . 4.000 3.530 3.485 3.546     .  0 0 "[    .    1    .    2]" 1 
        957 1 113 SER HA   1 116 LYS H    1.800 . 4.000 3.644 3.397 3.938     .  0 0 "[    .    1    .    2]" 1 
        958 1 113 SER H    1 113 SER HB3  1.800 . 4.000 3.097 2.378 3.590     .  0 0 "[    .    1    .    2]" 1 
        959 1 113 SER H    1 113 SER HB2  1.800 . 4.000 2.531 2.148 3.590     .  0 0 "[    .    1    .    2]" 1 
        960 1 113 SER HB3  1 114 ALA H    1.800 . 4.000 3.268 2.538 3.999     .  0 0 "[    .    1    .    2]" 1 
        961 1 113 SER HB2  1 114 ALA H    1.800 . 4.000 3.285 2.695 3.877     .  0 0 "[    .    1    .    2]" 1 
        962 1 113 SER H    1 114 ALA H    1.800 . 3.000 2.695 2.598 2.762     .  0 0 "[    .    1    .    2]" 1 
        963 1 113 SER H    1 115 PHE H    1.800 . 5.000 4.163 3.970 4.290     .  0 0 "[    .    1    .    2]" 1 
        964 1 114 ALA HA   1 115 PHE H    1.800 . 4.000 3.536 3.493 3.551     .  0 0 "[    .    1    .    2]" 1 
        965 1 114 ALA HA   1 117 SER H    1.800 . 4.000 3.648 3.345 4.014 0.014 18 0 "[    .    1    .    2]" 1 
        966 1 114 ALA H    1 114 ALA MB   1.800 . 4.000 2.179 2.096 2.260     .  0 0 "[    .    1    .    2]" 1 
        967 1 114 ALA MB   1 115 PHE H    1.800 . 4.000 2.604 2.469 2.792     .  0 0 "[    .    1    .    2]" 1 
        968 1 114 ALA H    1 115 PHE H    1.800 . 3.000 2.550 2.415 2.685     .  0 0 "[    .    1    .    2]" 1 
        969 1 114 ALA H    1 115 PHE QD   1.800 . 6.000 4.159 3.870 4.798     .  0 0 "[    .    1    .    2]" 1 
        970 1 114 ALA H    1 116 LYS H    1.800 . 5.000 3.910 3.786 4.164     .  0 0 "[    .    1    .    2]" 1 
        971 1 115 PHE HA   1 116 LYS H    1.800 . 4.000 3.486 3.255 3.539     .  0 0 "[    .    1    .    2]" 1 
        972 1 115 PHE HA   1 117 SER H    1.800 . 5.000 4.273 3.951 4.959     .  0 0 "[    .    1    .    2]" 1 
        973 1 115 PHE HA   1 118 MET H    1.800 . 5.000 3.792 3.288 4.374     .  0 0 "[    .    1    .    2]" 1 
        974 1 115 PHE H    1 115 PHE HB3  1.800 . 4.000 3.542 3.520 3.644     .  0 0 "[    .    1    .    2]" 1 
        975 1 115 PHE H    1 115 PHE HB2  1.800 . 4.000 2.293 2.228 2.741     .  0 0 "[    .    1    .    2]" 1 
        976 1 115 PHE QB   1 116 LYS H    1.800 . 4.000 2.834 2.610 3.450     .  0 0 "[    .    1    .    2]" 1 
        977 1 115 PHE H    1 115 PHE QD   1.800 . 4.000 2.330 2.032 3.109     .  0 0 "[    .    1    .    2]" 1 
        978 1 115 PHE QD   1 116 LYS H    1.800 . 6.000 4.388 4.244 4.904     .  0 0 "[    .    1    .    2]" 1 
        979 1 115 PHE H    1 116 LYS H    1.800 . 3.000 2.560 2.300 2.646     .  0 0 "[    .    1    .    2]" 1 
        980 1 115 PHE H    1 116 LYS QB   1.800 . 6.000 4.290 4.064 4.385     .  0 0 "[    .    1    .    2]" 1 
        981 1 115 PHE H    1 117 SER H    1.800 . 5.000 4.221 3.866 4.642     .  0 0 "[    .    1    .    2]" 1 
        982 1 116 LYS HA   1 117 SER H    1.800 . 4.000 3.518 3.481 3.568     .  0 0 "[    .    1    .    2]" 1 
        983 1 116 LYS H    1 116 LYS HB3  1.800 . 4.000 2.921 2.523 3.486     .  0 0 "[    .    1    .    2]" 1 
        984 1 116 LYS H    1 116 LYS HB2  1.800 . 4.000 2.288 2.078 2.528     .  0 0 "[    .    1    .    2]" 1 
        985 1 116 LYS HB3  1 117 SER H    1.800 . 4.000 2.837 2.213 3.470     .  0 0 "[    .    1    .    2]" 1 
        986 1 116 LYS HB2  1 117 SER H    1.800 . 4.000 3.551 2.634 3.957     .  0 0 "[    .    1    .    2]" 1 
        987 1 116 LYS H    1 116 LYS HG3  1.800 . 5.000 4.193 3.003 4.541     .  0 0 "[    .    1    .    2]" 1 
        988 1 116 LYS H    1 116 LYS HG2  1.800 . 5.000 4.283 3.154 4.658     .  0 0 "[    .    1    .    2]" 1 
        989 1 116 LYS QG   1 117 SER H    1.800 . 6.000 4.192 3.491 4.599     .  0 0 "[    .    1    .    2]" 1 
        990 1 116 LYS QD   1 117 SER H    1.800 . 6.000 4.633 3.420 5.398     .  0 0 "[    .    1    .    2]" 1 
        991 1 116 LYS H    1 117 SER H    1.800 . 3.000 2.605 2.284 2.852     .  0 0 "[    .    1    .    2]" 1 
        992 1 116 LYS H    1 118 MET H    1.800 . 5.000 4.279 3.835 4.843     .  0 0 "[    .    1    .    2]" 1 
        993 1 117 SER HA   1 118 MET H    1.800 . 4.000 3.338 2.822 3.570     .  0 0 "[    .    1    .    2]" 1 
        994 1 117 SER H    1 117 SER HB3  1.800 . 4.000 3.262 2.487 3.708     .  0 0 "[    .    1    .    2]" 1 
        995 1 117 SER H    1 117 SER HB2  1.800 . 4.000 2.449 2.095 3.690     .  0 0 "[    .    1    .    2]" 1 
        996 1 117 SER H    1 118 MET H    1.800 . 3.000 2.703 2.261 3.002 0.002 20 0 "[    .    1    .    2]" 1 
        997 1 118 MET H    1 118 MET HB3  1.800 . 4.000 3.203 2.570 3.780     .  0 0 "[    .    1    .    2]" 1 
        998 1 118 MET H    1 118 MET HB2  1.800 . 4.000 2.561 2.096 3.306     .  0 0 "[    .    1    .    2]" 1 
        999 1 118 MET H    1 118 MET QG   1.800 . 6.000 3.854 2.782 4.292     .  0 0 "[    .    1    .    2]" 1 
       1000 1  11 SER HA   1  14 THR MG   1.800 . 6.000 3.863 2.359 5.041     .  0 0 "[    .    1    .    2]" 1 
       1001 1  12 ALA HA   1  15 GLN HB3  1.800 . 5.000 4.120 3.090 4.996     .  0 0 "[    .    1    .    2]" 1 
       1002 1  12 ALA HA   1  15 GLN HB2  1.800 . 5.000 3.187 2.273 4.274     .  0 0 "[    .    1    .    2]" 1 
       1003 1  12 ALA HA   1  15 GLN QB   1.800 . 4.000 3.016 2.252 3.988     .  0 0 "[    .    1    .    2]" 1 
       1004 1  13 GLY QA   1  14 THR HA   1.800 . 6.000 4.025 3.996 4.082     .  0 0 "[    .    1    .    2]" 1 
       1005 1  13 GLY QA   1  16 GLU QB   1.800 . 4.000 2.962 2.100 3.684     .  0 0 "[    .    1    .    2]" 1 
       1006 1  14 THR HA   1  17 GLU QB   1.800 . 4.000 3.821 2.869 4.005 0.005  6 0 "[    .    1    .    2]" 1 
       1007 1  14 THR HA   1  14 THR MG   1.800 . 4.000 2.336 2.109 3.222     .  0 0 "[    .    1    .    2]" 1 
       1008 1  14 THR HA   1  18 LEU QD   1.800 . 6.000 4.583 3.660 5.802     .  0 0 "[    .    1    .    2]" 1 
       1009 1  14 THR MG   1  17 GLU QG   1.800 . 6.000 3.666 2.304 4.915     .  0 0 "[    .    1    .    2]" 1 
       1010 1  15 GLN HA   1  18 LEU QB   1.800 . 4.000 2.592 2.226 2.967     .  0 0 "[    .    1    .    2]" 1 
       1011 1  15 GLN QB   1 105 ILE MG   1.800 . 6.000 5.524 4.633 5.994     .  0 0 "[    .    1    .    2]" 1 
       1012 1  16 GLU HA   1  16 GLU QG   1.800 . 5.000 2.308 2.051 2.745     .  0 0 "[    .    1    .    2]" 1 
       1013 1  16 GLU HA   1  19 LEU QB   1.800 . 4.000 2.996 2.304 3.288     .  0 0 "[    .    1    .    2]" 1 
       1014 1  16 GLU QG   1  19 LEU QD   1.800 . 6.000 4.416 3.801 5.410     .  0 0 "[    .    1    .    2]" 1 
       1015 1  17 GLU HA   1  20 ARG QB   1.800 . 4.000 2.821 2.403 3.946     .  0 0 "[    .    1    .    2]" 1 
       1016 1  17 GLU QG   1  18 LEU HG   1.800 . 6.000 4.092 2.122 5.735     .  0 0 "[    .    1    .    2]" 1 
       1017 1  17 GLU QG   1  19 LEU QB   1.800 . 6.000 5.819 5.666 6.011 0.011  9 0 "[    .    1    .    2]" 1 
       1018 1  17 GLU QB   1  20 ARG QG   1.800 . 5.000 4.386 3.480 4.906     .  0 0 "[    .    1    .    2]" 1 
       1019 1  17 GLU HA   1  20 ARG QD   1.800 . 6.000 4.261 2.300 5.369     .  0 0 "[    .    1    .    2]" 1 
       1020 1  18 LEU HA   1  18 LEU MD1  1.800 . 6.000 3.061 1.959 3.914     .  0 0 "[    .    1    .    2]" 1 
       1021 1  18 LEU HA   1  18 LEU MD2  1.800 . 5.000 2.720 1.970 3.897     .  0 0 "[    .    1    .    2]" 1 
       1022 1  18 LEU HB3  1  18 LEU QD   1.800 . 5.000 2.149 2.034 2.367     .  0 0 "[    .    1    .    2]" 1 
       1023 1  18 LEU HB2  1  18 LEU QD   1.800 . 5.000 2.158 2.030 2.303     .  0 0 "[    .    1    .    2]" 1 
       1024 1  18 LEU QB   1  18 LEU QD   1.800 . 4.000 1.913 1.818 2.060     .  0 0 "[    .    1    .    2]" 1 
       1025 1  18 LEU HA   1  21 TRP QB   1.800 . 4.000 2.990 2.634 3.276     .  0 0 "[    .    1    .    2]" 1 
       1026 1  18 LEU HG   1 105 ILE MD   1.800 . 6.000 5.280 4.280 6.003 0.003 17 0 "[    .    1    .    2]" 1 
       1027 1  18 LEU MD2  1 108 LEU MD1  1.800 . 6.000 3.889 2.595 5.542     .  0 0 "[    .    1    .    2]" 1 
       1028 1  18 LEU MD2  1 108 LEU MD2  1.800 . 6.000 3.750 2.028 5.441     .  0 0 "[    .    1    .    2]" 1 
       1029 1  18 LEU MD1  1 108 LEU MD1  1.800 . 6.000 3.798 2.206 5.670     .  0 0 "[    .    1    .    2]" 1 
       1030 1  18 LEU MD1  1 108 LEU MD2  1.800 . 6.000 4.000 1.955 5.343     .  0 0 "[    .    1    .    2]" 1 
       1031 1  18 LEU QD   1 108 LEU QD   1.800 . 5.000 2.663 1.876 3.563     .  0 0 "[    .    1    .    2]" 1 
       1032 1  18 LEU QD   1 109 SER HA   1.800 . 5.000 3.877 3.177 4.685     .  0 0 "[    .    1    .    2]" 1 
       1033 1  18 LEU QD   1 112 HIS HB3  1.800 . 6.000 4.609 3.747 5.527     .  0 0 "[    .    1    .    2]" 1 
       1034 1  18 LEU QD   1 112 HIS HB2  1.800 . 6.000 4.106 3.153 5.189     .  0 0 "[    .    1    .    2]" 1 
       1035 1  18 LEU QD   1 112 HIS HE1  1.800 . 6.000 4.748 2.966 5.989     .  0 0 "[    .    1    .    2]" 1 
       1036 1  19 LEU HA   1  22 CYS QB   1.800 . 4.000 2.768 2.510 3.093     .  0 0 "[    .    1    .    2]" 1 
       1037 1  19 LEU HB3  1  19 LEU QD   1.800 . 5.000 2.095 1.928 2.292     .  0 0 "[    .    1    .    2]" 1 
       1038 1  19 LEU HB2  1  19 LEU QD   1.800 . 5.000 2.132 1.944 2.294     .  0 0 "[    .    1    .    2]" 1 
       1039 1  19 LEU QD   1  20 ARG HA   1.800 . 6.000 4.365 2.976 5.101     .  0 0 "[    .    1    .    2]" 1 
       1040 1  19 LEU QD   1  23 GLN QB   1.800 . 5.000 3.680 2.655 4.560     .  0 0 "[    .    1    .    2]" 1 
       1041 1  19 LEU QD   1  34 VAL QG   1.800 . 5.000 3.026 2.172 3.799     .  0 0 "[    .    1    .    2]" 1 
       1042 1  19 LEU MD1  1  36 ASP HA   1.800 . 5.000 3.960 2.830 4.998     .  0 0 "[    .    1    .    2]" 1 
       1043 1  19 LEU MD2  1  36 ASP HA   1.800 . 5.000 3.824 2.431 4.706     .  0 0 "[    .    1    .    2]" 1 
       1044 1  19 LEU QD   1  36 ASP HA   1.800 . 5.000 3.289 2.396 4.167     .  0 0 "[    .    1    .    2]" 1 
       1045 1  19 LEU QD   1  35 SER HA   1.800 . 5.000 2.302 1.841 3.050     .  0 0 "[    .    1    .    2]" 1 
       1046 1  19 LEU HA   1  37 LEU QD   1.800 . 5.000 4.198 3.251 4.803     .  0 0 "[    .    1    .    2]" 1 
       1047 1  20 ARG QG   1  21 TRP HA   1.800 . 6.000 5.395 3.136 5.820     .  0 0 "[    .    1    .    2]" 1 
       1048 1  20 ARG HA   1  23 GLN QB   1.800 . 4.000 3.181 2.693 3.954     .  0 0 "[    .    1    .    2]" 1 
       1049 1  20 ARG HA   1  23 GLN QG   1.800 . 6.000 3.981 1.940 5.072     .  0 0 "[    .    1    .    2]" 1 
       1050 1  21 TRP HA   1  21 TRP HD1  1.800 . 4.000 3.110 2.834 3.348     .  0 0 "[    .    1    .    2]" 1 
       1051 1  21 TRP HA   1  22 CYS HA   1.800 . 6.000 4.778 4.753 4.808     .  0 0 "[    .    1    .    2]" 1 
       1052 1  21 TRP HA   1  24 GLU HB3  1.800 . 4.000 3.283 2.812 4.001 0.001  4 0 "[    .    1    .    2]" 1 
       1053 1  21 TRP HA   1  24 GLU HB2  1.800 . 4.000 3.136 2.486 3.816     .  0 0 "[    .    1    .    2]" 1 
       1054 1  21 TRP HE3  1  22 CYS HA   1.800 . 4.000 2.835 2.303 3.446     .  0 0 "[    .    1    .    2]" 1 
       1055 1  21 TRP HZ3  1  22 CYS HA   1.800 . 5.000 3.854 3.173 4.542     .  0 0 "[    .    1    .    2]" 1 
       1056 1  21 TRP HZ3  1  50 LEU MD1  1.800 . 6.000 3.533 2.422 4.472     .  0 0 "[    .    1    .    2]" 1 
       1057 1  21 TRP HZ3  1  50 LEU MD2  1.800 . 6.000 2.766 2.064 3.465     .  0 0 "[    .    1    .    2]" 1 
       1058 1  21 TRP HZ3  1 108 LEU HA   1.800 . 6.000 4.977 3.983 5.589     .  0 0 "[    .    1    .    2]" 1 
       1059 1  21 TRP HZ2  1 112 HIS HA   1.800 . 5.000 3.354 2.470 3.921     .  0 0 "[    .    1    .    2]" 1 
       1060 1  22 CYS HA   1  25 GLN QB   1.800 . 4.000 2.908 2.662 3.056     .  0 0 "[    .    1    .    2]" 1 
       1061 1  22 CYS HA   1  25 GLN QG   1.800 . 6.000 3.983 3.218 4.717     .  0 0 "[    .    1    .    2]" 1 
       1062 1  22 CYS QB   1  34 VAL QG   1.800 . 6.000 2.501 1.941 3.251     .  0 0 "[    .    1    .    2]" 1 
       1063 1  22 CYS HA   1  34 VAL QG   1.800 . 6.000 4.263 3.867 5.267     .  0 0 "[    .    1    .    2]" 1 
       1064 1  22 CYS HB3  1  41 TRP HZ2  1.800 . 5.000 4.119 3.674 4.504     .  0 0 "[    .    1    .    2]" 1 
       1065 1  22 CYS HB2  1  41 TRP HZ2  1.800 . 5.000 4.194 3.859 4.550     .  0 0 "[    .    1    .    2]" 1 
       1066 1  22 CYS QB   1  41 TRP HH2  1.800 . 5.000 4.179 2.886 4.589     .  0 0 "[    .    1    .    2]" 1 
       1067 1  23 GLN HA   1  26 THR HB   1.800 . 4.000 3.111 2.587 4.033 0.033  9 0 "[    .    1    .    2]" 1 
       1068 1  23 GLN HA   1  34 VAL HB   1.800 . 5.000 2.130 1.959 2.800     .  0 0 "[    .    1    .    2]" 1 
       1069 1  23 GLN HA   1  34 VAL MG1  1.800 . 6.000 2.911 1.967 3.725     .  0 0 "[    .    1    .    2]" 1 
       1070 1  23 GLN HA   1  34 VAL MG2  1.800 . 6.000 2.956 2.500 3.603     .  0 0 "[    .    1    .    2]" 1 
       1071 1  23 GLN QB   1  34 VAL HA   1.800 . 5.000 4.967 4.643 5.025 0.025  3 0 "[    .    1    .    2]" 1 
       1072 1  23 GLN QB   1  34 VAL QG   1.800 . 6.000 2.986 2.512 3.477     .  0 0 "[    .    1    .    2]" 1 
       1073 1  23 GLN QG   1  34 VAL QG   1.800 . 6.000 3.551 2.895 4.588     .  0 0 "[    .    1    .    2]" 1 
       1074 1  24 GLU HA   1  27 ALA MB   1.800 . 4.000 2.556 2.312 2.762     .  0 0 "[    .    1    .    2]" 1 
       1075 1  25 GLN HA   1  53 ARG QG   1.800 . 6.000 4.401 3.350 5.122     .  0 0 "[    .    1    .    2]" 1 
       1076 1  25 GLN HA   1  53 ARG QD   1.800 . 6.000 4.073 2.631 5.488     .  0 0 "[    .    1    .    2]" 1 
       1077 1  25 GLN HA   1  54 LEU QD   1.800 . 6.000 5.915 5.500 6.006 0.006  8 0 "[    .    1    .    2]" 1 
       1078 1  26 THR HA   1  26 THR MG   1.800 . 5.000 2.434 2.120 3.222     .  0 0 "[    .    1    .    2]" 1 
       1079 1  26 THR HA   1  32 VAL MG2  1.800 . 6.000 5.030 3.836 6.005 0.005 20 0 "[    .    1    .    2]" 1 
       1080 1  26 THR HB   1  32 VAL QG   1.800 . 5.000 3.414 2.146 4.220     .  0 0 "[    .    1    .    2]" 1 
       1081 1  26 THR MG   1  32 VAL QG   1.800 . 5.000 2.191 1.792 3.576 0.008 18 0 "[    .    1    .    2]" 1 
       1082 1  26 THR HB   1  34 VAL QG   1.800 . 6.000 2.261 1.817 3.761     .  0 0 "[    .    1    .    2]" 1 
       1083 1  26 THR MG   1  34 VAL QG   1.800 . 6.000 1.941 1.788 2.829 0.012  3 0 "[    .    1    .    2]" 1 
       1084 1  26 THR MG   1  46 ALA HA   1.800 . 6.000 2.412 1.944 3.589     .  0 0 "[    .    1    .    2]" 1 
       1085 1  26 THR HA   1  49 ALA MB   1.800 . 6.000 2.331 1.960 3.009     .  0 0 "[    .    1    .    2]" 1 
       1086 1  26 THR HB   1  49 ALA MB   1.800 . 6.000 3.526 2.394 4.330     .  0 0 "[    .    1    .    2]" 1 
       1087 1  26 THR MG   1  49 ALA MB   1.800 . 5.000 2.082 1.787 3.506 0.013 18 0 "[    .    1    .    2]" 1 
       1088 1  26 THR HA   1  50 LEU HA   1.800 . 6.000 4.559 4.214 4.995     .  0 0 "[    .    1    .    2]" 1 
       1089 1  26 THR HA   1  50 LEU HG   1.800 . 5.000 4.587 4.066 4.955     .  0 0 "[    .    1    .    2]" 1 
       1090 1  26 THR HB   1  50 LEU QD   1.800 . 6.000 4.527 3.436 5.321     .  0 0 "[    .    1    .    2]" 1 
       1091 1  26 THR MG   1  50 LEU QD   1.800 . 6.000 3.820 2.437 4.726     .  0 0 "[    .    1    .    2]" 1 
       1092 1  27 ALA HA   1  28 GLY QA   1.800 . 5.000 3.933 3.918 3.985     .  0 0 "[    .    1    .    2]" 1 
       1093 1  28 GLY QA   1  29 TYR HD1  1.800 . 4.000 3.929 3.820 4.005 0.005 18 0 "[    .    1    .    2]" 1 
       1094 1  28 GLY QA   1  29 TYR HE1  1.800 . 5.000 4.639 4.433 4.896     .  0 0 "[    .    1    .    2]" 1 
       1095 1  29 TYR HA   1  29 TYR HD1  1.800 . 4.000 3.982 3.928 4.012 0.012  9 0 "[    .    1    .    2]" 1 
       1096 1  29 TYR HA   1  30 PRO HA   1.800 . 6.000 4.466 4.419 4.491     .  0 0 "[    .    1    .    2]" 1 
       1097 1  29 TYR HA   1  30 PRO HD3  1.800 . 4.000 2.136 1.855 2.382     .  0 0 "[    .    1    .    2]" 1 
       1098 1  29 TYR HA   1  30 PRO HD2  1.800 . 4.000 2.392 2.075 2.739     .  0 0 "[    .    1    .    2]" 1 
       1099 1  29 TYR QD   1  30 PRO HD3  1.800 . 6.000 4.580 4.334 5.013     .  0 0 "[    .    1    .    2]" 1 
       1100 1  29 TYR QD   1  30 PRO HD2  1.800 . 6.000 3.889 3.393 4.441     .  0 0 "[    .    1    .    2]" 1 
       1101 1  29 TYR QD   1  30 PRO QD   1.800 . 6.000 3.657 3.293 4.025     .  0 0 "[    .    1    .    2]" 1 
       1102 1  29 TYR QB   1  32 VAL HB   1.800 . 5.000 2.293 1.940 4.508     .  0 0 "[    .    1    .    2]" 1 
       1103 1  29 TYR QB   1  32 VAL MG1  1.800 . 5.000 2.974 1.991 4.074     .  0 0 "[    .    1    .    2]" 1 
       1104 1  29 TYR QB   1  32 VAL MG2  1.800 . 6.000 2.541 1.795 3.763 0.005 10 0 "[    .    1    .    2]" 1 
       1105 1  29 TYR HD1  1  32 VAL QG   1.800 . 6.000 2.950 1.989 3.653     .  0 0 "[    .    1    .    2]" 1 
       1106 1  29 TYR QB   1  49 ALA MB   1.800 . 5.000 4.103 3.710 4.406     .  0 0 "[    .    1    .    2]" 1 
       1107 1  29 TYR HD2  1  49 ALA HA   1.800 . 5.000 5.009 5.000 5.019 0.019 11 0 "[    .    1    .    2]" 1 
       1108 1  29 TYR HD1  1  49 ALA HA   1.800 . 5.000 4.977 4.822 5.014 0.014 11 0 "[    .    1    .    2]" 1 
       1109 1  29 TYR HD2  1  49 ALA MB   1.800 . 6.000 4.716 4.474 4.953     .  0 0 "[    .    1    .    2]" 1 
       1110 1  29 TYR HD1  1  49 ALA MB   1.800 . 6.000 3.297 2.930 3.601     .  0 0 "[    .    1    .    2]" 1 
       1111 1  29 TYR QE   1  49 ALA MB   1.800 . 5.000 2.348 2.092 2.789     .  0 0 "[    .    1    .    2]" 1 
       1112 1  30 PRO HA   1  30 PRO QD   1.800 . 6.000 3.424 3.374 3.459     .  0 0 "[    .    1    .    2]" 1 
       1113 1  30 PRO QB   1  31 GLY QA   1.800 . 6.000 4.019 3.844 4.139     .  0 0 "[    .    1    .    2]" 1 
       1114 1  32 VAL HA   1  32 VAL MG2  1.800 . 5.000 2.371 2.229 2.507     .  0 0 "[    .    1    .    2]" 1 
       1115 1  32 VAL QG   1  33 HIS HA   1.800 . 6.000 3.558 3.294 3.837     .  0 0 "[    .    1    .    2]" 1 
       1116 1  32 VAL QG   1  34 VAL HB   1.800 . 6.000 4.121 3.346 5.153     .  0 0 "[    .    1    .    2]" 1 
       1117 1  32 VAL QG   1  34 VAL QG   1.800 . 5.000 2.130 1.796 2.705 0.004 15 0 "[    .    1    .    2]" 1 
       1118 1  32 VAL HA   1  45 LEU MD1  1.800 . 6.000 3.875 2.676 5.279     .  0 0 "[    .    1    .    2]" 1 
       1119 1  32 VAL QG   1  45 LEU QB   1.800 . 5.000 2.725 1.938 4.248     .  0 0 "[    .    1    .    2]" 1 
       1120 1  32 VAL QG   1  46 ALA HA   1.800 . 5.000 3.947 3.257 4.842     .  0 0 "[    .    1    .    2]" 1 
       1121 1  32 VAL QG   1  46 ALA MB   1.800 . 6.000 4.331 3.850 4.951     .  0 0 "[    .    1    .    2]" 1 
       1122 1  33 HIS HA   1  35 SER QB   1.800 . 6.000 4.941 4.450 5.647     .  0 0 "[    .    1    .    2]" 1 
       1123 1  33 HIS QB   1  40 SER HA   1.800 . 6.000 5.431 4.222 6.005 0.005 10 0 "[    .    1    .    2]" 1 
       1124 1  34 VAL QG   1  35 SER HA   1.800 . 6.000 3.634 3.474 4.077     .  0 0 "[    .    1    .    2]" 1 
       1125 1  34 VAL HA   1  40 SER HA   1.800 . 5.000 4.385 3.618 4.997     .  0 0 "[    .    1    .    2]" 1 
       1126 1  34 VAL HA   1  40 SER QB   1.800 . 4.000 3.004 2.060 3.525     .  0 0 "[    .    1    .    2]" 1 
       1127 1  34 VAL HB   1  40 SER QB   1.800 . 6.000 5.293 4.162 5.924     .  0 0 "[    .    1    .    2]" 1 
       1128 1  34 VAL MG1  1  40 SER QB   1.800 . 6.000 3.009 1.921 3.733     .  0 0 "[    .    1    .    2]" 1 
       1129 1  34 VAL MG2  1  40 SER QB   1.800 . 6.000 3.882 2.650 4.583     .  0 0 "[    .    1    .    2]" 1 
       1130 1  34 VAL QG   1  46 ALA HA   1.800 . 6.000 2.922 2.269 3.654     .  0 0 "[    .    1    .    2]" 1 
       1131 1  34 VAL MG1  1  46 ALA MB   1.800 . 6.000 2.568 1.977 3.438     .  0 0 "[    .    1    .    2]" 1 
       1132 1  34 VAL MG2  1  46 ALA MB   1.800 . 6.000 2.741 1.985 3.779     .  0 0 "[    .    1    .    2]" 1 
       1133 1  34 VAL QG   1  46 ALA MB   1.800 . 5.000 2.335 1.835 3.190     .  0 0 "[    .    1    .    2]" 1 
       1134 1  36 ASP HA   1  37 LEU HG   1.800 . 6.000 4.918 3.646 6.004 0.004  1 0 "[    .    1    .    2]" 1 
       1135 1  36 ASP QB   1  38 SER QB   1.800 . 6.000 3.680 3.510 3.845     .  0 0 "[    .    1    .    2]" 1 
       1136 1  37 LEU HA   1  37 LEU MD1  1.800 . 6.000 3.351 2.008 3.918     .  0 0 "[    .    1    .    2]" 1 
       1137 1  37 LEU HA   1  37 LEU MD2  1.800 . 6.000 2.854 2.207 3.563     .  0 0 "[    .    1    .    2]" 1 
       1138 1  37 LEU HA   1  41 TRP HD1  1.800 . 4.000 3.378 2.872 3.868     .  0 0 "[    .    1    .    2]" 1 
       1139 1  37 LEU QB   1 101 PRO HA   1.800 . 5.000 4.472 3.556 5.003 0.003 19 0 "[    .    1    .    2]" 1 
       1140 1  37 LEU QB   1 101 PRO QB   1.800 . 5.000 4.182 3.259 4.844     .  0 0 "[    .    1    .    2]" 1 
       1141 1  37 LEU QD   1 105 ILE HA   1.800 . 6.000 4.561 3.593 5.617     .  0 0 "[    .    1    .    2]" 1 
       1142 1  37 LEU HA   1 108 LEU QD   1.800 . 6.000 5.358 4.621 6.003 0.003  3 0 "[    .    1    .    2]" 1 
       1143 1  37 LEU QD   1 108 LEU MD1  1.800 . 6.000 4.063 2.659 5.186     .  0 0 "[    .    1    .    2]" 1 
       1144 1  37 LEU QD   1 108 LEU MD2  1.800 . 6.000 4.778 3.364 5.987     .  0 0 "[    .    1    .    2]" 1 
       1145 1  38 SER HA   1  41 TRP QB   1.800 . 4.000 3.746 3.409 4.007 0.007  6 0 "[    .    1    .    2]" 1 
       1146 1  38 SER HA   1  41 TRP HD1  1.800 . 5.000 3.304 2.859 3.957     .  0 0 "[    .    1    .    2]" 1 
       1147 1  38 SER HA   1  98 GLY QA   1.800 . 5.000 2.735 1.949 3.281     .  0 0 "[    .    1    .    2]" 1 
       1148 1  38 SER HA   1 104 LEU QD   1.800 . 6.000 3.436 2.682 4.806     .  0 0 "[    .    1    .    2]" 1 
       1149 1  38 SER QB   1  98 GLY QA   1.800 . 4.000 2.580 2.038 3.333     .  0 0 "[    .    1    .    2]" 1 
       1150 1  38 SER QB   1 104 LEU QD   1.800 . 6.000 4.527 3.402 5.783     .  0 0 "[    .    1    .    2]" 1 
       1151 1  39 SER HA   1  42 ALA MB   1.800 . 4.000 2.486 2.066 2.881     .  0 0 "[    .    1    .    2]" 1 
       1152 1  39 SER QB   1  42 ALA MB   1.800 . 6.000 3.726 3.236 4.173     .  0 0 "[    .    1    .    2]" 1 
       1153 1  40 SER HA   1  42 ALA MB   1.800 . 6.000 4.479 4.229 4.741     .  0 0 "[    .    1    .    2]" 1 
       1154 1  41 TRP HA   1  41 TRP HE3  1.800 . 5.000 3.712 3.278 4.095     .  0 0 "[    .    1    .    2]" 1 
       1155 1  41 TRP HB3  1 104 LEU QD   1.800 . 5.000 3.556 3.103 4.565     .  0 0 "[    .    1    .    2]" 1 
       1156 1  41 TRP HB2  1 104 LEU QD   1.800 . 5.000 3.275 2.747 3.908     .  0 0 "[    .    1    .    2]" 1 
       1157 1  41 TRP HH2  1  50 LEU QD   1.800 . 5.000 3.141 2.349 3.665     .  0 0 "[    .    1    .    2]" 1 
       1158 1  41 TRP HA   1  46 ALA MB   1.800 . 5.000 3.094 2.676 3.764     .  0 0 "[    .    1    .    2]" 1 
       1159 1  41 TRP QB   1  95 VAL QG   1.800 . 6.000 2.201 1.819 3.512     .  0 0 "[    .    1    .    2]" 1 
       1160 1  41 TRP HE3  1  47 LEU QD   1.800 . 6.000 2.714 1.931 3.584     .  0 0 "[    .    1    .    2]" 1 
       1161 1  41 TRP HZ3  1  47 LEU QD   1.800 . 6.000 2.420 1.865 3.659     .  0 0 "[    .    1    .    2]" 1 
       1162 1  42 ALA HA   1  73 THR HG1  1.800 . 6.000 5.305 4.688 5.993     .  0 0 "[    .    1    .    2]" 1 
       1163 1  42 ALA HA   1  95 VAL QG   1.800 . 5.000 4.514 3.932 4.990     .  0 0 "[    .    1    .    2]" 1 
       1164 1  42 ALA HA   1  96 VAL HA   1.800 . 4.000 2.239 1.987 2.594     .  0 0 "[    .    1    .    2]" 1 
       1165 1  42 ALA MB   1  96 VAL HA   1.800 . 5.000 3.764 3.451 4.081     .  0 0 "[    .    1    .    2]" 1 
       1166 1  42 ALA MB   1  96 VAL QG   1.800 . 6.000 2.868 2.327 3.255     .  0 0 "[    .    1    .    2]" 1 
       1167 1  43 ASP HA   1  66 GLY QA   1.800 . 6.000 5.923 5.760 6.005 0.005 10 0 "[    .    1    .    2]" 1 
       1168 1  43 ASP QB   1  66 GLY QA   1.800 . 4.000 4.029 4.021 4.048 0.048 16 0 "[    .    1    .    2]" 1 
       1169 1  43 ASP HA   1  69 ALA HA   1.800 . 4.000 2.078 1.947 2.499     .  0 0 "[    .    1    .    2]" 1 
       1170 1  43 ASP HA   1  69 ALA MB   1.800 . 4.000 2.234 1.938 3.168     .  0 0 "[    .    1    .    2]" 1 
       1171 1  43 ASP HB3  1  69 ALA HA   1.800 . 6.000 4.071 3.588 4.319     .  0 0 "[    .    1    .    2]" 1 
       1172 1  43 ASP HB2  1  69 ALA HA   1.800 . 6.000 3.797 3.388 4.444     .  0 0 "[    .    1    .    2]" 1 
       1173 1  43 ASP QB   1  69 ALA HA   1.800 . 5.000 3.482 3.153 3.856     .  0 0 "[    .    1    .    2]" 1 
       1174 1  43 ASP HB3  1  69 ALA MB   1.800 . 6.000 3.696 3.150 4.506     .  0 0 "[    .    1    .    2]" 1 
       1175 1  43 ASP HB2  1  69 ALA MB   1.800 . 6.000 4.265 3.790 5.241     .  0 0 "[    .    1    .    2]" 1 
       1176 1  44 GLY QA   1  47 LEU QD   1.800 . 6.000 3.564 2.140 4.468     .  0 0 "[    .    1    .    2]" 1 
       1177 1  44 GLY QA   1  72 ALA MB   1.800 . 5.000 2.846 2.318 3.288     .  0 0 "[    .    1    .    2]" 1 
       1178 1  44 GLY QA   1  73 THR HA   1.800 . 5.000 3.437 3.044 3.643     .  0 0 "[    .    1    .    2]" 1 
       1179 1  44 GLY QA   1  73 THR MG   1.800 . 5.000 3.408 1.923 4.378     .  0 0 "[    .    1    .    2]" 1 
       1180 1  45 LEU HA   1  45 LEU QD   1.800 . 5.000 2.125 1.847 2.792     .  0 0 "[    .    1    .    2]" 1 
       1181 1  45 LEU QB   1  45 LEU QD   1.800 . 4.000 1.956 1.784 2.057 0.016 16 0 "[    .    1    .    2]" 1 
       1182 1  45 LEU HA   1  48 CYS QB   1.800 . 4.000 2.719 2.224 3.367     .  0 0 "[    .    1    .    2]" 1 
       1183 1  45 LEU MD1  1  48 CYS QB   1.800 . 6.000 3.881 2.709 5.538     .  0 0 "[    .    1    .    2]" 1 
       1184 1  45 LEU QD   1  61 PRO QB   1.800 . 6.000 3.274 2.240 3.873     .  0 0 "[    .    1    .    2]" 1 
       1185 1  45 LEU MD1  1  64 LEU QB   1.800 . 6.000 5.838 3.907 6.019 0.019 14 0 "[    .    1    .    2]" 1 
       1186 1  45 LEU MD2  1  64 LEU QB   1.800 . 6.000 5.224 4.158 6.012 0.012 17 0 "[    .    1    .    2]" 1 
       1187 1  45 LEU QD   1  66 GLY QA   1.800 . 5.000 4.608 4.219 5.014 0.014 13 0 "[    .    1    .    2]" 1 
       1188 1  45 LEU QD   1  72 ALA MB   1.800 . 5.000 4.099 3.604 5.001 0.001 13 0 "[    .    1    .    2]" 1 
       1189 1  46 ALA MB   1  49 ALA MB   1.800 . 6.000 3.975 3.773 4.258     .  0 0 "[    .    1    .    2]" 1 
       1190 1  46 ALA HA   1  49 ALA MB   1.800 . 4.000 2.639 2.347 2.925     .  0 0 "[    .    1    .    2]" 1 
       1191 1  47 LEU HA   1  47 LEU QD   1.800 . 5.000 2.462 1.963 2.998     .  0 0 "[    .    1    .    2]" 1 
       1192 1  47 LEU QB   1  47 LEU MD1  1.800 . 5.000 2.096 1.915 2.325     .  0 0 "[    .    1    .    2]" 1 
       1193 1  47 LEU QB   1  47 LEU MD2  1.800 . 5.000 2.077 1.955 2.278     .  0 0 "[    .    1    .    2]" 1 
       1194 1  47 LEU HA   1  50 LEU QB   1.800 . 4.000 3.110 2.827 3.558     .  0 0 "[    .    1    .    2]" 1 
       1195 1  47 LEU HA   1  50 LEU MD1  1.800 . 6.000 2.492 1.956 3.514     .  0 0 "[    .    1    .    2]" 1 
       1196 1  47 LEU HA   1  50 LEU MD2  1.800 . 6.000 4.806 4.073 5.402     .  0 0 "[    .    1    .    2]" 1 
       1197 1  47 LEU QD   1  50 LEU QD   1.800 . 6.000 3.255 2.451 4.251     .  0 0 "[    .    1    .    2]" 1 
       1198 1  47 LEU QD   1  73 THR HA   1.800 . 6.000 3.342 2.840 4.401     .  0 0 "[    .    1    .    2]" 1 
       1199 1  47 LEU HB3  1  76 ALA MB   1.800 . 5.000 3.101 2.637 4.144     .  0 0 "[    .    1    .    2]" 1 
       1200 1  47 LEU HB2  1  76 ALA MB   1.800 . 5.000 4.146 3.200 4.951     .  0 0 "[    .    1    .    2]" 1 
       1201 1  47 LEU QB   1  76 ALA MB   1.800 . 5.000 2.982 2.601 3.568     .  0 0 "[    .    1    .    2]" 1 
       1202 1  47 LEU QD   1  77 LEU QD   1.800 . 6.000 2.390 1.800 3.461     .  0 0 "[    .    1    .    2]" 1 
       1203 1  47 LEU QD   1 107 TYR QD   1.800 . 6.000 2.775 1.985 4.206     .  0 0 "[    .    1    .    2]" 1 
       1204 1  47 LEU QD   1 107 TYR QE   1.800 . 6.000 2.250 1.796 3.068 0.004 17 0 "[    .    1    .    2]" 1 
       1205 1  47 LEU QD   1 108 LEU QD   1.800 . 6.000 4.180 2.834 5.213     .  0 0 "[    .    1    .    2]" 1 
       1206 1  48 CYS HA   1  51 VAL HB   1.800 . 4.000 2.996 2.781 3.230     .  0 0 "[    .    1    .    2]" 1 
       1207 1  48 CYS HA   1  51 VAL MG1  1.800 . 5.000 4.357 4.162 4.563     .  0 0 "[    .    1    .    2]" 1 
       1208 1  48 CYS HA   1  51 VAL MG2  1.800 . 5.000 2.855 2.561 3.228     .  0 0 "[    .    1    .    2]" 1 
       1209 1  48 CYS HA   1  51 VAL QG   1.800 . 4.000 2.817 2.539 3.158     .  0 0 "[    .    1    .    2]" 1 
       1210 1  48 CYS HA   1  59 LEU QD   1.800 . 6.000 3.352 2.671 4.360     .  0 0 "[    .    1    .    2]" 1 
       1211 1  48 CYS HA   1  61 PRO QD   1.800 . 6.000 4.949 4.691 5.210     .  0 0 "[    .    1    .    2]" 1 
       1212 1  48 CYS HB3  1  64 LEU QD   1.800 . 6.000 4.830 2.703 5.744     .  0 0 "[    .    1    .    2]" 1 
       1213 1  48 CYS HB2  1  64 LEU QD   1.800 . 6.000 5.188 3.800 5.999     .  0 0 "[    .    1    .    2]" 1 
       1214 1  48 CYS HA   1  76 ALA HA   1.800 . 5.000 4.706 4.089 5.005 0.005 11 0 "[    .    1    .    2]" 1 
       1215 1  48 CYS HA   1  76 ALA MB   1.800 . 5.000 2.770 2.411 3.086     .  0 0 "[    .    1    .    2]" 1 
       1216 1  49 ALA MB   1  50 LEU QD   1.800 . 6.000 3.611 2.861 3.945     .  0 0 "[    .    1    .    2]" 1 
       1217 1  49 ALA HA   1  52 TYR QB   1.800 . 4.000 2.745 2.587 2.884     .  0 0 "[    .    1    .    2]" 1 
       1218 1  49 ALA HA   1  52 TYR QD   1.800 . 6.000 4.222 4.011 4.675     .  0 0 "[    .    1    .    2]" 1 
       1219 1  49 ALA MB   1  53 ARG QG   1.800 . 6.000 5.018 3.823 6.003 0.003 16 0 "[    .    1    .    2]" 1 
       1220 1  50 LEU HA   1  50 LEU QD   1.800 . 5.000 2.369 1.983 2.886     .  0 0 "[    .    1    .    2]" 1 
       1221 1  50 LEU HB3  1  50 LEU MD1  1.800 . 5.000 2.678 2.422 3.148     .  0 0 "[    .    1    .    2]" 1 
       1222 1  50 LEU HB2  1  50 LEU MD1  1.800 . 5.000 2.112 1.974 2.309     .  0 0 "[    .    1    .    2]" 1 
       1223 1  50 LEU QB   1  50 LEU MD2  1.800 . 5.000 2.134 1.929 2.282     .  0 0 "[    .    1    .    2]" 1 
       1224 1  50 LEU HA   1  53 ARG HB3  1.800 . 4.000 3.610 3.044 4.004 0.004 20 0 "[    .    1    .    2]" 1 
       1225 1  50 LEU HA   1  53 ARG HB2  1.800 . 4.000 3.029 2.709 3.471     .  0 0 "[    .    1    .    2]" 1 
       1226 1  50 LEU HA   1  54 LEU QD   1.800 . 6.000 3.725 3.500 4.088     .  0 0 "[    .    1    .    2]" 1 
       1227 1  50 LEU QD   1 108 LEU QD   1.800 . 6.000 2.914 2.212 3.713     .  0 0 "[    .    1    .    2]" 1 
       1228 1  50 LEU QB   1 111 PHE HA   1.800 . 6.000 5.987 5.845 6.014 0.014 18 0 "[    .    1    .    2]" 1 
       1229 1  50 LEU QD   1 111 PHE HA   1.800 . 6.000 5.058 4.445 5.469     .  0 0 "[    .    1    .    2]" 1 
       1230 1  50 LEU QD   1 111 PHE QB   1.800 . 6.000 2.969 2.260 3.304     .  0 0 "[    .    1    .    2]" 1 
       1231 1  50 LEU QD   1 111 PHE QD   1.800 . 5.000 2.910 1.988 3.737     .  0 0 "[    .    1    .    2]" 1 
       1232 1  51 VAL HA   1  54 LEU QB   1.800 . 4.000 2.901 2.603 3.231     .  0 0 "[    .    1    .    2]" 1 
       1233 1  51 VAL HA   1  54 LEU QD   1.800 . 6.000 3.613 2.558 4.007     .  0 0 "[    .    1    .    2]" 1 
       1234 1  51 VAL HB   1  59 LEU QD   1.800 . 5.000 2.425 1.821 3.210     .  0 0 "[    .    1    .    2]" 1 
       1235 1  51 VAL MG1  1  76 ALA MB   1.800 . 6.000 4.069 3.516 4.532     .  0 0 "[    .    1    .    2]" 1 
       1236 1  51 VAL MG2  1  76 ALA MB   1.800 . 6.000 2.905 2.584 3.307     .  0 0 "[    .    1    .    2]" 1 
       1237 1  51 VAL MG1  1  76 ALA HA   1.800 . 6.000 4.219 3.558 4.818     .  0 0 "[    .    1    .    2]" 1 
       1238 1  51 VAL MG2  1  76 ALA HA   1.800 . 6.000 4.144 3.433 4.631     .  0 0 "[    .    1    .    2]" 1 
       1239 1  51 VAL HB   1  79 VAL QG   1.800 . 6.000 4.564 3.747 6.007 0.007  2 0 "[    .    1    .    2]" 1 
       1240 1  51 VAL QG   1  79 VAL HB   1.800 . 6.000 4.072 3.467 5.264     .  0 0 "[    .    1    .    2]" 1 
       1241 1  51 VAL QG   1  79 VAL QG   1.800 . 6.000 2.835 2.108 4.085     .  0 0 "[    .    1    .    2]" 1 
       1242 1  51 VAL QG   1  80 ALA MB   1.800 . 5.000 1.851 1.791 1.994 0.009 20 0 "[    .    1    .    2]" 1 
       1243 1  51 VAL QG   1 111 PHE QD   1.800 . 6.000 4.234 3.747 4.545     .  0 0 "[    .    1    .    2]" 1 
       1244 1  51 VAL QG   1 111 PHE QE   1.800 . 6.000 2.679 1.946 3.492     .  0 0 "[    .    1    .    2]" 1 
       1245 1  51 VAL QG   1 111 PHE HZ   1.800 . 6.000 2.811 1.945 3.936     .  0 0 "[    .    1    .    2]" 1 
       1246 1  51 VAL QG   1 115 PHE HZ   1.800 . 6.000 3.663 3.102 4.614     .  0 0 "[    .    1    .    2]" 1 
       1247 1  52 TYR HA   1  52 TYR QD   1.800 . 4.000 2.716 2.263 3.038     .  0 0 "[    .    1    .    2]" 1 
       1248 1  52 TYR HA   1  52 TYR QE   1.800 . 6.000 4.581 4.357 4.747     .  0 0 "[    .    1    .    2]" 1 
       1249 1  52 TYR HA   1  56 PRO HA   1.800 . 4.000 2.581 2.199 3.208     .  0 0 "[    .    1    .    2]" 1 
       1250 1  52 TYR QD   1  56 PRO HA   1.800 . 4.000 2.631 2.239 3.108     .  0 0 "[    .    1    .    2]" 1 
       1251 1  52 TYR QE   1  56 PRO HA   1.800 . 5.000 3.188 2.757 3.438     .  0 0 "[    .    1    .    2]" 1 
       1252 1  52 TYR HA   1  59 LEU QB   1.800 . 5.000 2.608 2.102 4.958     .  0 0 "[    .    1    .    2]" 1 
       1253 1  52 TYR QD   1  59 LEU HA   1.800 . 6.000 4.548 4.249 5.275     .  0 0 "[    .    1    .    2]" 1 
       1254 1  52 TYR QD   1  59 LEU QB   1.800 . 4.000 2.158 1.858 3.947     .  0 0 "[    .    1    .    2]" 1 
       1255 1  52 TYR QD   1  60 GLU HA   1.800 . 6.000 3.722 3.281 4.219     .  0 0 "[    .    1    .    2]" 1 
       1256 1  52 TYR QE   1  60 GLU HA   1.800 . 5.000 3.447 2.779 4.272     .  0 0 "[    .    1    .    2]" 1 
       1257 1  52 TYR QE   1  61 PRO HG3  1.800 . 5.000 4.415 3.928 5.003 0.003  9 0 "[    .    1    .    2]" 1 
       1258 1  52 TYR QE   1  61 PRO HG2  1.800 . 5.000 4.153 3.768 4.430     .  0 0 "[    .    1    .    2]" 1 
       1259 1  52 TYR QE   1  61 PRO HD3  1.800 . 5.000 4.225 3.853 4.566     .  0 0 "[    .    1    .    2]" 1 
       1260 1  52 TYR QE   1  61 PRO HD2  1.800 . 5.000 2.965 2.570 3.450     .  0 0 "[    .    1    .    2]" 1 
       1261 1  53 ARG HA   1  53 ARG QD   1.800 . 5.000 3.218 1.968 4.028     .  0 0 "[    .    1    .    2]" 1 
       1262 1  53 ARG HA   1  56 PRO HA   1.800 . 6.000 5.133 4.810 5.379     .  0 0 "[    .    1    .    2]" 1 
       1263 1  53 ARG HA   1  56 PRO QB   1.800 . 6.000 3.904 3.598 4.707     .  0 0 "[    .    1    .    2]" 1 
       1264 1  54 LEU HA   1  54 LEU MD1  1.800 . 6.000 2.324 1.975 3.989     .  0 0 "[    .    1    .    2]" 1 
       1265 1  54 LEU HA   1  54 LEU MD2  1.800 . 4.000 2.526 2.156 3.767     .  0 0 "[    .    1    .    2]" 1 
       1266 1  54 LEU QB   1  54 LEU QD   1.800 . 5.000 1.987 1.806 2.072     .  0 0 "[    .    1    .    2]" 1 
       1267 1  54 LEU QB   1 115 PHE QD   1.800 . 5.000 4.819 3.039 5.008 0.008 20 0 "[    .    1    .    2]" 1 
       1268 1  54 LEU QB   1 115 PHE QE   1.800 . 5.000 3.743 2.399 4.035     .  0 0 "[    .    1    .    2]" 1 
       1269 1  54 LEU QD   1 115 PHE HA   1.800 . 6.000 3.029 2.556 3.917     .  0 0 "[    .    1    .    2]" 1 
       1270 1  54 LEU QD   1 115 PHE QB   1.800 . 6.000 3.281 2.126 3.667     .  0 0 "[    .    1    .    2]" 1 
       1271 1  54 LEU QD   1 115 PHE QD   1.800 . 6.000 2.561 2.101 2.885     .  0 0 "[    .    1    .    2]" 1 
       1272 1  54 LEU QD   1 115 PHE QE   1.800 . 6.000 2.323 1.964 2.724     .  0 0 "[    .    1    .    2]" 1 
       1273 1  55 GLN HA   1  56 PRO QG   1.800 . 5.000 3.933 3.811 4.010     .  0 0 "[    .    1    .    2]" 1 
       1274 1  55 GLN HA   1  56 PRO HD3  1.800 . 3.000 2.892 2.744 3.023 0.023 18 0 "[    .    1    .    2]" 1 
       1275 1  55 GLN HA   1  56 PRO HD2  1.800 . 3.000 2.097 1.949 2.187     .  0 0 "[    .    1    .    2]" 1 
       1276 1  55 GLN HA   1  58 LEU QB   1.800 . 6.000 4.364 3.842 4.741     .  0 0 "[    .    1    .    2]" 1 
       1277 1  55 GLN QB   1  57 GLY QA   1.800 . 5.000 4.977 4.779 5.018 0.018 20 0 "[    .    1    .    2]" 1 
       1278 1  55 GLN QB   1  58 LEU HA   1.800 . 6.000 4.756 3.760 5.103     .  0 0 "[    .    1    .    2]" 1 
       1279 1  55 GLN QB   1  58 LEU QB   1.800 . 5.000 2.274 1.826 2.876     .  0 0 "[    .    1    .    2]" 1 
       1280 1  55 GLN QB   1  58 LEU QD   1.800 . 5.000 3.208 1.880 3.963     .  0 0 "[    .    1    .    2]" 1 
       1281 1  55 GLN HA   1  58 LEU QD   1.800 . 6.000 4.635 3.297 5.500     .  0 0 "[    .    1    .    2]" 1 
       1282 1  55 GLN QB   1  84 LEU HA   1.800 . 6.000 6.007 6.001 6.021 0.021  2 0 "[    .    1    .    2]" 1 
       1283 1  56 PRO QB   1  57 GLY QA   1.800 . 5.000 3.775 3.592 3.868     .  0 0 "[    .    1    .    2]" 1 
       1284 1  56 PRO QD   1  57 GLY QA   1.800 . 5.000 4.293 4.172 4.487     .  0 0 "[    .    1    .    2]" 1 
       1285 1  58 LEU QB   1  58 LEU QD   1.800 . 5.000 1.945 1.823 2.062     .  0 0 "[    .    1    .    2]" 1 
       1286 1  58 LEU QD   1  60 GLU QG   1.800 . 6.000 5.807 5.343 6.005 0.005 14 0 "[    .    1    .    2]" 1 
       1287 1  58 LEU QD   1  79 VAL MG1  1.800 . 6.000 4.485 1.793 5.729 0.007  2 0 "[    .    1    .    2]" 1 
       1288 1  58 LEU QD   1  79 VAL MG2  1.800 . 6.000 5.101 3.499 5.986     .  0 0 "[    .    1    .    2]" 1 
       1289 1  58 LEU QD   1  83 GLU HA   1.800 . 6.000 4.110 3.494 4.837     .  0 0 "[    .    1    .    2]" 1 
       1290 1  58 LEU QD   1  83 GLU QG   1.800 . 5.000 2.463 1.819 3.601     .  0 0 "[    .    1    .    2]" 1 
       1291 1  58 LEU QD   1  83 GLU QB   1.800 . 5.000 3.652 1.789 4.321 0.011  2 0 "[    .    1    .    2]" 1 
       1292 1  59 LEU HA   1  64 LEU QD   1.800 . 6.000 4.899 4.168 5.431     .  0 0 "[    .    1    .    2]" 1 
       1293 1  59 LEU HA   1  75 TRP HZ3  1.800 . 4.000 2.734 2.043 3.353     .  0 0 "[    .    1    .    2]" 1 
       1294 1  59 LEU QB   1  59 LEU MD2  1.800 . 5.000 2.140 1.927 2.341     .  0 0 "[    .    1    .    2]" 1 
       1295 1  59 LEU QB   1  60 GLU QB   1.800 . 5.000 4.711 4.417 4.933     .  0 0 "[    .    1    .    2]" 1 
       1296 1  59 LEU QD   1  64 LEU QD   1.800 . 5.000 3.643 2.403 4.434     .  0 0 "[    .    1    .    2]" 1 
       1297 1  60 GLU HA   1  61 PRO QD   1.800 . 4.000 2.143 1.901 2.385     .  0 0 "[    .    1    .    2]" 1 
       1298 1  60 GLU HA   1  61 PRO QG   1.800 . 5.000 3.891 3.714 4.100     .  0 0 "[    .    1    .    2]" 1 
       1299 1  60 GLU HA   1  63 GLU QB   1.800 . 5.000 4.607 3.863 5.010 0.010 19 0 "[    .    1    .    2]" 1 
       1300 1  61 PRO HA   1  61 PRO QD   1.800 . 5.000 3.218 3.151 3.264     .  0 0 "[    .    1    .    2]" 1 
       1301 1  61 PRO HA   1  64 LEU QB   1.800 . 4.000 2.835 2.470 3.411     .  0 0 "[    .    1    .    2]" 1 
       1302 1  61 PRO HA   1  64 LEU QD   1.800 . 6.000 2.929 2.034 3.822     .  0 0 "[    .    1    .    2]" 1 
       1303 1  61 PRO QB   1  64 LEU QB   1.800 . 6.000 4.305 3.711 4.867     .  0 0 "[    .    1    .    2]" 1 
       1304 1  61 PRO QB   1  64 LEU QD   1.800 . 6.000 4.267 3.436 5.137     .  0 0 "[    .    1    .    2]" 1 
       1305 1  64 LEU HA   1  64 LEU QD   1.800 . 5.000 2.371 1.876 3.082     .  0 0 "[    .    1    .    2]" 1 
       1306 1  64 LEU QB   1  72 ALA MB   1.800 . 4.000 1.996 1.828 2.184     .  0 0 "[    .    1    .    2]" 1 
       1307 1  64 LEU QD   1  75 TRP QB   1.800 . 6.000 2.106 1.809 2.741     .  0 0 "[    .    1    .    2]" 1 
       1308 1  64 LEU QD   1  71 GLU QB   1.800 . 6.000 2.927 2.040 4.011     .  0 0 "[    .    1    .    2]" 1 
       1309 1  64 LEU MD1  1  72 ALA HA   1.800 . 5.000 2.611 1.895 3.612     .  0 0 "[    .    1    .    2]" 1 
       1310 1  64 LEU MD2  1  72 ALA HA   1.800 . 5.000 2.917 1.966 4.158     .  0 0 "[    .    1    .    2]" 1 
       1311 1  64 LEU MD1  1  72 ALA MB   1.800 . 6.000 3.273 2.689 3.840     .  0 0 "[    .    1    .    2]" 1 
       1312 1  64 LEU MD2  1  72 ALA MB   1.800 . 6.000 3.690 3.191 4.411     .  0 0 "[    .    1    .    2]" 1 
       1313 1  65 GLN HA   1  65 GLN QG   1.800 . 4.000 2.444 2.081 2.606     .  0 0 "[    .    1    .    2]" 1 
       1314 1  65 GLN QB   1  67 LEU QD   1.800 . 5.000 5.023 4.999 5.075 0.075 12 0 "[    .    1    .    2]" 1 
       1315 1  67 LEU HA   1  67 LEU QD   1.800 . 4.000 2.694 2.515 2.919     .  0 0 "[    .    1    .    2]" 1 
       1316 1  67 LEU QB   1  71 GLU QB   1.800 . 4.000 3.428 2.358 4.003 0.003  9 0 "[    .    1    .    2]" 1 
       1317 1  67 LEU QD   1  71 GLU QB   1.800 . 6.000 4.030 2.835 4.736     .  0 0 "[    .    1    .    2]" 1 
       1318 1  67 LEU QD   1  71 GLU HG3  1.800 . 6.000 5.033 2.749 5.898     .  0 0 "[    .    1    .    2]" 1 
       1319 1  67 LEU QD   1  71 GLU HG2  1.800 . 6.000 4.437 2.395 5.699     .  0 0 "[    .    1    .    2]" 1 
       1320 1  69 ALA HA   1  72 ALA MB   1.800 . 4.000 2.991 2.560 3.322     .  0 0 "[    .    1    .    2]" 1 
       1321 1  69 ALA HA   1  96 VAL QG   1.800 . 5.000 3.699 3.128 4.202     .  0 0 "[    .    1    .    2]" 1 
       1322 1  69 ALA MB   1  96 VAL HA   1.800 . 5.000 4.186 3.653 4.729     .  0 0 "[    .    1    .    2]" 1 
       1323 1  69 ALA MB   1  96 VAL QG   1.800 . 4.000 1.885 1.785 2.156 0.015 13 0 "[    .    1    .    2]" 1 
       1324 1  70 LEU QB   1  70 LEU QD   1.800 . 4.000 1.908 1.800 2.062 0.000  9 0 "[    .    1    .    2]" 1 
       1325 1  70 LEU QD   1  71 GLU HA   1.800 . 6.000 4.364 2.643 5.177     .  0 0 "[    .    1    .    2]" 1 
       1326 1  70 LEU HA   1  73 THR HB   1.800 . 4.000 3.252 2.789 4.001 0.001 14 0 "[    .    1    .    2]" 1 
       1327 1  70 LEU QD   1  73 THR HB   1.800 . 6.000 4.182 3.014 5.587     .  0 0 "[    .    1    .    2]" 1 
       1328 1  70 LEU HA   1  92 ALA MB   1.800 . 4.000 2.860 2.090 3.427     .  0 0 "[    .    1    .    2]" 1 
       1329 1  70 LEU QD   1  92 ALA MB   1.800 . 5.000 2.517 1.796 3.405 0.004  5 0 "[    .    1    .    2]" 1 
       1330 1  70 LEU QD   1  93 GLN HA   1.800 . 5.000 2.732 1.950 3.502     .  0 0 "[    .    1    .    2]" 1 
       1331 1  70 LEU QD   1  93 GLN QG   1.800 . 6.000 3.002 1.870 4.507     .  0 0 "[    .    1    .    2]" 1 
       1332 1  71 GLU HA   1  71 GLU QG   1.800 . 5.000 2.269 2.027 2.621     .  0 0 "[    .    1    .    2]" 1 
       1333 1  71 GLU QB   1  72 ALA MB   1.800 . 6.000 3.737 3.606 3.889     .  0 0 "[    .    1    .    2]" 1 
       1334 1  71 GLU HA   1  74 ALA MB   1.800 . 4.000 2.875 2.685 3.047     .  0 0 "[    .    1    .    2]" 1 
       1335 1  71 GLU QG   1  74 ALA MB   1.800 . 6.000 4.152 3.876 4.648     .  0 0 "[    .    1    .    2]" 1 
       1336 1  72 ALA HA   1  75 TRP HB3  1.800 . 5.000 3.130 2.887 3.542     .  0 0 "[    .    1    .    2]" 1 
       1337 1  72 ALA HA   1  75 TRP HB2  1.800 . 5.000 3.638 3.299 3.885     .  0 0 "[    .    1    .    2]" 1 
       1338 1  72 ALA HA   1  75 TRP QB   1.800 . 4.000 2.937 2.796 3.086     .  0 0 "[    .    1    .    2]" 1 
       1339 1  73 THR HA   1  76 ALA MB   1.800 . 4.000 2.816 2.615 3.020     .  0 0 "[    .    1    .    2]" 1 
       1340 1  73 THR HB   1  92 ALA MB   1.800 . 5.000 2.215 1.834 3.890     .  0 0 "[    .    1    .    2]" 1 
       1341 1  73 THR MG   1  92 ALA HA   1.800 . 4.000 2.218 1.893 3.489     .  0 0 "[    .    1    .    2]" 1 
       1342 1  73 THR MG   1  95 VAL HB   1.800 . 6.000 3.013 2.236 5.281     .  0 0 "[    .    1    .    2]" 1 
       1343 1  73 THR MG   1  95 VAL MG1  1.800 . 5.000 2.825 1.843 4.929     .  0 0 "[    .    1    .    2]" 1 
       1344 1  73 THR MG   1  95 VAL MG2  1.800 . 4.000 2.843 1.870 3.421     .  0 0 "[    .    1    .    2]" 1 
       1345 1  74 ALA HA   1  77 LEU QB   1.800 . 4.000 2.692 2.531 2.844     .  0 0 "[    .    1    .    2]" 1 
       1346 1  75 TRP HA   1  75 TRP HD1  1.800 . 5.000 3.170 2.902 3.451     .  0 0 "[    .    1    .    2]" 1 
       1347 1  75 TRP HA   1  78 LYS QB   1.800 . 4.000 3.050 2.808 3.239     .  0 0 "[    .    1    .    2]" 1 
       1348 1  75 TRP HA   1  78 LYS QG   1.800 . 6.000 4.792 3.806 5.252     .  0 0 "[    .    1    .    2]" 1 
       1349 1  75 TRP HA   1  78 LYS QD   1.800 . 6.000 4.562 3.645 5.657     .  0 0 "[    .    1    .    2]" 1 
       1350 1  75 TRP HA   1  79 VAL QG   1.800 . 6.000 3.566 3.091 4.263     .  0 0 "[    .    1    .    2]" 1 
       1351 1  75 TRP HD1  1  79 VAL QG   1.800 . 6.000 4.693 4.138 5.888     .  0 0 "[    .    1    .    2]" 1 
       1352 1  76 ALA HA   1  79 VAL HB   1.800 . 5.000 4.010 2.984 4.674     .  0 0 "[    .    1    .    2]" 1 
       1353 1  76 ALA HA   1  79 VAL MG1  1.800 . 6.000 3.715 1.891 4.520     .  0 0 "[    .    1    .    2]" 1 
       1354 1  76 ALA HA   1  79 VAL MG2  1.800 . 6.000 2.833 1.888 4.427     .  0 0 "[    .    1    .    2]" 1 
       1355 1  77 LEU QB   1  77 LEU MD1  1.800 . 4.000 2.079 1.943 2.265     .  0 0 "[    .    1    .    2]" 1 
       1356 1  77 LEU QB   1  77 LEU MD2  1.800 . 4.000 2.123 1.942 2.288     .  0 0 "[    .    1    .    2]" 1 
       1357 1  77 LEU HA   1  80 ALA MB   1.800 . 5.000 2.566 2.413 2.790     .  0 0 "[    .    1    .    2]" 1 
       1358 1  77 LEU QD   1  80 ALA MB   1.800 . 6.000 3.687 3.171 4.303     .  0 0 "[    .    1    .    2]" 1 
       1359 1  77 LEU HA   1  88 PRO HA   1.800 . 6.000 5.829 5.356 6.006 0.006  5 0 "[    .    1    .    2]" 1 
       1360 1  77 LEU QB   1  88 PRO QG   1.800 . 6.000 3.391 2.025 4.518     .  0 0 "[    .    1    .    2]" 1 
       1361 1  77 LEU MD1  1  88 PRO QB   1.800 . 6.000 3.210 2.108 4.858     .  0 0 "[    .    1    .    2]" 1 
       1362 1  77 LEU MD2  1  88 PRO QB   1.800 . 6.000 2.330 1.845 3.144     .  0 0 "[    .    1    .    2]" 1 
       1363 1  77 LEU QD   1  88 PRO QB   1.800 . 6.000 2.235 1.827 2.970     .  0 0 "[    .    1    .    2]" 1 
       1364 1  77 LEU QD   1  88 PRO HA   1.800 . 6.000 3.074 2.228 3.714     .  0 0 "[    .    1    .    2]" 1 
       1365 1  77 LEU QD   1  91 SER HA   1.800 . 6.000 3.763 3.396 4.152     .  0 0 "[    .    1    .    2]" 1 
       1366 1  77 LEU QD   1 107 TYR QD   1.800 . 6.000 3.905 3.204 4.504     .  0 0 "[    .    1    .    2]" 1 
       1367 1  77 LEU QD   1 107 TYR QE   1.800 . 6.000 2.538 1.946 3.251     .  0 0 "[    .    1    .    2]" 1 
       1368 1  77 LEU HA   1 111 PHE HZ   1.800 . 6.000 5.012 4.358 5.705     .  0 0 "[    .    1    .    2]" 1 
       1369 1  78 LYS HA   1  78 LYS QD   1.800 . 6.000 3.702 2.842 4.080     .  0 0 "[    .    1    .    2]" 1 
       1370 1  78 LYS QB   1  78 LYS QD   1.800 . 5.000 2.070 1.941 2.183     .  0 0 "[    .    1    .    2]" 1 
       1371 1  78 LYS QB   1  79 VAL HA   1.800 . 6.000 3.860 3.749 4.153     .  0 0 "[    .    1    .    2]" 1 
       1372 1  78 LYS QB   1  79 VAL QG   1.800 . 6.000 3.012 2.689 3.846     .  0 0 "[    .    1    .    2]" 1 
       1373 1  78 LYS HA   1  81 GLU QB   1.800 . 5.000 3.452 2.916 4.210     .  0 0 "[    .    1    .    2]" 1 
       1374 1  78 LYS QB   1  82 ASN QB   1.800 . 6.000 4.612 4.208 4.943     .  0 0 "[    .    1    .    2]" 1 
       1375 1  79 VAL HA   1  79 VAL QG   1.800 . 5.000 2.235 2.074 2.336     .  0 0 "[    .    1    .    2]" 1 
       1376 1  79 VAL QG   1  80 ALA HA   1.800 . 6.000 3.335 2.972 3.704     .  0 0 "[    .    1    .    2]" 1 
       1377 1  79 VAL HA   1  82 ASN HA   1.800 . 5.000 5.042 5.025 5.061 0.061  2 0 "[    .    1    .    2]" 1 
       1378 1  79 VAL HA   1  82 ASN QB   1.800 . 5.000 2.237 2.132 2.427     .  0 0 "[    .    1    .    2]" 1 
       1379 1  79 VAL HA   1  83 GLU QG   1.800 . 6.000 4.990 3.296 5.742     .  0 0 "[    .    1    .    2]" 1 
       1380 1  79 VAL HB   1  83 GLU QB   1.800 . 6.000 4.430 3.647 5.437     .  0 0 "[    .    1    .    2]" 1 
       1381 1  79 VAL MG1  1  83 GLU QG   1.800 . 6.000 4.256 1.857 5.765     .  0 0 "[    .    1    .    2]" 1 
       1382 1  79 VAL MG2  1  83 GLU QG   1.800 . 6.000 4.666 3.062 5.766     .  0 0 "[    .    1    .    2]" 1 
       1383 1  80 ALA HA   1  83 GLU QB   1.800 . 5.000 3.134 3.020 3.284     .  0 0 "[    .    1    .    2]" 1 
       1384 1  80 ALA HA   1  84 LEU QB   1.800 . 5.000 3.678 3.188 4.203     .  0 0 "[    .    1    .    2]" 1 
       1385 1  80 ALA HA   1  84 LEU QD   1.800 . 6.000 3.725 2.200 4.871     .  0 0 "[    .    1    .    2]" 1 
       1386 1  80 ALA MB   1  84 LEU QD   1.800 . 6.000 3.464 2.188 4.699     .  0 0 "[    .    1    .    2]" 1 
       1387 1  80 ALA MB   1  86 ILE HB   1.800 . 6.000 4.280 3.366 5.623     .  0 0 "[    .    1    .    2]" 1 
       1388 1  80 ALA MB   1  86 ILE MG   1.800 . 6.000 4.148 2.607 5.209     .  0 0 "[    .    1    .    2]" 1 
       1389 1  80 ALA MB   1  88 PRO QG   1.800 . 6.000 5.195 4.688 5.733     .  0 0 "[    .    1    .    2]" 1 
       1390 1  80 ALA MB   1 111 PHE QD   1.800 . 5.000 4.960 4.834 5.007 0.007 10 0 "[    .    1    .    2]" 1 
       1391 1  80 ALA MB   1 111 PHE HZ   1.800 . 5.000 2.456 1.976 3.232     .  0 0 "[    .    1    .    2]" 1 
       1392 1  81 GLU HA   1  84 LEU QB   1.800 . 5.000 3.568 3.308 3.840     .  0 0 "[    .    1    .    2]" 1 
       1393 1  81 GLU QB   1  87 THR HA   1.800 . 5.000 3.592 2.984 4.757     .  0 0 "[    .    1    .    2]" 1 
       1394 1  81 GLU HA   1  88 PRO QG   1.800 . 6.000 5.553 5.114 6.007 0.007 12 0 "[    .    1    .    2]" 1 
       1395 1  81 GLU QB   1  88 PRO HA   1.800 . 6.000 5.041 4.536 5.784     .  0 0 "[    .    1    .    2]" 1 
       1396 1  81 GLU QG   1  82 ASN HA   1.800 . 5.000 3.776 3.130 4.572     .  0 0 "[    .    1    .    2]" 1 
       1397 1  82 ASN HA   1  83 GLU QB   1.800 . 6.000 5.310 5.185 5.535     .  0 0 "[    .    1    .    2]" 1 
       1398 1  82 ASN QB   1  83 GLU QG   1.800 . 6.000 4.244 2.964 5.006     .  0 0 "[    .    1    .    2]" 1 
       1399 1  84 LEU HB3  1  84 LEU QD   1.800 . 4.000 2.102 1.955 2.315     .  0 0 "[    .    1    .    2]" 1 
       1400 1  84 LEU HB2  1  84 LEU QD   1.800 . 4.000 2.150 1.978 2.347     .  0 0 "[    .    1    .    2]" 1 
       1401 1  84 LEU QD   1  84 LEU HG   1.800 . 6.000 1.880 1.867 1.894     .  0 0 "[    .    1    .    2]" 1 
       1402 1  84 LEU HB2  1  86 ILE QG   1.800 . 6.000 3.238 2.000 4.112     .  0 0 "[    .    1    .    2]" 1 
       1403 1  84 LEU QD   1  86 ILE QG   1.800 . 6.000 2.763 1.907 3.351     .  0 0 "[    .    1    .    2]" 1 
       1404 1  84 LEU MD1  1  86 ILE MD   1.800 . 5.000 3.319 1.885 4.623     .  0 0 "[    .    1    .    2]" 1 
       1405 1  84 LEU MD2  1  86 ILE MD   1.800 . 6.000 3.096 1.797 5.455 0.003  3 0 "[    .    1    .    2]" 1 
       1406 1  84 LEU QD   1 111 PHE HZ   1.800 . 6.000 4.061 2.294 6.004 0.004 19 0 "[    .    1    .    2]" 1 
       1407 1  84 LEU QD   1 115 PHE HA   1.800 . 6.000 4.645 3.734 5.332     .  0 0 "[    .    1    .    2]" 1 
       1408 1  84 LEU QD   1 115 PHE HZ   1.800 . 5.000 3.591 1.969 4.511     .  0 0 "[    .    1    .    2]" 1 
       1409 1  86 ILE HA   1  86 ILE MD   1.800 . 5.000 3.242 1.975 3.930     .  0 0 "[    .    1    .    2]" 1 
       1410 1  86 ILE HB   1  86 ILE MD   1.800 . 6.000 2.526 1.988 3.230     .  0 0 "[    .    1    .    2]" 1 
       1411 1  86 ILE MD   1  86 ILE MG   1.800 . 6.000 2.234 1.798 2.929 0.002 11 0 "[    .    1    .    2]" 1 
       1412 1  86 ILE MG   1  88 PRO HA   1.800 . 6.000 4.201 4.032 4.402     .  0 0 "[    .    1    .    2]" 1 
       1413 1  86 ILE MG   1 107 TYR QD   1.800 . 6.000 4.552 3.730 5.365     .  0 0 "[    .    1    .    2]" 1 
       1414 1  86 ILE MG   1 107 TYR HE1  1.800 . 5.000 3.601 2.395 4.921     .  0 0 "[    .    1    .    2]" 1 
       1415 1  86 ILE MG   1 107 TYR HE2  1.800 . 5.000 4.654 3.990 5.005 0.005 20 0 "[    .    1    .    2]" 1 
       1416 1  86 ILE MD   1 111 PHE HA   1.800 . 5.000 3.141 2.187 4.055     .  0 0 "[    .    1    .    2]" 1 
       1417 1  86 ILE MG   1 110 HIS HB3  1.800 . 6.000 3.390 2.043 5.008     .  0 0 "[    .    1    .    2]" 1 
       1418 1  86 ILE MG   1 110 HIS HB2  1.800 . 6.000 4.480 3.249 6.002 0.002 15 0 "[    .    1    .    2]" 1 
       1419 1  86 ILE MD   1 111 PHE QD   1.800 . 5.000 3.285 1.972 4.509     .  0 0 "[    .    1    .    2]" 1 
       1420 1  86 ILE MD   1 111 PHE QE   1.800 . 5.000 3.319 2.294 4.694     .  0 0 "[    .    1    .    2]" 1 
       1421 1  86 ILE MD   1 114 ALA MB   1.800 . 4.000 2.812 1.834 3.479     .  0 0 "[    .    1    .    2]" 1 
       1422 1  86 ILE QG   1 114 ALA MB   1.800 . 6.000 3.860 3.066 5.255     .  0 0 "[    .    1    .    2]" 1 
       1423 1  87 THR HA   1  88 PRO QG   1.800 . 5.000 3.824 3.792 3.908     .  0 0 "[    .    1    .    2]" 1 
       1424 1  87 THR HA   1  88 PRO QD   1.800 . 4.000 1.915 1.882 2.000     .  0 0 "[    .    1    .    2]" 1 
       1425 1  87 THR HB   1  88 PRO QD   1.800 . 5.000 3.892 3.551 4.215     .  0 0 "[    .    1    .    2]" 1 
       1426 1  87 THR MG   1  88 PRO QB   1.800 . 6.000 4.509 3.615 5.478     .  0 0 "[    .    1    .    2]" 1 
       1427 1  87 THR MG   1  88 PRO QG   1.800 . 6.000 4.473 3.607 5.510     .  0 0 "[    .    1    .    2]" 1 
       1428 1  87 THR MG   1  88 PRO QD   1.800 . 6.000 2.902 1.921 4.154     .  0 0 "[    .    1    .    2]" 1 
       1429 1  87 THR HB   1  89 VAL QG   1.800 . 6.000 4.562 3.529 5.646     .  0 0 "[    .    1    .    2]" 1 
       1430 1  87 THR MG   1  89 VAL QG   1.800 . 5.000 3.620 2.877 4.725     .  0 0 "[    .    1    .    2]" 1 
       1431 1  88 PRO HA   1  89 VAL QG   1.800 . 6.000 3.363 3.214 3.577     .  0 0 "[    .    1    .    2]" 1 
       1432 1  88 PRO HA   1 107 TYR QD   1.800 . 6.000 3.951 3.007 4.803     .  0 0 "[    .    1    .    2]" 1 
       1433 1  88 PRO HA   1 107 TYR QE   1.800 . 5.000 2.316 1.991 2.705     .  0 0 "[    .    1    .    2]" 1 
       1434 1  89 VAL HA   1  89 VAL MG1  1.800 . 5.000 2.242 2.180 2.340     .  0 0 "[    .    1    .    2]" 1 
       1435 1  89 VAL HA   1  89 VAL MG2  1.800 . 5.000 2.459 2.375 2.510     .  0 0 "[    .    1    .    2]" 1 
       1436 1  89 VAL HB   1  90 VAL QG   1.800 . 6.000 3.003 2.441 4.042     .  0 0 "[    .    1    .    2]" 1 
       1437 1  89 VAL QG   1  90 VAL HA   1.800 . 6.000 4.074 3.971 4.143     .  0 0 "[    .    1    .    2]" 1 
       1438 1  89 VAL QG   1  90 VAL HB   1.800 . 6.000 4.616 3.406 5.359     .  0 0 "[    .    1    .    2]" 1 
       1439 1  89 VAL QG   1  90 VAL QG   1.800 . 5.000 2.999 2.299 3.968     .  0 0 "[    .    1    .    2]" 1 
       1440 1  89 VAL QG   1 106 ALA MB   1.800 . 5.000 2.602 1.799 3.463 0.001 13 0 "[    .    1    .    2]" 1 
       1441 1  89 VAL HB   1 107 TYR QB   1.800 . 6.000 3.122 2.237 3.897     .  0 0 "[    .    1    .    2]" 1 
       1442 1  89 VAL HB   1 107 TYR QD   1.800 . 6.000 2.517 1.987 3.683     .  0 0 "[    .    1    .    2]" 1 
       1443 1  89 VAL QG   1 107 TYR QB   1.800 . 5.000 3.515 2.932 4.087     .  0 0 "[    .    1    .    2]" 1 
       1444 1  89 VAL QG   1 107 TYR QD   1.800 . 4.000 2.402 1.841 3.123     .  0 0 "[    .    1    .    2]" 1 
       1445 1  89 VAL QG   1 107 TYR QE   1.800 . 4.000 3.000 1.944 4.001 0.001 15 0 "[    .    1    .    2]" 1 
       1446 1  90 VAL QG   1  92 ALA MB   1.800 . 6.000 5.082 4.666 5.366     .  0 0 "[    .    1    .    2]" 1 
       1447 1  90 VAL QG   1  94 ALA MB   1.800 . 6.000 2.724 1.849 3.980     .  0 0 "[    .    1    .    2]" 1 
       1448 1  90 VAL QG   1  95 VAL QG   1.800 . 6.000 2.277 1.829 3.076     .  0 0 "[    .    1    .    2]" 1 
       1449 1  90 VAL QG   1 100 ASP QB   1.800 . 6.000 2.971 2.123 3.746     .  0 0 "[    .    1    .    2]" 1 
       1450 1  90 VAL QG   1 103 GLY QA   1.800 . 6.000 2.237 1.826 3.175     .  0 0 "[    .    1    .    2]" 1 
       1451 1  90 VAL MG1  1 104 LEU HA   1.800 . 6.000 3.754 2.737 5.115     .  0 0 "[    .    1    .    2]" 1 
       1452 1  90 VAL MG2  1 104 LEU HA   1.800 . 6.000 3.810 3.136 4.687     .  0 0 "[    .    1    .    2]" 1 
       1453 1  90 VAL MG1  1 104 LEU QD   1.800 . 6.000 3.790 2.814 4.454     .  0 0 "[    .    1    .    2]" 1 
       1454 1  90 VAL MG2  1 104 LEU QD   1.800 . 6.000 3.817 2.404 4.821     .  0 0 "[    .    1    .    2]" 1 
       1455 1  90 VAL QG   1 104 LEU QD   1.800 . 5.000 3.340 2.350 3.973     .  0 0 "[    .    1    .    2]" 1 
       1456 1  90 VAL QG   1 107 TYR QB   1.800 . 6.000 2.636 2.024 3.648     .  0 0 "[    .    1    .    2]" 1 
       1457 1  90 VAL QG   1 107 TYR QD   1.800 . 6.000 3.077 2.135 4.552     .  0 0 "[    .    1    .    2]" 1 
       1458 1  91 SER HA   1  94 ALA MB   1.800 . 5.000 4.477 4.269 4.667     .  0 0 "[    .    1    .    2]" 1 
       1459 1  92 ALA HA   1  95 VAL HB   1.800 . 5.000 3.308 2.693 4.842     .  0 0 "[    .    1    .    2]" 1 
       1460 1  92 ALA HA   1  95 VAL MG1  1.800 . 6.000 3.837 1.907 4.408     .  0 0 "[    .    1    .    2]" 1 
       1461 1  92 ALA HA   1  95 VAL MG2  1.800 . 6.000 2.743 1.948 4.611     .  0 0 "[    .    1    .    2]" 1 
       1462 1  93 GLN HA   1  93 GLN QG   1.800 . 5.000 2.490 2.022 3.381     .  0 0 "[    .    1    .    2]" 1 
       1463 1  93 GLN QB   1  94 ALA MB   1.800 . 6.000 3.912 3.712 4.559     .  0 0 "[    .    1    .    2]" 1 
       1464 1  93 GLN HA   1  96 VAL HB   1.800 . 4.000 3.184 2.711 4.004 0.004 11 0 "[    .    1    .    2]" 1 
       1465 1  93 GLN HA   1  96 VAL QG   1.800 . 5.000 2.961 1.900 3.414     .  0 0 "[    .    1    .    2]" 1 
       1466 1  94 ALA HA   1  95 VAL QG   1.800 . 6.000 4.672 4.460 4.795     .  0 0 "[    .    1    .    2]" 1 
       1467 1  94 ALA HA   1  97 ALA MB   1.800 . 5.000 2.858 2.545 3.178     .  0 0 "[    .    1    .    2]" 1 
       1468 1  94 ALA HA   1 100 ASP QB   1.800 . 6.000 3.841 3.534 4.528     .  0 0 "[    .    1    .    2]" 1 
       1469 1  95 VAL HA   1  95 VAL MG1  1.800 . 5.000 2.419 2.196 3.207     .  0 0 "[    .    1    .    2]" 1 
       1470 1  95 VAL HA   1  95 VAL MG2  1.800 . 5.000 2.494 2.337 3.207     .  0 0 "[    .    1    .    2]" 1 
       1471 1  96 VAL QG   1  97 ALA HA   1.800 . 5.000 3.579 3.083 3.815     .  0 0 "[    .    1    .    2]" 1 
       1472 1  96 VAL QG   1  97 ALA MB   1.800 . 6.000 3.699 2.569 4.037     .  0 0 "[    .    1    .    2]" 1 
       1473 1  97 ALA MB   1  99 SER HA   1.800 . 6.000 4.558 4.271 4.695     .  0 0 "[    .    1    .    2]" 1 
       1474 1  97 ALA MB   1  99 SER QB   1.800 . 5.000 2.885 2.487 3.439     .  0 0 "[    .    1    .    2]" 1 
       1475 1  99 SER HA   1 101 PRO QD   1.800 . 6.000 3.317 3.008 3.684     .  0 0 "[    .    1    .    2]" 1 
       1476 1 100 ASP HA   1 101 PRO HD3  1.800 . 4.000 2.974 2.405 3.301     .  0 0 "[    .    1    .    2]" 1 
       1477 1 100 ASP HA   1 101 PRO HD2  1.800 . 4.000 2.234 2.005 2.617     .  0 0 "[    .    1    .    2]" 1 
       1478 1 100 ASP HA   1 101 PRO QD   1.800 . 3.000 2.142 1.975 2.375     .  0 0 "[    .    1    .    2]" 1 
       1479 1 100 ASP HA   1 102 LEU QB   1.800 . 6.000 4.454 4.294 4.737     .  0 0 "[    .    1    .    2]" 1 
       1480 1 100 ASP QB   1 102 LEU QB   1.800 . 6.000 4.890 4.277 5.368     .  0 0 "[    .    1    .    2]" 1 
       1481 1 101 PRO HA   1 101 PRO HD3  1.800 . 6.000 3.538 3.470 3.741     .  0 0 "[    .    1    .    2]" 1 
       1482 1 101 PRO HA   1 104 LEU HB3  1.800 . 5.000 3.779 2.994 4.574     .  0 0 "[    .    1    .    2]" 1 
       1483 1 101 PRO HA   1 104 LEU HB2  1.800 . 5.000 2.846 2.494 3.570     .  0 0 "[    .    1    .    2]" 1 
       1484 1 101 PRO HA   1 104 LEU QB   1.800 . 4.000 2.710 2.470 3.028     .  0 0 "[    .    1    .    2]" 1 
       1485 1 101 PRO HA   1 104 LEU MD1  1.800 . 5.000 3.704 1.966 5.006 0.006 17 0 "[    .    1    .    2]" 1 
       1486 1 101 PRO HA   1 104 LEU MD2  1.800 . 5.000 4.205 3.038 5.001 0.001  2 0 "[    .    1    .    2]" 1 
       1487 1 102 LEU QB   1 102 LEU QD   1.800 . 4.000 1.890 1.827 2.090     .  0 0 "[    .    1    .    2]" 1 
       1488 1 102 LEU HA   1 105 ILE HB   1.800 . 5.000 3.426 3.119 4.886     .  0 0 "[    .    1    .    2]" 1 
       1489 1 102 LEU HA   1 105 ILE MG   1.800 . 6.000 4.578 3.892 4.787     .  0 0 "[    .    1    .    2]" 1 
       1490 1 102 LEU HA   1 105 ILE MD   1.800 . 6.000 3.683 2.220 5.028     .  0 0 "[    .    1    .    2]" 1 
       1491 1 103 GLY QA   1 106 ALA MB   1.800 . 4.000 2.598 2.396 2.778     .  0 0 "[    .    1    .    2]" 1 
       1492 1 104 LEU HA   1 104 LEU QD   1.800 . 5.000 2.436 1.888 2.909     .  0 0 "[    .    1    .    2]" 1 
       1493 1 104 LEU QB   1 104 LEU QD   1.800 . 4.000 1.891 1.799 2.047 0.001  8 0 "[    .    1    .    2]" 1 
       1494 1 104 LEU HA   1 107 TYR HB3  1.800 . 5.000 3.348 2.847 3.847     .  0 0 "[    .    1    .    2]" 1 
       1495 1 104 LEU HA   1 107 TYR HB2  1.800 . 5.000 3.578 3.033 3.969     .  0 0 "[    .    1    .    2]" 1 
       1496 1 104 LEU HA   1 107 TYR QB   1.800 . 4.000 3.035 2.757 3.404     .  0 0 "[    .    1    .    2]" 1 
       1497 1 104 LEU QB   1 108 LEU QD   1.800 . 6.000 3.669 2.854 4.420     .  0 0 "[    .    1    .    2]" 1 
       1498 1 104 LEU QD   1 108 LEU QD   1.800 . 6.000 2.878 2.117 4.213     .  0 0 "[    .    1    .    2]" 1 
       1499 1 105 ILE HA   1 106 ALA HA   1.800 . 6.000 4.810 4.772 4.848     .  0 0 "[    .    1    .    2]" 1 
       1500 1 105 ILE MG   1 106 ALA HA   1.800 . 6.000 3.749 3.539 5.408     .  0 0 "[    .    1    .    2]" 1 
       1501 1 105 ILE MG   1 106 ALA MB   1.800 . 6.000 4.315 4.180 5.087     .  0 0 "[    .    1    .    2]" 1 
       1502 1 105 ILE HA   1 108 LEU QB   1.800 . 4.000 2.633 2.316 3.043     .  0 0 "[    .    1    .    2]" 1 
       1503 1 105 ILE MG   1 108 LEU QD   1.800 . 6.000 4.092 3.277 4.968     .  0 0 "[    .    1    .    2]" 1 
       1504 1 106 ALA MB   1 107 TYR QB   1.800 . 6.000 3.768 3.629 3.897     .  0 0 "[    .    1    .    2]" 1 
       1505 1 106 ALA HA   1 109 SER QB   1.800 . 4.000 2.930 2.608 3.277     .  0 0 "[    .    1    .    2]" 1 
       1506 1 107 TYR HA   1 107 TYR QD   1.800 . 4.000 2.424 1.974 3.162     .  0 0 "[    .    1    .    2]" 1 
       1507 1 107 TYR HA   1 107 TYR QE   1.800 . 6.000 4.360 4.116 4.732     .  0 0 "[    .    1    .    2]" 1 
       1508 1 107 TYR HA   1 110 HIS HB3  1.800 . 5.000 3.992 3.481 4.731     .  0 0 "[    .    1    .    2]" 1 
       1509 1 107 TYR HA   1 110 HIS HB2  1.800 . 5.000 3.134 2.724 3.531     .  0 0 "[    .    1    .    2]" 1 
       1510 1 107 TYR HA   1 110 HIS QB   1.800 . 4.000 2.993 2.684 3.210     .  0 0 "[    .    1    .    2]" 1 
       1511 1 108 LEU HA   1 108 LEU QD   1.800 . 6.000 2.376 1.859 2.929     .  0 0 "[    .    1    .    2]" 1 
       1512 1 108 LEU HA   1 111 PHE QB   1.800 . 4.000 2.631 2.389 2.786     .  0 0 "[    .    1    .    2]" 1 
       1513 1 108 LEU HA   1 111 PHE QD   1.800 . 5.000 3.896 2.322 4.774     .  0 0 "[    .    1    .    2]" 1 
       1514 1 109 SER HA   1 112 HIS QB   1.800 . 4.000 2.777 2.518 2.970     .  0 0 "[    .    1    .    2]" 1 
       1515 1 111 PHE HA   1 111 PHE HE1  1.800 . 6.000 4.578 4.226 5.081     .  0 0 "[    .    1    .    2]" 1 
       1516 1 111 PHE HA   1 111 PHE HE2  1.800 . 6.000 5.420 5.025 5.815     .  0 0 "[    .    1    .    2]" 1 
       1517 1 111 PHE HA   1 115 PHE QD   1.800 . 5.000 3.593 2.781 4.582     .  0 0 "[    .    1    .    2]" 1 
       1518 1 112 HIS HA   1 112 HIS HD2  1.800 . 4.000 2.958 2.272 3.885     .  0 0 "[    .    1    .    2]" 1 
       1519 1 112 HIS HA   1 115 PHE QB   1.800 . 4.000 2.610 2.216 3.307     .  0 0 "[    .    1    .    2]" 1 
       1520 1 112 HIS HA   1 115 PHE QD   1.800 . 6.000 4.148 3.008 4.544     .  0 0 "[    .    1    .    2]" 1 
       1521 1 113 SER HA   1 116 LYS QB   1.800 . 4.000 2.803 2.192 3.257     .  0 0 "[    .    1    .    2]" 1 
       1522 1 114 ALA MB   1 115 PHE QD   1.800 . 6.000 2.658 2.283 3.293     .  0 0 "[    .    1    .    2]" 1 
       1523 1 114 ALA MB   1 116 LYS QB   1.800 . 6.000 5.367 5.121 5.667     .  0 0 "[    .    1    .    2]" 1 
       1524 1 115 PHE HA   1 115 PHE QD   1.800 . 4.000 2.560 2.058 2.834     .  0 0 "[    .    1    .    2]" 1 
       1525 1 115 PHE HA   1 115 PHE QE   1.800 . 6.000 4.415 4.344 4.604     .  0 0 "[    .    1    .    2]" 1 
       1526 1 115 PHE HA   1 118 MET QB   1.800 . 4.000 3.265 2.340 3.959     .  0 0 "[    .    1    .    2]" 1 
       1527 1 115 PHE HA   1 116 LYS HA   1.800 . 6.000 4.778 4.657 4.871     .  0 0 "[    .    1    .    2]" 1 
       1528 1 115 PHE QB   1 116 LYS HA   1.800 . 6.000 3.918 3.840 4.110     .  0 0 "[    .    1    .    2]" 1 
       1529 1 116 LYS HA   1 116 LYS HG3  1.800 . 4.000 2.863 2.047 3.563     .  0 0 "[    .    1    .    2]" 1 
       1530 1 116 LYS HA   1 116 LYS HG2  1.800 . 4.000 2.786 2.189 3.763     .  0 0 "[    .    1    .    2]" 1 
       1531 1 116 LYS QE   1 116 LYS HG3  1.800 . 5.000 2.460 1.978 3.304     .  0 0 "[    .    1    .    2]" 1 
       1532 1 116 LYS QE   1 116 LYS HG2  1.800 . 5.000 2.639 2.017 3.483     .  0 0 "[    .    1    .    2]" 1 
       1533 1 118 MET HA   1 118 MET QG   1.800 . 5.000 2.264 2.055 2.907     .  0 0 "[    .    1    .    2]" 1 
    stop_

save_


save_distance_constraint_statistics_2
    _Distance_constraint_stats_list.Sf_category                   distance_constraint_statistics
    _Distance_constraint_stats_list.Constraint_list_ID            2
    _Distance_constraint_stats_list.Constraint_count              81
    _Distance_constraint_stats_list.Viol_count                    285
    _Distance_constraint_stats_list.Viol_total                    35.314
    _Distance_constraint_stats_list.Viol_max                      0.031
    _Distance_constraint_stats_list.Viol_rms                      0.0033
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0011
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0062
    _Distance_constraint_stats_list.Cutoff_violation_report       0.500
    _Distance_constraint_stats_list.Details                       .

    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  16 GLU 0.003 0.003 20 0 "[    .    1    .    2]" 
       1  17 GLU 0.106 0.015 18 0 "[    .    1    .    2]" 
       1  18 LEU 0.000 0.000 13 0 "[    .    1    .    2]" 
       1  19 LEU 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  20 ARG 0.010 0.003 20 0 "[    .    1    .    2]" 
       1  21 TRP 0.106 0.015 18 0 "[    .    1    .    2]" 
       1  22 CYS 0.002 0.001 18 0 "[    .    1    .    2]" 
       1  23 GLN 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  24 GLU 0.007 0.003  7 0 "[    .    1    .    2]" 
       1  25 GLN 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  26 THR 0.001 0.001 18 0 "[    .    1    .    2]" 
       1  29 TYR 0.059 0.022  1 0 "[    .    1    .    2]" 
       1  32 VAL 0.059 0.022  1 0 "[    .    1    .    2]" 
       1  36 ASP 0.037 0.011 16 0 "[    .    1    .    2]" 
       1  38 SER 0.002 0.002 13 0 "[    .    1    .    2]" 
       1  39 SER 0.093 0.014 19 0 "[    .    1    .    2]" 
       1  41 TRP 0.144 0.012 11 0 "[    .    1    .    2]" 
       1  42 ALA 0.093 0.014 19 0 "[    .    1    .    2]" 
       1  43 ASP 0.004 0.004  8 0 "[    .    1    .    2]" 
       1  44 GLY 0.125 0.013 17 0 "[    .    1    .    2]" 
       1  45 LEU 0.035 0.006 16 0 "[    .    1    .    2]" 
       1  46 ALA 0.150 0.017 19 0 "[    .    1    .    2]" 
       1  47 LEU 0.086 0.016 17 0 "[    .    1    .    2]" 
       1  48 CYS 0.058 0.013 17 0 "[    .    1    .    2]" 
       1  49 ALA 0.031 0.006 16 0 "[    .    1    .    2]" 
       1  50 LEU 0.328 0.017 19 0 "[    .    1    .    2]" 
       1  51 VAL 0.086 0.016 17 0 "[    .    1    .    2]" 
       1  52 TYR 0.039 0.009  2 0 "[    .    1    .    2]" 
       1  54 LEU 0.178 0.016 16 0 "[    .    1    .    2]" 
       1  60 GLU 0.358 0.031 10 0 "[    .    1    .    2]" 
       1  63 GLU 0.358 0.031 10 0 "[    .    1    .    2]" 
       1  68 GLY 0.041 0.007 11 0 "[    .    1    .    2]" 
       1  69 ALA 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  70 LEU 0.019 0.009  2 0 "[    .    1    .    2]" 
       1  71 GLU 0.000 0.000  3 0 "[    .    1    .    2]" 
       1  72 ALA 0.041 0.007 11 0 "[    .    1    .    2]" 
       1  73 THR 0.017 0.005 11 0 "[    .    1    .    2]" 
       1  74 ALA 0.019 0.009  2 0 "[    .    1    .    2]" 
       1  75 TRP 0.000 0.000  3 0 "[    .    1    .    2]" 
       1  76 ALA 0.128 0.016 15 0 "[    .    1    .    2]" 
       1  77 LEU 0.025 0.005 11 0 "[    .    1    .    2]" 
       1  78 LYS 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  79 VAL 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  80 ALA 0.193 0.021 19 0 "[    .    1    .    2]" 
       1  81 GLU 0.009 0.005  2 0 "[    .    1    .    2]" 
       1  84 LEU 0.065 0.021 19 0 "[    .    1    .    2]" 
       1  91 SER 0.025 0.006  2 0 "[    .    1    .    2]" 
       1  92 ALA 0.014 0.007 18 0 "[    .    1    .    2]" 
       1  93 GLN 0.000 0.000 16 0 "[    .    1    .    2]" 
       1  95 VAL 0.025 0.006  2 0 "[    .    1    .    2]" 
       1  96 VAL 0.014 0.007 18 0 "[    .    1    .    2]" 
       1  97 ALA 0.000 0.000 16 0 "[    .    1    .    2]" 
       1 100 ASP 0.044 0.008 18 0 "[    .    1    .    2]" 
       1 101 PRO 0.047 0.010 19 0 "[    .    1    .    2]" 
       1 102 LEU 0.036 0.014 17 0 "[    .    1    .    2]" 
       1 103 GLY 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 104 LEU 0.064 0.012 17 0 "[    .    1    .    2]" 
       1 105 ILE 0.047 0.010 19 0 "[    .    1    .    2]" 
       1 106 ALA 0.036 0.014 17 0 "[    .    1    .    2]" 
       1 107 TYR 0.021 0.011  1 0 "[    .    1    .    2]" 
       1 108 LEU 0.021 0.012 17 0 "[    .    1    .    2]" 
       1 109 SER 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 111 PHE 0.021 0.011  1 0 "[    .    1    .    2]" 
    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  16 GLU O   1  20 ARG N   2.700 2.600 3.200 3.103 2.879 3.203 0.003 20 0 "[    .    1    .    2]" 2 
        2 1  17 GLU O   1  21 TRP H   1.800     . 2.300 2.295 2.239 2.315 0.015 18 0 "[    .    1    .    2]" 2 
        3 1  17 GLU O   1  21 TRP N   2.700 2.600 3.200 3.189 3.151 3.210 0.010  3 0 "[    .    1    .    2]" 2 
        4 1  18 LEU O   1  22 CYS H   1.800     . 2.300 2.160 2.018 2.300 0.000 13 0 "[    .    1    .    2]" 2 
        5 1  18 LEU O   1  22 CYS N   2.700 2.600 3.200 3.088 2.898 3.193     .  0 0 "[    .    1    .    2]" 2 
        6 1  19 LEU O   1  23 GLN H   1.800     . 2.300 2.021 1.824 2.229     .  0 0 "[    .    1    .    2]" 2 
        7 1  19 LEU O   1  23 GLN N   2.700 2.600 3.200 2.976 2.775 3.184     .  0 0 "[    .    1    .    2]" 2 
        8 1  20 ARG O   1  24 GLU H   1.800     . 2.300 2.148 1.952 2.303 0.003  7 0 "[    .    1    .    2]" 2 
        9 1  20 ARG O   1  24 GLU N   2.700 2.600 3.200 3.033 2.778 3.195     .  0 0 "[    .    1    .    2]" 2 
       10 1  21 TRP O   1  25 GLN H   1.800     . 2.300 2.072 1.889 2.259     .  0 0 "[    .    1    .    2]" 2 
       11 1  21 TRP O   1  25 GLN N   2.700 2.600 3.200 3.016 2.845 3.196     .  0 0 "[    .    1    .    2]" 2 
       12 1  22 CYS O   1  26 THR H   1.800     . 2.300 2.027 1.799 2.219 0.001 18 0 "[    .    1    .    2]" 2 
       13 1  22 CYS O   1  26 THR N   2.700 2.600 3.200 2.869 2.613 3.090     .  0 0 "[    .    1    .    2]" 2 
       14 1  29 TYR O   1  32 VAL H   2.000     . 2.700 2.545 1.974 2.722 0.022  1 0 "[    .    1    .    2]" 2 
       15 1  29 TYR O   1  32 VAL N   3.000 2.800 3.500 3.321 2.939 3.498     .  0 0 "[    .    1    .    2]" 2 
       16 1  38 SER O   1  41 TRP H   1.800     . 2.300 2.105 1.900 2.302 0.002 13 0 "[    .    1    .    2]" 2 
       17 1  38 SER O   1  41 TRP N   2.700 2.600 3.200 2.954 2.770 3.181     .  0 0 "[    .    1    .    2]" 2 
       18 1  36 ASP O   1  41 TRP HE1 2.000     . 2.700 2.545 2.174 2.711 0.011 16 0 "[    .    1    .    2]" 2 
       19 1  36 ASP O   1  41 TRP NE1 3.000 2.800 3.500 3.207 2.798 3.425 0.002  9 0 "[    .    1    .    2]" 2 
       20 1  39 SER O   1  42 ALA H   1.800     . 2.300 1.981 1.786 2.300 0.014 19 0 "[    .    1    .    2]" 2 
       21 1  39 SER O   1  42 ALA N   2.700 2.600 3.200 2.903 2.691 3.206 0.006 11 0 "[    .    1    .    2]" 2 
       22 1  41 TRP O   1  44 GLY H   1.800     . 2.300 2.305 2.298 2.312 0.012 11 0 "[    .    1    .    2]" 2 
       23 1  41 TRP O   1  44 GLY N   2.700 2.600 3.200 3.093 3.008 3.182     .  0 0 "[    .    1    .    2]" 2 
       24 1  43 ASP OD1 1  45 LEU H   1.800     . 2.300 2.173 1.894 2.304 0.004  8 0 "[    .    1    .    2]" 2 
       25 1  43 ASP OD1 1  45 LEU N   2.700 2.600 3.200 2.917 2.791 3.043     .  0 0 "[    .    1    .    2]" 2 
       26 1  44 GLY O   1  48 CYS H   1.800     . 2.300 2.191 2.023 2.278     .  0 0 "[    .    1    .    2]" 2 
       27 1  44 GLY O   1  48 CYS N   2.700 2.600 3.200 3.104 2.965 3.213 0.013 17 0 "[    .    1    .    2]" 2 
       28 1  45 LEU O   1  49 ALA H   1.800     . 2.300 1.834 1.794 1.983 0.006 16 0 "[    .    1    .    2]" 2 
       29 1  45 LEU O   1  49 ALA N   2.700 2.600 3.200 2.725 2.633 2.800     .  0 0 "[    .    1    .    2]" 2 
       30 1  46 ALA O   1  50 LEU H   1.800     . 2.300 2.265 2.051 2.314 0.014  9 0 "[    .    1    .    2]" 2 
       31 1  46 ALA O   1  50 LEU N   2.700 2.600 3.200 3.179 3.009 3.217 0.017 19 0 "[    .    1    .    2]" 2 
       32 1  47 LEU O   1  51 VAL H   1.800     . 2.300 2.216 2.069 2.247     .  0 0 "[    .    1    .    2]" 2 
       33 1  47 LEU O   1  51 VAL N   2.700 2.600 3.200 3.189 3.045 3.216 0.016 17 0 "[    .    1    .    2]" 2 
       34 1  48 CYS O   1  52 TYR H   1.800     . 2.300 1.855 1.791 1.994 0.009  2 0 "[    .    1    .    2]" 2 
       35 1  48 CYS O   1  52 TYR N   2.700 2.600 3.200 2.802 2.695 2.912     .  0 0 "[    .    1    .    2]" 2 
       36 1  50 LEU O   1  54 LEU H   1.800     . 2.300 2.298 2.247 2.309 0.009 17 0 "[    .    1    .    2]" 2 
       37 1  50 LEU O   1  54 LEU N   2.700 2.600 3.200 3.198 3.083 3.216 0.016 16 0 "[    .    1    .    2]" 2 
       38 1  60 GLU O   1  63 GLU H   1.800     . 2.300 2.318 2.303 2.331 0.031 10 0 "[    .    1    .    2]" 2 
       39 1  60 GLU O   1  63 GLU N   2.700 2.600 3.200 3.085 2.984 3.203 0.003  9 0 "[    .    1    .    2]" 2 
       40 1  68 GLY O   1  72 ALA H   1.800     . 2.300 2.217 1.797 2.307 0.007 11 0 "[    .    1    .    2]" 2 
       41 1  68 GLY O   1  72 ALA N   2.700 2.600 3.200 3.082 2.712 3.198     .  0 0 "[    .    1    .    2]" 2 
       42 1  69 ALA O   1  73 THR H   1.800     . 2.300 2.020 1.875 2.244     .  0 0 "[    .    1    .    2]" 2 
       43 1  69 ALA O   1  73 THR N   2.700 2.600 3.200 2.972 2.828 3.196     .  0 0 "[    .    1    .    2]" 2 
       44 1  70 LEU O   1  74 ALA H   1.800     . 2.300 1.902 1.791 2.147 0.009  2 0 "[    .    1    .    2]" 2 
       45 1  70 LEU O   1  74 ALA N   2.700 2.600 3.200 2.854 2.736 3.112     .  0 0 "[    .    1    .    2]" 2 
       46 1  71 GLU O   1  75 TRP H   1.800     . 2.300 1.911 1.800 2.057     .  3 0 "[    .    1    .    2]" 2 
       47 1  71 GLU O   1  75 TRP N   2.700 2.600 3.200 2.826 2.694 2.968     .  0 0 "[    .    1    .    2]" 2 
       48 1  72 ALA O   1  76 ALA H   1.800     . 2.300 1.929 1.818 2.078     .  0 0 "[    .    1    .    2]" 2 
       49 1  72 ALA O   1  76 ALA N   2.700 2.600 3.200 2.835 2.754 2.935     .  0 0 "[    .    1    .    2]" 2 
       50 1  73 THR O   1  77 LEU H   1.800     . 2.300 1.855 1.795 1.942 0.005 11 0 "[    .    1    .    2]" 2 
       51 1  73 THR O   1  77 LEU N   2.700 2.600 3.200 2.759 2.689 2.831     .  0 0 "[    .    1    .    2]" 2 
       52 1  74 ALA O   1  78 LYS H   1.800     . 2.300 2.097 1.972 2.251     .  0 0 "[    .    1    .    2]" 2 
       53 1  74 ALA O   1  78 LYS N   2.700 2.600 3.200 3.025 2.903 3.147     .  0 0 "[    .    1    .    2]" 2 
       54 1  75 TRP O   1  79 VAL H   1.800     . 2.300 2.024 1.837 2.183     .  0 0 "[    .    1    .    2]" 2 
       55 1  75 TRP O   1  79 VAL N   2.700 2.600 3.200 2.985 2.792 3.142     .  0 0 "[    .    1    .    2]" 2 
       56 1  76 ALA O   1  80 ALA H   1.800     . 2.300 1.802 1.784 1.939 0.016 15 0 "[    .    1    .    2]" 2 
       57 1  76 ALA O   1  80 ALA N   2.700 2.600 3.200 2.678 2.651 2.805     .  0 0 "[    .    1    .    2]" 2 
       58 1  77 LEU O   1  81 GLU H   1.800     . 2.300 2.226 2.068 2.305 0.005  2 0 "[    .    1    .    2]" 2 
       59 1  77 LEU O   1  81 GLU N   2.700 2.600 3.200 3.142 2.995 3.203 0.003 15 0 "[    .    1    .    2]" 2 
       60 1  80 ALA O   1  84 LEU H   1.800     . 2.300 1.809 1.779 1.860 0.021 19 0 "[    .    1    .    2]" 2 
       61 1  80 ALA O   1  84 LEU N   2.700 2.600 3.200 2.705 2.641 2.775     .  0 0 "[    .    1    .    2]" 2 
       62 1  91 SER O   1  95 VAL H   1.800     . 2.300 2.213 2.046 2.297     .  0 0 "[    .    1    .    2]" 2 
       63 1  91 SER O   1  95 VAL N   2.700 2.600 3.200 3.145 2.963 3.206 0.006  2 0 "[    .    1    .    2]" 2 
       64 1  92 ALA O   1  96 VAL H   1.800     . 2.300 1.904 1.793 2.155 0.007 18 0 "[    .    1    .    2]" 2 
       65 1  92 ALA O   1  96 VAL N   2.700 2.600 3.200 2.874 2.754 3.100     .  0 0 "[    .    1    .    2]" 2 
       66 1  93 GLN O   1  97 ALA H   1.800     . 2.300 2.132 1.801 2.300     . 16 0 "[    .    1    .    2]" 2 
       67 1  93 GLN O   1  97 ALA N   2.700 2.600 3.200 2.962 2.715 3.132     .  0 0 "[    .    1    .    2]" 2 
       68 1 100 ASP O   1 104 LEU H   1.800     . 2.300 2.193 1.917 2.306 0.006  9 0 "[    .    1    .    2]" 2 
       69 1 100 ASP O   1 104 LEU N   2.700 2.600 3.200 3.105 2.847 3.208 0.008 18 0 "[    .    1    .    2]" 2 
       70 1 101 PRO O   1 105 ILE H   1.800     . 2.300 2.196 2.012 2.284     .  0 0 "[    .    1    .    2]" 2 
       71 1 101 PRO O   1 105 ILE N   2.700 2.600 3.200 3.140 2.975 3.210 0.010 19 0 "[    .    1    .    2]" 2 
       72 1 102 LEU O   1 106 ALA H   1.800     . 2.300 2.235 2.050 2.300 0.000  2 0 "[    .    1    .    2]" 2 
       73 1 102 LEU O   1 106 ALA N   2.700 2.600 3.200 3.160 2.964 3.214 0.014 17 0 "[    .    1    .    2]" 2 
       74 1 103 GLY O   1 107 TYR H   1.800     . 2.300 2.055 1.840 2.299     .  0 0 "[    .    1    .    2]" 2 
       75 1 103 GLY O   1 107 TYR N   2.700 2.600 3.200 2.981 2.770 3.180     .  0 0 "[    .    1    .    2]" 2 
       76 1 104 LEU O   1 108 LEU H   1.800     . 2.300 2.082 1.882 2.277     .  0 0 "[    .    1    .    2]" 2 
       77 1 104 LEU O   1 108 LEU N   2.700 2.600 3.200 3.014 2.831 3.212 0.012 17 0 "[    .    1    .    2]" 2 
       78 1 105 ILE O   1 109 SER H   1.800     . 2.300 2.145 1.911 2.288     .  0 0 "[    .    1    .    2]" 2 
       79 1 105 ILE O   1 109 SER N   2.700 2.600 3.200 3.013 2.771 3.192     .  0 0 "[    .    1    .    2]" 2 
       80 1 107 TYR O   1 111 PHE H   1.800     . 2.300 2.175 2.026 2.289     .  0 0 "[    .    1    .    2]" 2 
       81 1 107 TYR O   1 111 PHE N   2.700 2.600 3.200 3.125 2.984 3.211 0.011  1 0 "[    .    1    .    2]" 2 
    stop_

save_



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