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
582508 2mhm 19638 cing 4-filtered-FRED Wattos check violation distance


data_2mhm


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              1169
    _Distance_constraint_stats_list.Viol_count                    2129
    _Distance_constraint_stats_list.Viol_total                    2898.469
    _Distance_constraint_stats_list.Viol_max                      1.299
    _Distance_constraint_stats_list.Viol_rms                      0.0425
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0062
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0681
    _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   1 THR  0.000 0.000  .  0 "[    .    1    .    2]" 
       1   2 GLU  0.439 0.361 20  0 "[    .    1    .    2]" 
       1   3 PHE 27.166 1.299  3 20  [**+*******-*********]  
       1   4 LYS  1.185 0.119  3  0 "[    .    1    .    2]" 
       1   6 GLY  0.076 0.071 11  0 "[    .    1    .    2]" 
       1   7 SER  0.251 0.108 11  0 "[    .    1    .    2]" 
       1   8 ALA  1.317 0.129 17  0 "[    .    1    .    2]" 
       1   9 LYS  0.406 0.060 10  0 "[    .    1    .    2]" 
       1  10 LYS  0.350 0.095 19  0 "[    .    1    .    2]" 
       1  11 GLY  2.964 0.223 17  0 "[    .    1    .    2]" 
       1  12 ALA  1.688 0.080 12  0 "[    .    1    .    2]" 
       1  13 THR  6.517 0.242  5  0 "[    .    1    .    2]" 
       1  14 LEU  2.550 0.104  2  0 "[    .    1    .    2]" 
       1  15 PHE  2.585 0.116 17  0 "[    .    1    .    2]" 
       1  16 LYS  3.400 0.136 17  0 "[    .    1    .    2]" 
       1  17 THR  0.932 0.059  2  0 "[    .    1    .    2]" 
       1  18 ARG  2.400 0.104  2  0 "[    .    1    .    2]" 
       1  19 CYS  2.201 0.083  8  0 "[    .    1    .    2]" 
       1  20 LEU  3.872 0.116 17  0 "[    .    1    .    2]" 
       1  21 GLN  0.467 0.054  8  0 "[    .    1    .    2]" 
       1  22 CYS  0.547 0.057  4  0 "[    .    1    .    2]" 
       1  23 HIS  2.269 0.122  5  0 "[    .    1    .    2]" 
       1  24 THR  0.805 0.099 12  0 "[    .    1    .    2]" 
       1  25 VAL  0.998 0.081  8  0 "[    .    1    .    2]" 
       1  26 GLU  0.085 0.023 11  0 "[    .    1    .    2]" 
       1  27 LYS  0.838 0.146 19  0 "[    .    1    .    2]" 
       1  28 GLY  0.941 0.146 19  0 "[    .    1    .    2]" 
       1  29 GLY  0.572 0.052 18  0 "[    .    1    .    2]" 
       1  30 PRO  2.002 0.132  1  0 "[    .    1    .    2]" 
       1  31 HIS  3.845 0.132  1  0 "[    .    1    .    2]" 
       1  32 LYS  1.243 0.115  8  0 "[    .    1    .    2]" 
       1  33 VAL  0.202 0.085 12  0 "[    .    1    .    2]" 
       1  34 GLY  0.143 0.057  4  0 "[    .    1    .    2]" 
       1  35 PRO  0.450 0.155  5  0 "[    .    1    .    2]" 
       1  36 ASN  3.252 0.155  5  0 "[    .    1    .    2]" 
       1  37 LEU  0.606 0.092 17  0 "[    .    1    .    2]" 
       1  38 HIS  1.182 0.091  4  0 "[    .    1    .    2]" 
       1  39 GLY  0.029 0.029  9  0 "[    .    1    .    2]" 
       1  40 ILE  0.545 0.092 17  0 "[    .    1    .    2]" 
       1  41 PHE  3.830 0.097 13  0 "[    .    1    .    2]" 
       1  42 GLY  0.000 0.000  .  0 "[    .    1    .    2]" 
       1  43 ARG  1.524 0.092 16  0 "[    .    1    .    2]" 
       1  44 HIS  1.652 0.087 12  0 "[    .    1    .    2]" 
       1  45 SER  0.190 0.043  9  0 "[    .    1    .    2]" 
       1  46 GLY  2.117 0.091 12  0 "[    .    1    .    2]" 
       1  47 GLN  1.000 0.154 17  0 "[    .    1    .    2]" 
       1  48 ALA  1.650 0.205  2  0 "[    .    1    .    2]" 
       1  49 GLU  1.678 0.205  2  0 "[    .    1    .    2]" 
       1  50 GLY  0.000 0.000 19  0 "[    .    1    .    2]" 
       1  51 TYR  1.845 0.111  8  0 "[    .    1    .    2]" 
       1  53 TYR  0.360 0.111 16  0 "[    .    1    .    2]" 
       1  54 THR  0.150 0.033 20  0 "[    .    1    .    2]" 
       1  55 ASP  2.412 0.121 16  0 "[    .    1    .    2]" 
       1  56 ALA  0.081 0.031 18  0 "[    .    1    .    2]" 
       1  57 ASN  5.308 0.132 12  0 "[    .    1    .    2]" 
       1  58 ILE  6.033 0.252 12  0 "[    .    1    .    2]" 
       1  59 LYS  0.087 0.069 20  0 "[    .    1    .    2]" 
       1  60 LYS  1.704 0.202 13  0 "[    .    1    .    2]" 
       1  61 ASN  0.091 0.022 16  0 "[    .    1    .    2]" 
       1  62 VAL  1.526 0.110 16  0 "[    .    1    .    2]" 
       1  63 LEU  2.324 0.197 19  0 "[    .    1    .    2]" 
       1  64 TRP  4.800 0.190 17  0 "[    .    1    .    2]" 
       1  65 ASP  2.124 0.197 19  0 "[    .    1    .    2]" 
       1  66 GLU  0.449 0.117 13  0 "[    .    1    .    2]" 
       1  67 ASN  1.601 0.096  1  0 "[    .    1    .    2]" 
       1  68 ASN  3.109 0.117 13  0 "[    .    1    .    2]" 
       1  69 MET  6.747 0.190 17  0 "[    .    1    .    2]" 
       1  70 SER  1.883 0.107  4  0 "[    .    1    .    2]" 
       1  71 GLU  1.353 0.104 14  0 "[    .    1    .    2]" 
       1  72 HIS  4.696 0.136  4  0 "[    .    1    .    2]" 
       1  73 LEU  6.119 0.154 11  0 "[    .    1    .    2]" 
       1  74 THR  1.461 0.076 15  0 "[    .    1    .    2]" 
       1  75 ASN  3.159 0.151  6  0 "[    .    1    .    2]" 
       1  76 PRO  2.486 0.154 11  0 "[    .    1    .    2]" 
       1  77 ALA  0.083 0.083 18  0 "[    .    1    .    2]" 
       1  78 LYS  0.518 0.091 17  0 "[    .    1    .    2]" 
       1  79 TYR  6.301 0.136  4  0 "[    .    1    .    2]" 
       1  80 ILE  2.722 0.202 13  0 "[    .    1    .    2]" 
       1  81 PRO  1.775 0.155 19  0 "[    .    1    .    2]" 
       1  82 GLY  1.229 0.080 18  0 "[    .    1    .    2]" 
       1  83 THR  1.139 0.097 15  0 "[    .    1    .    2]" 
       1  84 LYS  1.101 0.151 13  0 "[    .    1    .    2]" 
       1  85 MET  0.022 0.022 15  0 "[    .    1    .    2]" 
       1  86 ALA  2.055 0.195 17  0 "[    .    1    .    2]" 
       1  87 PHE  4.530 0.195 17  0 "[    .    1    .    2]" 
       1  88 GLY  0.266 0.048  8  0 "[    .    1    .    2]" 
       1  89 GLY  0.954 0.096  7  0 "[    .    1    .    2]" 
       1  90 LEU  0.472 0.091 20  0 "[    .    1    .    2]" 
       1  91 LYS  1.160 0.189 17  0 "[    .    1    .    2]" 
       1  92 LYS  2.933 0.189 17  0 "[    .    1    .    2]" 
       1  93 GLU  1.685 0.120 18  0 "[    .    1    .    2]" 
       1  94 LYS  0.518 0.152 17  0 "[    .    1    .    2]" 
       1  95 ASP  2.787 0.152 17  0 "[    .    1    .    2]" 
       1  96 ARG  1.019 0.130 11  0 "[    .    1    .    2]" 
       1  97 ASN  4.587 1.030 20  3 "[    .    1    .- * +]" 
       1  98 ASP  4.877 0.223 17  0 "[    .    1    .    2]" 
       1  99 LEU  2.501 0.090  3  0 "[    .    1    .    2]" 
       1 100 ILE  4.065 0.143  9  0 "[    .    1    .    2]" 
       1 101 THR  2.578 0.209 20  0 "[    .    1    .    2]" 
       1 102 TYR  0.510 0.073  8  0 "[    .    1    .    2]" 
       1 103 LEU  5.438 0.147 15  0 "[    .    1    .    2]" 
       1 104 LYS  6.216 0.209 20  0 "[    .    1    .    2]" 
       1 105 LYS  3.654 0.167  8  0 "[    .    1    .    2]" 
       1 106 ALA  3.458 0.200  4  0 "[    .    1    .    2]" 
       1 107 THR  0.221 0.200  4  0 "[    .    1    .    2]" 
       1 108 GLU  0.389 0.079  4  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   1 THR HB   1   2 GLU H    1.800 . 5.000 3.348 1.853 4.678     .  0  0 "[    .    1    .    2]" 1 
          2 1   1 THR HG1  1   2 GLU H    1.800 . 5.000 3.220 2.026 4.074     .  0  0 "[    .    1    .    2]" 1 
          3 1   2 GLU H    1   2 GLU QB   1.800 . 2.900 2.494 2.270 3.261 0.361 20  0 "[    .    1    .    2]" 1 
          4 1   2 GLU QB   1   3 PHE H    1.800 . 5.000 2.827 1.775 3.637 0.025 20  0 "[    .    1    .    2]" 1 
          5 1   3 PHE H    1   3 PHE QD   1.800 . 5.300 4.061 2.421 4.264     .  0  0 "[    .    1    .    2]" 1 
          6 1   3 PHE H    1   3 PHE QE   1.800 . 5.000 6.041 3.871 6.299 1.299  3 18 "[**+******* ** *-****]" 1 
          7 1   3 PHE H    1   4 LYS H    1.800 . 5.000 4.499 4.480 4.536     .  0  0 "[    .    1    .    2]" 1 
          8 1   3 PHE HA   1   3 PHE QD   1.800 . 5.000 2.908 2.630 3.707     .  0  0 "[    .    1    .    2]" 1 
          9 1   3 PHE HA   1   3 PHE QE   1.800 . 5.000 4.668 4.512 5.618 0.618 14  2 "[    .    1-  +.    2]" 1 
         10 1   3 PHE HA   1   4 LYS H    1.800 . 5.000 2.229 2.193 2.492     .  0  0 "[    .    1    .    2]" 1 
         11 1   3 PHE QB   1  97 ASN QD   1.800 . 5.000 4.573 2.443 6.030 1.030 20  3 "[    .    1    .- * +]" 1 
         12 1   3 PHE QD   1   4 LYS H    1.800 . 5.000 3.465 3.130 3.570     .  0  0 "[    .    1    .    2]" 1 
         13 1   4 LYS H    1   4 LYS HA   1.800 . 2.900 2.945 2.785 2.989 0.089  9  0 "[    .    1    .    2]" 1 
         14 1   4 LYS H    1   4 LYS QB   1.800 . 2.900 2.457 2.271 3.019 0.119  3  0 "[    .    1    .    2]" 1 
         15 1   6 GLY H    1   7 SER H    1.800 . 5.000 4.247 3.001 4.674     .  0  0 "[    .    1    .    2]" 1 
         16 1   6 GLY H    1 101 THR MG   1.800 . 5.000 3.884 1.795 5.071 0.071 11  0 "[    .    1    .    2]" 1 
         17 1   6 GLY QA   1  97 ASN QB   1.800 . 6.000 3.099 2.105 3.978     .  0  0 "[    .    1    .    2]" 1 
         18 1   6 GLY QA   1 101 THR MG   1.800 . 5.000 3.365 2.090 4.423     .  0  0 "[    .    1    .    2]" 1 
         19 1   6 GLY HA2  1   7 SER H    1.800 . 5.000 2.317 2.192 2.654     .  0  0 "[    .    1    .    2]" 1 
         20 1   6 GLY HA3  1   7 SER H    1.800 . 5.000 3.142 2.567 3.551     .  0  0 "[    .    1    .    2]" 1 
         21 1   7 SER H    1   8 ALA H    1.800 . 6.000 3.697 2.529 4.685     .  0  0 "[    .    1    .    2]" 1 
         22 1   7 SER H    1   8 ALA HA   1.800 . 6.000 5.096 4.470 5.559     .  0  0 "[    .    1    .    2]" 1 
         23 1   7 SER H    1  98 ASP H    1.800 . 6.000 4.972 4.059 5.888     .  0  0 "[    .    1    .    2]" 1 
         24 1   7 SER H    1  98 ASP HA   1.800 . 5.300 3.788 2.386 4.655     .  0  0 "[    .    1    .    2]" 1 
         25 1   7 SER H    1  98 ASP HB3  1.800 . 5.000 4.628 3.445 5.108 0.108 11  0 "[    .    1    .    2]" 1 
         26 1   7 SER QB   1   8 ALA H    1.800 . 5.000 3.188 2.532 4.061     .  0  0 "[    .    1    .    2]" 1 
         27 1   8 ALA H    1   8 ALA MB   1.800 . 2.900 2.518 2.073 2.969 0.069  6  0 "[    .    1    .    2]" 1 
         28 1   8 ALA H    1  98 ASP QB   1.800 . 5.000 3.997 2.159 5.129 0.129 17  0 "[    .    1    .    2]" 1 
         29 1   8 ALA HA   1   9 LYS H    1.800 . 3.500 3.219 2.167 3.560 0.060 10  0 "[    .    1    .    2]" 1 
         30 1   8 ALA HA   1  10 LYS H    1.800 . 5.000 4.505 3.967 5.095 0.095 19  0 "[    .    1    .    2]" 1 
         31 1   8 ALA HA   1  11 GLY H    1.800 . 6.000 3.793 3.209 5.904     .  0  0 "[    .    1    .    2]" 1 
         32 1   8 ALA HA   1 101 THR HB   1.800 . 6.800 3.457 2.288 6.828 0.028 11  0 "[    .    1    .    2]" 1 
         33 1   8 ALA HA   1 101 THR MG   1.800 . 6.000 3.856 3.051 6.049 0.049 11  0 "[    .    1    .    2]" 1 
         34 1   8 ALA HA   1 102 TYR QB   1.800 . 6.800 4.051 3.026 6.873 0.073  8  0 "[    .    1    .    2]" 1 
         35 1   8 ALA MB   1   9 LYS H    1.800 . 3.500 2.627 1.761 3.532 0.039  2  0 "[    .    1    .    2]" 1 
         36 1   9 LYS H    1   9 LYS HB2  1.800 . 3.500 2.665 2.448 3.524 0.024 19  0 "[    .    1    .    2]" 1 
         37 1   9 LYS H    1  10 LYS H    1.800 . 5.000 3.097 2.585 4.318     .  0  0 "[    .    1    .    2]" 1 
         38 1   9 LYS HA   1  10 LYS H    1.800 . 5.000 3.534 3.237 3.598     .  0  0 "[    .    1    .    2]" 1 
         39 1   9 LYS HA   1  11 GLY H    1.800 . 6.000 4.663 3.797 5.103     .  0  0 "[    .    1    .    2]" 1 
         40 1   9 LYS HA   1  12 ALA MB   1.800 . 6.000 2.701 2.331 3.301     .  0  0 "[    .    1    .    2]" 1 
         41 1   9 LYS HB2  1  10 LYS H    1.800 . 5.000 3.381 2.340 4.051     .  0  0 "[    .    1    .    2]" 1 
         42 1   9 LYS HB3  1  10 LYS H    1.800 . 5.000 2.645 1.745 4.352 0.055 19  0 "[    .    1    .    2]" 1 
         43 1  10 LYS H    1  10 LYS QB   1.800 . 3.500 2.440 2.275 2.569     .  0  0 "[    .    1    .    2]" 1 
         44 1  10 LYS H    1  10 LYS QD   1.800 . 5.000 3.868 3.188 4.431     .  0  0 "[    .    1    .    2]" 1 
         45 1  10 LYS H    1  11 GLY H    1.800 . 3.500 2.748 2.610 3.030     .  0  0 "[    .    1    .    2]" 1 
         46 1  10 LYS HA   1  11 GLY H    1.800 . 5.000 3.568 3.536 3.598     .  0  0 "[    .    1    .    2]" 1 
         47 1  10 LYS HA   1  13 THR H    1.800 . 5.000 3.650 3.479 3.863     .  0  0 "[    .    1    .    2]" 1 
         48 1  11 GLY H    1  12 ALA H    1.800 . 3.500 2.666 2.588 2.760     .  0  0 "[    .    1    .    2]" 1 
         49 1  11 GLY H    1  13 THR H    1.800 . 5.000 4.476 4.278 4.603     .  0  0 "[    .    1    .    2]" 1 
         50 1  11 GLY H    1  14 LEU H    1.800 . 5.000 4.763 4.531 5.016 0.016  5  0 "[    .    1    .    2]" 1 
         51 1  11 GLY H    1  98 ASP H    1.800 . 5.000 5.100 5.000 5.223 0.223 17  0 "[    .    1    .    2]" 1 
         52 1  11 GLY H    1  98 ASP QB   1.800 . 2.900 1.872 1.708 2.454 0.092  7  0 "[    .    1    .    2]" 1 
         53 1  11 GLY QA   1  13 THR H    1.800 . 5.000 4.128 3.942 4.349     .  0  0 "[    .    1    .    2]" 1 
         54 1  11 GLY QA   1  14 LEU H    1.800 . 5.000 3.183 2.956 3.424     .  0  0 "[    .    1    .    2]" 1 
         55 1  11 GLY QA   1  14 LEU MD1  1.800 . 5.000 4.322 4.079 4.627     .  0  0 "[    .    1    .    2]" 1 
         56 1  11 GLY QA   1  14 LEU MD2  1.800 . 5.000 3.294 2.870 4.297     .  0  0 "[    .    1    .    2]" 1 
         57 1  11 GLY QA   1  15 PHE H    1.800 . 5.000 3.725 3.352 4.107     .  0  0 "[    .    1    .    2]" 1 
         58 1  11 GLY QA   1  99 LEU HA   1.800 . 5.000 2.299 2.133 2.768     .  0  0 "[    .    1    .    2]" 1 
         59 1  11 GLY QA   1  99 LEU MD1  1.800 . 5.000 2.982 2.473 4.108     .  0  0 "[    .    1    .    2]" 1 
         60 1  11 GLY HA2  1  12 ALA H    1.800 . 5.000 3.529 3.503 3.560     .  0  0 "[    .    1    .    2]" 1 
         61 1  11 GLY HA2  1  99 LEU MD2  1.800 . 5.300 4.848 4.470 5.285     .  0  0 "[    .    1    .    2]" 1 
         62 1  11 GLY HA3  1  12 ALA H    1.800 . 5.000 2.937 2.865 2.996     .  0  0 "[    .    1    .    2]" 1 
         63 1  11 GLY HA3  1  99 LEU MD2  1.800 . 5.300 5.239 4.876 5.373 0.073 17  0 "[    .    1    .    2]" 1 
         64 1  12 ALA H    1  12 ALA HA   1.800 . 2.900 2.839 2.824 2.859     .  0  0 "[    .    1    .    2]" 1 
         65 1  12 ALA H    1  12 ALA MB   1.800 . 2.900 2.197 2.057 2.254     .  0  0 "[    .    1    .    2]" 1 
         66 1  12 ALA H    1  13 THR H    1.800 . 2.900 2.799 2.747 2.844     .  0  0 "[    .    1    .    2]" 1 
         67 1  12 ALA H    1  13 THR HA   1.800 . 6.000 5.423 5.385 5.458     .  0  0 "[    .    1    .    2]" 1 
         68 1  12 ALA H    1 102 TYR HA   1.800 . 6.000 5.559 5.279 5.972     .  0  0 "[    .    1    .    2]" 1 
         69 1  12 ALA H    1 102 TYR HB2  1.800 . 5.000 3.548 3.214 3.805     .  0  0 "[    .    1    .    2]" 1 
         70 1  12 ALA H    1 102 TYR HB3  1.800 . 5.000 4.936 4.332 5.047 0.047 15  0 "[    .    1    .    2]" 1 
         71 1  12 ALA HA   1  13 THR H    1.800 . 3.500 3.569 3.549 3.580 0.080 12  0 "[    .    1    .    2]" 1 
         72 1  12 ALA HA   1  14 LEU H    1.800 . 5.000 4.499 4.353 4.642     .  0  0 "[    .    1    .    2]" 1 
         73 1  12 ALA HA   1  15 PHE H    1.800 . 5.000 3.672 3.366 3.846     .  0  0 "[    .    1    .    2]" 1 
         74 1  12 ALA HA   1  15 PHE HB2  1.800 . 5.000 3.615 3.133 4.140     .  0  0 "[    .    1    .    2]" 1 
         75 1  12 ALA HA   1  15 PHE HB3  1.800 . 5.000 3.172 2.936 3.550     .  0  0 "[    .    1    .    2]" 1 
         76 1  12 ALA HA   1  16 LYS H    1.800 . 5.000 4.317 3.950 4.645     .  0  0 "[    .    1    .    2]" 1 
         77 1  12 ALA MB   1  13 THR H    1.800 . 2.900 2.440 2.304 2.590     .  0  0 "[    .    1    .    2]" 1 
         78 1  12 ALA MB   1  13 THR HA   1.800 . 5.000 3.804 3.728 3.857     .  0  0 "[    .    1    .    2]" 1 
         79 1  13 THR H    1  13 THR HA   1.800 . 2.900 2.892 2.848 2.907 0.007  6  0 "[    .    1    .    2]" 1 
         80 1  13 THR H    1  13 THR HB   1.800 . 3.500 3.520 2.646 3.619 0.119  6  0 "[    .    1    .    2]" 1 
         81 1  13 THR H    1  13 THR MG   1.800 . 3.500 2.285 1.971 3.742 0.242  5  0 "[    .    1    .    2]" 1 
         82 1  13 THR H    1  14 LEU H    1.800 . 2.900 2.553 2.487 2.688     .  0  0 "[    .    1    .    2]" 1 
         83 1  13 THR H    1  15 PHE H    1.800 . 5.000 4.106 4.011 4.449     .  0  0 "[    .    1    .    2]" 1 
         84 1  13 THR H    1  16 LYS QB   1.800 . 5.000 4.754 4.379 4.902     .  0  0 "[    .    1    .    2]" 1 
         85 1  13 THR H    1  17 THR MG   1.800 . 5.300 5.146 4.973 5.340 0.040  2  0 "[    .    1    .    2]" 1 
         86 1  13 THR HA   1  13 THR MG   1.800 . 2.900 2.364 2.213 2.443     .  0  0 "[    .    1    .    2]" 1 
         87 1  13 THR HA   1  14 LEU H    1.800 . 5.000 3.553 3.530 3.566     .  0  0 "[    .    1    .    2]" 1 
         88 1  13 THR HA   1  15 PHE H    1.800 . 5.000 4.252 4.150 4.721     .  0  0 "[    .    1    .    2]" 1 
         89 1  13 THR HA   1  16 LYS H    1.800 . 5.000 3.150 3.075 3.365     .  0  0 "[    .    1    .    2]" 1 
         90 1  13 THR HA   1  16 LYS HB2  1.800 . 2.900 3.019 2.973 3.036 0.136 17  0 "[    .    1    .    2]" 1 
         91 1  13 THR HA   1  16 LYS HB3  1.800 . 2.900 2.544 2.260 2.655     .  0  0 "[    .    1    .    2]" 1 
         92 1  13 THR HB   1  14 LEU H    1.800 . 5.000 3.701 2.550 3.906     .  0  0 "[    .    1    .    2]" 1 
         93 1  13 THR HB   1  17 THR MG   1.800 . 3.500 3.026 2.680 3.546 0.046  5  0 "[    .    1    .    2]" 1 
         94 1  13 THR MG   1  14 LEU H    1.800 . 5.000 3.769 3.669 3.828     .  0  0 "[    .    1    .    2]" 1 
         95 1  13 THR MG   1  16 LYS H    1.800 . 5.000 4.909 4.288 5.044 0.044  2  0 "[    .    1    .    2]" 1 
         96 1  14 LEU H    1  14 LEU QB   1.800 . 2.900 2.254 2.173 2.279     .  0  0 "[    .    1    .    2]" 1 
         97 1  14 LEU H    1  14 LEU MD1  1.800 . 5.000 4.010 3.903 4.191     .  0  0 "[    .    1    .    2]" 1 
         98 1  14 LEU H    1  14 LEU MD2  1.800 . 5.000 4.086 1.966 4.342     .  0  0 "[    .    1    .    2]" 1 
         99 1  14 LEU H    1  14 LEU HG   1.800 . 5.000 4.447 3.818 4.628     .  0  0 "[    .    1    .    2]" 1 
        100 1  14 LEU H    1  15 PHE H    1.800 . 3.500 2.675 2.610 2.859     .  0  0 "[    .    1    .    2]" 1 
        101 1  14 LEU H    1  16 LYS H    1.800 . 5.000 4.142 3.993 4.200     .  0  0 "[    .    1    .    2]" 1 
        102 1  14 LEU H    1  99 LEU HA   1.800 . 6.000 5.531 5.167 5.910     .  0  0 "[    .    1    .    2]" 1 
        103 1  14 LEU H    1  99 LEU MD1  1.800 . 5.000 4.323 4.030 5.031 0.031 10  0 "[    .    1    .    2]" 1 
        104 1  14 LEU H    1  99 LEU MD2  1.800 . 6.300 6.043 5.511 6.337 0.037  2  0 "[    .    1    .    2]" 1 
        105 1  14 LEU HA   1  14 LEU MD1  1.800 . 3.500 2.260 2.192 2.538     .  0  0 "[    .    1    .    2]" 1 
        106 1  14 LEU HA   1  14 LEU MD2  1.800 . 5.000 3.497 2.093 3.854     .  0  0 "[    .    1    .    2]" 1 
        107 1  14 LEU HA   1  15 PHE H    1.800 . 3.500 3.533 3.525 3.561 0.061  2  0 "[    .    1    .    2]" 1 
        108 1  14 LEU HA   1  16 LYS H    1.800 . 5.000 4.550 4.491 4.683     .  0  0 "[    .    1    .    2]" 1 
        109 1  14 LEU HA   1  17 THR H    1.800 . 5.000 3.427 3.294 3.665     .  0  0 "[    .    1    .    2]" 1 
        110 1  14 LEU HA   1  18 ARG QB   1.800 . 5.300 4.820 3.554 5.077     .  0  0 "[    .    1    .    2]" 1 
        111 1  14 LEU QB   1  14 LEU MD1  1.800 . 3.500 2.180 2.112 2.343     .  0  0 "[    .    1    .    2]" 1 
        112 1  14 LEU QB   1  14 LEU MD2  1.800 . 3.500 2.110 2.053 2.398     .  0  0 "[    .    1    .    2]" 1 
        113 1  14 LEU QB   1  15 PHE H    1.800 . 2.900 2.481 2.365 2.527     .  0  0 "[    .    1    .    2]" 1 
        114 1  14 LEU QB   1  99 LEU MD1  1.800 . 5.000 2.357 2.184 2.704     .  0  0 "[    .    1    .    2]" 1 
        115 1  14 LEU QB   1  99 LEU MD2  1.800 . 5.000 3.747 3.027 4.323     .  0  0 "[    .    1    .    2]" 1 
        116 1  14 LEU QD   1  18 ARG HB2  1.800 . 5.000 3.779 2.869 4.171     .  0  0 "[    .    1    .    2]" 1 
        117 1  14 LEU QD   1  95 ASP HB3  1.800 . 5.000 3.144 2.595 3.933     .  0  0 "[    .    1    .    2]" 1 
        118 1  14 LEU MD1  1  15 PHE H    1.800 . 5.000 4.523 3.527 4.783     .  0  0 "[    .    1    .    2]" 1 
        119 1  14 LEU MD1  1  18 ARG HB3  1.800 . 6.000 5.350 4.171 6.005 0.005  5  0 "[    .    1    .    2]" 1 
        120 1  14 LEU MD1  1  95 ASP HB2  1.800 . 5.000 4.764 3.402 5.087 0.087 10  0 "[    .    1    .    2]" 1 
        121 1  14 LEU MD1  1  99 LEU H    1.800 . 6.000 6.019 5.796 6.084 0.084 19  0 "[    .    1    .    2]" 1 
        122 1  14 LEU MD1  1  99 LEU MD1  1.800 . 5.000 4.040 2.027 4.561     .  0  0 "[    .    1    .    2]" 1 
        123 1  14 LEU MD2  1  15 PHE H    1.800 . 5.000 4.082 3.702 4.631     .  0  0 "[    .    1    .    2]" 1 
        124 1  14 LEU MD2  1  18 ARG HB3  1.800 . 6.000 6.030 6.004 6.104 0.104  2  0 "[    .    1    .    2]" 1 
        125 1  14 LEU MD2  1  95 ASP HB2  1.800 . 5.000 4.296 2.862 5.013 0.013  2  0 "[    .    1    .    2]" 1 
        126 1  14 LEU MD2  1  99 LEU H    1.800 . 6.000 4.391 3.632 6.067 0.067  8  0 "[    .    1    .    2]" 1 
        127 1  14 LEU MD2  1  99 LEU MD1  1.800 . 5.000 2.722 2.077 4.615     .  0  0 "[    .    1    .    2]" 1 
        128 1  14 LEU HG   1  15 PHE H    1.800 . 5.000 4.132 3.842 4.907     .  0  0 "[    .    1    .    2]" 1 
        129 1  14 LEU HG   1  99 LEU MD1  1.800 . 5.000 3.548 2.599 4.063     .  0  0 "[    .    1    .    2]" 1 
        130 1  14 LEU HG   1  99 LEU QD   1.800 . 6.000 3.188 2.593 3.791     .  0  0 "[    .    1    .    2]" 1 
        131 1  14 LEU HG   1  99 LEU MD2  1.800 . 6.000 3.798 3.267 6.005 0.005  2  0 "[    .    1    .    2]" 1 
        132 1  15 PHE H    1  15 PHE HB2  1.800 . 3.500 2.472 2.447 2.552     .  0  0 "[    .    1    .    2]" 1 
        133 1  15 PHE H    1  15 PHE HB3  1.800 . 3.500 2.580 2.509 2.645     .  0  0 "[    .    1    .    2]" 1 
        134 1  15 PHE H    1  16 LYS H    1.800 . 2.900 2.656 2.599 2.680     .  0  0 "[    .    1    .    2]" 1 
        135 1  15 PHE H    1  17 THR H    1.800 . 5.000 4.018 3.932 4.239     .  0  0 "[    .    1    .    2]" 1 
        136 1  15 PHE H    1  18 ARG H    1.800 . 5.000 4.805 4.729 4.840     .  0  0 "[    .    1    .    2]" 1 
        137 1  15 PHE H    1  99 LEU MD1  1.800 . 5.000 2.853 2.596 3.843     .  0  0 "[    .    1    .    2]" 1 
        138 1  15 PHE H    1  99 LEU MD2  1.800 . 5.000 4.659 4.271 4.918     .  0  0 "[    .    1    .    2]" 1 
        139 1  15 PHE HA   1  15 PHE QD   1.800 . 5.000 2.793 2.730 2.966     .  0  0 "[    .    1    .    2]" 1 
        140 1  15 PHE HA   1  16 LYS H    1.800 . 5.000 3.551 3.545 3.556     .  0  0 "[    .    1    .    2]" 1 
        141 1  15 PHE HA   1  18 ARG H    1.800 . 5.000 3.590 3.382 3.643     .  0  0 "[    .    1    .    2]" 1 
        142 1  15 PHE HA   1  19 CYS H    1.800 . 5.000 4.414 3.901 4.506     .  0  0 "[    .    1    .    2]" 1 
        143 1  15 PHE HA   1  19 CYS HB2  1.800 . 3.500 2.398 2.276 2.564     .  0  0 "[    .    1    .    2]" 1 
        144 1  15 PHE HA   1  19 CYS HB3  1.800 . 3.500 2.469 2.273 2.656     .  0  0 "[    .    1    .    2]" 1 
        145 1  15 PHE HA   1  20 LEU H    1.800 . 5.000 3.955 3.862 4.174     .  0  0 "[    .    1    .    2]" 1 
        146 1  15 PHE HA   1  99 LEU MD1  1.800 . 5.000 2.541 2.370 3.136     .  0  0 "[    .    1    .    2]" 1 
        147 1  15 PHE HA   1  99 LEU MD2  1.800 . 5.000 3.778 3.527 4.129     .  0  0 "[    .    1    .    2]" 1 
        148 1  15 PHE HB2  1  16 LYS H    1.800 . 5.000 3.698 3.658 3.762     .  0  0 "[    .    1    .    2]" 1 
        149 1  15 PHE HB2  1  99 LEU MD1  1.800 . 5.000 2.200 1.968 3.528     .  0  0 "[    .    1    .    2]" 1 
        150 1  15 PHE HB2  1  99 LEU MD2  1.800 . 5.000 4.151 2.888 4.571     .  0  0 "[    .    1    .    2]" 1 
        151 1  15 PHE HB3  1  16 LYS H    1.800 . 5.000 2.378 2.319 2.516     .  0  0 "[    .    1    .    2]" 1 
        152 1  15 PHE HB3  1  99 LEU MD1  1.800 . 5.000 3.591 3.328 4.834     .  0  0 "[    .    1    .    2]" 1 
        153 1  15 PHE HB3  1  99 LEU MD2  1.800 . 6.000 5.503 4.307 5.868     .  0  0 "[    .    1    .    2]" 1 
        154 1  15 PHE QD   1  20 LEU H    1.800 . 5.000 3.399 3.267 3.880     .  0  0 "[    .    1    .    2]" 1 
        155 1  15 PHE QE   1 103 LEU QD   1.800 . 5.000 2.090 1.990 2.230     .  0  0 "[    .    1    .    2]" 1 
        156 1  15 PHE HZ   1  20 LEU MD1  1.800 . 5.000 3.845 3.652 5.021 0.021  2  0 "[    .    1    .    2]" 1 
        157 1  15 PHE HZ   1  20 LEU MD2  1.800 . 6.000 5.974 3.977 6.116 0.116 17  0 "[    .    1    .    2]" 1 
        158 1  15 PHE HZ   1  23 HIS HA   1.800 . 5.300 4.934 4.647 5.171     .  0  0 "[    .    1    .    2]" 1 
        159 1  15 PHE HZ   1  23 HIS HB2  1.800 . 3.500 2.553 2.278 2.760     .  0  0 "[    .    1    .    2]" 1 
        160 1  15 PHE HZ   1  23 HIS HB3  1.800 . 3.500 2.952 2.683 3.200     .  0  0 "[    .    1    .    2]" 1 
        161 1  15 PHE HZ   1  24 THR HA   1.800 . 5.000 4.958 4.606 5.038 0.038 12  0 "[    .    1    .    2]" 1 
        162 1  15 PHE HZ   1  25 VAL HB   1.800 . 5.000 4.162 2.593 4.643     .  0  0 "[    .    1    .    2]" 1 
        163 1  15 PHE HZ   1  25 VAL QG   1.800 . 2.900 2.096 1.966 2.748     .  0  0 "[    .    1    .    2]" 1 
        164 1  15 PHE HZ   1  37 LEU MD1  1.800 . 6.000 4.295 3.553 5.973     .  0  0 "[    .    1    .    2]" 1 
        165 1  15 PHE HZ   1  37 LEU MD2  1.800 . 5.000 4.597 3.945 5.023 0.023  5  0 "[    .    1    .    2]" 1 
        166 1  16 LYS H    1  16 LYS HB2  1.800 . 2.900 2.403 2.394 2.417     .  0  0 "[    .    1    .    2]" 1 
        167 1  16 LYS H    1  16 LYS HB3  1.800 . 2.900 2.669 2.656 2.690     .  0  0 "[    .    1    .    2]" 1 
        168 1  16 LYS H    1  16 LYS QE   1.800 . 6.000 5.925 5.874 6.025 0.025  2  0 "[    .    1    .    2]" 1 
        169 1  16 LYS H    1  16 LYS QG   1.800 . 5.000 3.950 3.946 3.954     .  0  0 "[    .    1    .    2]" 1 
        170 1  16 LYS H    1  17 THR H    1.800 . 2.900 2.683 2.627 2.777     .  0  0 "[    .    1    .    2]" 1 
        171 1  16 LYS H    1  99 LEU MD1  1.800 . 6.000 4.717 4.485 5.639     .  0  0 "[    .    1    .    2]" 1 
        172 1  16 LYS H    1  99 LEU MD2  1.800 . 6.800 6.428 6.062 6.736     .  0  0 "[    .    1    .    2]" 1 
        173 1  16 LYS HA   1  16 LYS QE   1.800 . 5.000 4.511 4.431 4.750     .  0  0 "[    .    1    .    2]" 1 
        174 1  16 LYS HA   1  17 THR H    1.800 . 3.500 3.541 3.532 3.559 0.059  2  0 "[    .    1    .    2]" 1 
        175 1  16 LYS HA   1  20 LEU H    1.800 . 3.500 2.922 2.822 3.564 0.064  2  0 "[    .    1    .    2]" 1 
        176 1  16 LYS HA   1  20 LEU HB2  1.800 . 3.500 2.328 2.244 2.455     .  0  0 "[    .    1    .    2]" 1 
        177 1  16 LYS HA   1  20 LEU HB3  1.800 . 5.000 2.408 2.268 3.795     .  0  0 "[    .    1    .    2]" 1 
        178 1  16 LYS HB2  1  17 THR H    1.800 . 5.000 3.782 3.759 3.827     .  0  0 "[    .    1    .    2]" 1 
        179 1  16 LYS HB3  1  17 THR H    1.800 . 3.500 2.586 2.541 2.622     .  0  0 "[    .    1    .    2]" 1 
        180 1  17 THR H    1  17 THR MG   1.800 . 2.900 2.149 2.085 2.387     .  0  0 "[    .    1    .    2]" 1 
        181 1  17 THR H    1  18 ARG H    1.800 . 2.900 2.688 2.431 2.761     .  0  0 "[    .    1    .    2]" 1 
        182 1  17 THR HA   1  18 ARG H    1.800 . 5.000 3.549 3.301 3.579     .  0  0 "[    .    1    .    2]" 1 
        183 1  17 THR HB   1  18 ARG H    1.800 . 5.000 3.919 3.814 4.442     .  0  0 "[    .    1    .    2]" 1 
        184 1  17 THR MG   1  18 ARG H    1.800 . 5.000 3.914 3.860 4.129     .  0  0 "[    .    1    .    2]" 1 
        185 1  18 ARG H    1  18 ARG HA   1.800 . 2.900 2.957 2.943 2.975 0.075 18  0 "[    .    1    .    2]" 1 
        186 1  18 ARG H    1  18 ARG QB   1.800 . 3.500 2.774 2.733 2.819     .  0  0 "[    .    1    .    2]" 1 
        187 1  18 ARG H    1  18 ARG HG2  1.800 . 5.000 4.104 3.049 4.193     .  0  0 "[    .    1    .    2]" 1 
        188 1  18 ARG H    1  18 ARG HG3  1.800 . 5.000 3.352 3.195 4.276     .  0  0 "[    .    1    .    2]" 1 
        189 1  18 ARG H    1  19 CYS H    1.800 . 2.900 2.877 2.242 2.942 0.042 11  0 "[    .    1    .    2]" 1 
        190 1  18 ARG HA   1  19 CYS H    1.800 . 5.000 2.684 2.600 3.011     .  0  0 "[    .    1    .    2]" 1 
        191 1  18 ARG HA   1  20 LEU H    1.800 . 5.000 4.878 4.662 5.012 0.012 18  0 "[    .    1    .    2]" 1 
        192 1  18 ARG QB   1  19 CYS H    1.800 . 5.000 3.921 3.794 3.932     .  0  0 "[    .    1    .    2]" 1 
        193 1  18 ARG HB2  1  87 PHE QE   1.800 . 5.000 2.493 2.268 3.364     .  0  0 "[    .    1    .    2]" 1 
        194 1  18 ARG HB2  1  87 PHE HZ   1.800 . 5.000 4.329 3.652 4.703     .  0  0 "[    .    1    .    2]" 1 
        195 1  18 ARG HB3  1  87 PHE QE   1.800 . 5.000 2.998 2.287 3.919     .  0  0 "[    .    1    .    2]" 1 
        196 1  18 ARG HB3  1  87 PHE HZ   1.800 . 5.300 5.111 3.924 5.354 0.054 12  0 "[    .    1    .    2]" 1 
        197 1  18 ARG QG   1  19 CYS H    1.800 . 5.000 4.534 4.479 4.769     .  0  0 "[    .    1    .    2]" 1 
        198 1  19 CYS H    1  19 CYS HA   1.800 . 2.900 2.873 2.868 2.884     .  0  0 "[    .    1    .    2]" 1 
        199 1  19 CYS H    1  20 LEU H    1.800 . 5.000 2.237 1.743 2.396 0.057  2  0 "[    .    1    .    2]" 1 
        200 1  19 CYS HA   1  20 LEU H    1.800 . 3.500 3.572 3.500 3.583 0.083  8  0 "[    .    1    .    2]" 1 
        201 1  19 CYS HA   1  21 GLN H    1.800 . 5.000 4.290 4.095 4.338     .  0  0 "[    .    1    .    2]" 1 
        202 1  19 CYS HA   1 103 LEU QD   1.800 . 6.800 5.910 5.764 6.249     .  0  0 "[    .    1    .    2]" 1 
        203 1  19 CYS HB2  1  20 LEU HA   1.800 . 6.000 5.519 5.483 5.640     .  0  0 "[    .    1    .    2]" 1 
        204 1  19 CYS HB3  1  20 LEU HA   1.800 . 6.000 3.973 3.919 4.148     .  0  0 "[    .    1    .    2]" 1 
        205 1  19 CYS HB3  1  23 HIS HB3  1.800 . 6.000 5.998 5.910 6.080 0.080  5  0 "[    .    1    .    2]" 1 
        206 1  20 LEU H    1  20 LEU HB2  1.800 . 3.500 2.482 2.193 2.550     .  0  0 "[    .    1    .    2]" 1 
        207 1  20 LEU H    1  20 LEU HB3  1.800 . 3.500 2.633 2.575 2.936     .  0  0 "[    .    1    .    2]" 1 
        208 1  20 LEU H    1  20 LEU MD1  1.800 . 5.000 4.059 4.019 4.232     .  0  0 "[    .    1    .    2]" 1 
        209 1  20 LEU H    1  20 LEU MD2  1.800 . 5.000 4.252 3.468 4.314     .  0  0 "[    .    1    .    2]" 1 
        210 1  20 LEU H    1  20 LEU HG   1.800 . 5.000 4.485 4.405 4.589     .  0  0 "[    .    1    .    2]" 1 
        211 1  20 LEU H    1  21 GLN H    1.800 . 3.500 2.771 2.732 2.814     .  0  0 "[    .    1    .    2]" 1 
        212 1  20 LEU HA   1  20 LEU MD1  1.800 . 3.500 2.245 2.190 3.013     .  0  0 "[    .    1    .    2]" 1 
        213 1  20 LEU HA   1  20 LEU MD2  1.800 . 5.000 3.766 2.149 3.869     .  0  0 "[    .    1    .    2]" 1 
        214 1  20 LEU HA   1  20 LEU HG   1.800 . 3.500 2.841 2.403 3.597 0.097  2  0 "[    .    1    .    2]" 1 
        215 1  20 LEU HA   1  21 GLN H    1.800 . 5.000 3.544 3.536 3.549     .  0  0 "[    .    1    .    2]" 1 
        216 1  20 LEU HA   1  22 CYS H    1.800 . 6.800 4.118 3.990 4.238     .  0  0 "[    .    1    .    2]" 1 
        217 1  20 LEU HA   1  23 HIS H    1.800 . 5.000 3.430 3.359 3.820     .  0  0 "[    .    1    .    2]" 1 
        218 1  20 LEU HA   1  23 HIS QB   1.800 . 5.000 3.637 3.530 4.066     .  0  0 "[    .    1    .    2]" 1 
        219 1  20 LEU HB2  1  20 LEU MD1  1.800 . 5.000 2.245 2.121 3.201     .  0  0 "[    .    1    .    2]" 1 
        220 1  20 LEU HB2  1  20 LEU MD2  1.800 . 5.000 2.509 2.202 2.953     .  0  0 "[    .    1    .    2]" 1 
        221 1  20 LEU HB2  1  21 GLN H    1.800 . 5.000 3.900 3.569 3.968     .  0  0 "[    .    1    .    2]" 1 
        222 1  20 LEU HB3  1  20 LEU MD1  1.800 . 5.000 3.125 2.387 3.184     .  0  0 "[    .    1    .    2]" 1 
        223 1  20 LEU HB3  1  20 LEU MD2  1.800 . 5.000 2.271 2.110 3.183     .  0  0 "[    .    1    .    2]" 1 
        224 1  20 LEU HB3  1  21 GLN H    1.800 . 5.000 2.675 2.642 2.718     .  0  0 "[    .    1    .    2]" 1 
        225 1  20 LEU MD1  1  21 GLN H    1.800 . 5.300 4.658 3.670 4.916     .  0  0 "[    .    1    .    2]" 1 
        226 1  20 LEU MD1  1  23 HIS H    1.800 . 6.000 4.907 4.586 5.862     .  0  0 "[    .    1    .    2]" 1 
        227 1  20 LEU MD1  1  24 THR HA   1.800 . 3.500 2.731 2.466 3.542 0.042 20  0 "[    .    1    .    2]" 1 
        228 1  20 LEU MD2  1  21 GLN H    1.800 . 5.000 4.174 3.353 4.688     .  0  0 "[    .    1    .    2]" 1 
        229 1  20 LEU MD2  1  23 HIS H    1.800 . 6.300 6.249 5.164 6.358 0.058  7  0 "[    .    1    .    2]" 1 
        230 1  20 LEU MD2  1  24 THR HA   1.800 . 5.000 4.766 3.204 5.004 0.004  8  0 "[    .    1    .    2]" 1 
        231 1  20 LEU HG   1  21 GLN H    1.800 . 6.000 3.978 3.876 4.976     .  0  0 "[    .    1    .    2]" 1 
        232 1  21 GLN H    1  21 GLN QE   1.800 . 5.000 4.555 3.400 5.054 0.054  8  0 "[    .    1    .    2]" 1 
        233 1  21 GLN H    1  21 GLN HG2  1.800 . 5.000 3.342 2.018 4.519     .  0  0 "[    .    1    .    2]" 1 
        234 1  21 GLN H    1  21 GLN HG3  1.800 . 5.000 2.284 2.068 4.355     .  0  0 "[    .    1    .    2]" 1 
        235 1  21 GLN H    1  22 CYS H    1.800 . 5.000 2.758 2.738 2.850     .  0  0 "[    .    1    .    2]" 1 
        236 1  21 GLN H    1  23 HIS H    1.800 . 5.000 4.283 4.192 4.570     .  0  0 "[    .    1    .    2]" 1 
        237 1  21 GLN HA   1  22 CYS H    1.800 . 5.000 3.542 3.530 3.561     .  0  0 "[    .    1    .    2]" 1 
        238 1  21 GLN HB2  1  22 CYS H    1.800 . 5.000 2.789 2.686 3.857     .  0  0 "[    .    1    .    2]" 1 
        239 1  21 GLN HB3  1  22 CYS H    1.800 . 5.000 3.686 2.693 3.785     .  0  0 "[    .    1    .    2]" 1 
        240 1  21 GLN HG2  1  22 CYS H    1.800 . 5.000 4.933 4.053 5.044 0.044  2  0 "[    .    1    .    2]" 1 
        241 1  21 GLN HG3  1  22 CYS H    1.800 . 5.000 4.391 4.311 5.027 0.027 12  0 "[    .    1    .    2]" 1 
        242 1  22 CYS H    1  23 HIS H    1.800 . 5.000 2.340 2.309 2.457     .  0  0 "[    .    1    .    2]" 1 
        243 1  22 CYS HA   1  23 HIS H    1.800 . 5.000 3.572 3.557 3.590     .  0  0 "[    .    1    .    2]" 1 
        244 1  22 CYS HA   1  23 HIS QB   1.800 . 6.000 5.437 5.409 5.460     .  0  0 "[    .    1    .    2]" 1 
        245 1  22 CYS HA   1  24 THR MG   1.800 . 5.300 5.019 4.740 5.149     .  0  0 "[    .    1    .    2]" 1 
        246 1  22 CYS HA   1  33 VAL HB   1.800 . 5.000 2.442 2.277 3.860     .  0  0 "[    .    1    .    2]" 1 
        247 1  22 CYS HA   1  33 VAL MG1  1.800 . 5.000 3.374 2.220 4.734     .  0  0 "[    .    1    .    2]" 1 
        248 1  22 CYS HA   1  33 VAL MG2  1.800 . 5.000 3.231 2.187 5.002 0.002 15  0 "[    .    1    .    2]" 1 
        249 1  22 CYS HA   1  34 GLY H    1.800 . 3.500 3.356 2.991 3.557 0.057  4  0 "[    .    1    .    2]" 1 
        250 1  22 CYS HA   1  34 GLY QA   1.800 . 5.000 4.559 4.043 4.916     .  0  0 "[    .    1    .    2]" 1 
        251 1  22 CYS QB   1  33 VAL HB   1.800 . 6.000 3.379 2.931 4.644     .  0  0 "[    .    1    .    2]" 1 
        252 1  22 CYS QB   1  34 GLY H    1.800 . 5.000 3.423 3.136 3.779     .  0  0 "[    .    1    .    2]" 1 
        253 1  22 CYS HB2  1  23 HIS H    1.800 . 5.000 2.554 2.440 2.613     .  0  0 "[    .    1    .    2]" 1 
        254 1  22 CYS HB3  1  23 HIS H    1.800 . 5.000 3.521 3.374 3.591     .  0  0 "[    .    1    .    2]" 1 
        255 1  22 CYS HB3  1  33 VAL MG1  1.800 . 6.000 3.259 2.215 4.608     .  0  0 "[    .    1    .    2]" 1 
        256 1  22 CYS HB3  1  33 VAL MG2  1.800 . 6.000 4.663 3.944 6.029 0.029 15  0 "[    .    1    .    2]" 1 
        257 1  23 HIS H    1  23 HIS HB2  1.800 . 3.500 2.413 2.389 2.463     .  0  0 "[    .    1    .    2]" 1 
        258 1  23 HIS H    1  24 THR H    1.800 . 5.000 4.446 4.357 4.494     .  0  0 "[    .    1    .    2]" 1 
        259 1  23 HIS H    1  25 VAL H    1.800 . 6.000 5.628 5.402 5.776     .  0  0 "[    .    1    .    2]" 1 
        260 1  23 HIS HA   1  24 THR HA   1.800 . 6.000 4.449 4.433 4.478     .  0  0 "[    .    1    .    2]" 1 
        261 1  23 HIS HA   1  24 THR HB   1.800 . 6.000 5.743 5.701 5.778     .  0  0 "[    .    1    .    2]" 1 
        262 1  23 HIS HA   1  36 ASN HA   1.800 . 5.000 3.672 3.383 4.062     .  0  0 "[    .    1    .    2]" 1 
        263 1  23 HIS QB   1  24 THR HA   1.800 . 5.000 4.440 4.325 4.494     .  0  0 "[    .    1    .    2]" 1 
        264 1  23 HIS QB   1  34 GLY QA   1.800 . 5.300 5.039 4.672 5.329 0.029  6  0 "[    .    1    .    2]" 1 
        265 1  23 HIS QB   1  37 LEU H    1.800 . 5.000 3.455 3.242 3.595     .  0  0 "[    .    1    .    2]" 1 
        266 1  23 HIS QB   1  37 LEU QB   1.800 . 5.000 3.803 2.744 4.195     .  0  0 "[    .    1    .    2]" 1 
        267 1  23 HIS QB   1  37 LEU QD   1.800 . 3.500 2.369 1.970 3.537 0.037 16  0 "[    .    1    .    2]" 1 
        268 1  23 HIS HB2  1  24 THR H    1.800 . 5.000 4.341 4.266 4.442     .  0  0 "[    .    1    .    2]" 1 
        269 1  23 HIS HB2  1 103 LEU MD1  1.800 . 5.000 5.057 5.026 5.122 0.122  5  0 "[    .    1    .    2]" 1 
        270 1  23 HIS HB3  1  24 THR H    1.800 . 5.000 3.421 3.258 3.668     .  0  0 "[    .    1    .    2]" 1 
        271 1  24 THR H    1  24 THR MG   1.800 . 5.000 2.293 2.126 2.456     .  0  0 "[    .    1    .    2]" 1 
        272 1  24 THR H    1  25 VAL H    1.800 . 3.500 2.295 2.184 2.375     .  0  0 "[    .    1    .    2]" 1 
        273 1  24 THR H    1  32 LYS QB   1.800 . 5.000 4.287 3.777 4.891     .  0  0 "[    .    1    .    2]" 1 
        274 1  24 THR H    1  36 ASN HA   1.800 . 5.000 3.106 2.654 3.422     .  0  0 "[    .    1    .    2]" 1 
        275 1  24 THR H    1  37 LEU H    1.800 . 5.000 4.442 4.024 4.819     .  0  0 "[    .    1    .    2]" 1 
        276 1  24 THR HA   1  24 THR HB   1.800 . 2.900 2.425 2.364 2.442     .  0  0 "[    .    1    .    2]" 1 
        277 1  24 THR HA   1  24 THR MG   1.800 . 2.900 2.389 2.328 2.511     .  0  0 "[    .    1    .    2]" 1 
        278 1  24 THR HA   1  25 VAL H    1.800 . 5.000 3.455 3.335 3.508     .  0  0 "[    .    1    .    2]" 1 
        279 1  24 THR HA   1  25 VAL QG   1.800 . 5.000 3.402 3.080 4.032     .  0  0 "[    .    1    .    2]" 1 
        280 1  24 THR HB   1  25 VAL H    1.800 . 5.000 4.102 3.957 4.337     .  0  0 "[    .    1    .    2]" 1 
        281 1  24 THR HB   1  25 VAL QG   1.800 . 5.000 4.663 4.287 5.028 0.028  1  0 "[    .    1    .    2]" 1 
        282 1  24 THR HB   1  36 ASN QD   1.800 . 5.000 3.938 3.519 4.333     .  0  0 "[    .    1    .    2]" 1 
        283 1  24 THR MG   1  25 VAL H    1.800 . 5.000 3.881 3.681 4.008     .  0  0 "[    .    1    .    2]" 1 
        284 1  24 THR MG   1  30 PRO QD   1.800 . 5.000 4.181 2.415 5.016 0.016  9  0 "[    .    1    .    2]" 1 
        285 1  24 THR MG   1  32 LYS HB2  1.800 . 5.000 2.643 2.146 3.065     .  0  0 "[    .    1    .    2]" 1 
        286 1  24 THR MG   1  32 LYS HB3  1.800 . 3.500 3.005 2.066 3.599 0.099 12  0 "[    .    1    .    2]" 1 
        287 1  24 THR MG   1  34 GLY H    1.800 . 5.300 4.870 4.660 5.120     .  0  0 "[    .    1    .    2]" 1 
        288 1  24 THR MG   1  36 ASN HD21 1.800 . 3.500 3.146 2.423 3.559 0.059  6  0 "[    .    1    .    2]" 1 
        289 1  24 THR MG   1  36 ASN QD   1.800 . 3.500 2.476 1.899 3.036     .  0  0 "[    .    1    .    2]" 1 
        290 1  24 THR MG   1  36 ASN HD22 1.800 . 5.000 2.622 1.969 3.329     .  0  0 "[    .    1    .    2]" 1 
        291 1  25 VAL H    1  25 VAL QG   1.800 . 5.000 2.547 2.291 3.100     .  0  0 "[    .    1    .    2]" 1 
        292 1  25 VAL H    1  26 GLU H    1.800 . 5.000 2.900 2.660 3.288     .  0  0 "[    .    1    .    2]" 1 
        293 1  25 VAL H    1  36 ASN H    1.800 . 5.300 5.335 5.165 5.381 0.081  8  0 "[    .    1    .    2]" 1 
        294 1  25 VAL H    1  37 LEU H    1.800 . 5.000 2.771 2.238 3.312     .  0  0 "[    .    1    .    2]" 1 
        295 1  25 VAL HA   1  25 VAL QG   1.800 . 3.500 2.110 2.051 2.251     .  0  0 "[    .    1    .    2]" 1 
        296 1  25 VAL QG   1  26 GLU HB2  1.800 . 6.000 4.927 3.544 5.410     .  0  0 "[    .    1    .    2]" 1 
        297 1  25 VAL QG   1  26 GLU HB3  1.800 . 6.000 5.447 4.513 5.858     .  0  0 "[    .    1    .    2]" 1 
        298 1  25 VAL QG   1  37 LEU H    1.800 . 5.000 2.874 2.140 3.569     .  0  0 "[    .    1    .    2]" 1 
        299 1  25 VAL QG   1  37 LEU QB   1.800 . 5.000 2.331 1.987 2.915     .  0  0 "[    .    1    .    2]" 1 
        300 1  25 VAL QG   1 103 LEU QD   1.800 . 5.000 2.034 1.844 2.437     .  0  0 "[    .    1    .    2]" 1 
        301 1  25 VAL QG   1 106 ALA MB   1.800 . 5.000 2.487 1.937 5.032 0.032  4  0 "[    .    1    .    2]" 1 
        302 1  26 GLU H    1  27 LYS H    1.800 . 5.000 4.527 4.425 4.665     .  0  0 "[    .    1    .    2]" 1 
        303 1  26 GLU H    1  36 ASN HD21 1.800 . 5.000 4.237 3.199 5.023 0.023 11  0 "[    .    1    .    2]" 1 
        304 1  26 GLU H    1  36 ASN QD   1.800 . 5.000 3.841 3.058 4.444     .  0  0 "[    .    1    .    2]" 1 
        305 1  26 GLU H    1  36 ASN HD22 1.800 . 5.000 4.589 3.436 5.015 0.015 13  0 "[    .    1    .    2]" 1 
        306 1  26 GLU HA   1  27 LYS H    1.800 . 5.000 2.247 2.186 2.385     .  0  0 "[    .    1    .    2]" 1 
        307 1  26 GLU QB   1  29 GLY H    1.800 . 5.300 2.842 1.885 4.355     .  0  0 "[    .    1    .    2]" 1 
        308 1  26 GLU HB2  1  27 LYS H    1.800 . 5.000 4.157 3.737 4.375     .  0  0 "[    .    1    .    2]" 1 
        309 1  26 GLU HB3  1  27 LYS H    1.800 . 5.000 3.539 2.620 4.212     .  0  0 "[    .    1    .    2]" 1 
        310 1  27 LYS H    1  27 LYS QE   1.800 . 5.300 4.522 3.070 5.410 0.110  1  0 "[    .    1    .    2]" 1 
        311 1  27 LYS H    1  27 LYS HG2  1.800 . 5.000 2.838 2.062 4.506     .  0  0 "[    .    1    .    2]" 1 
        312 1  27 LYS H    1  27 LYS HG3  1.800 . 5.000 3.780 3.395 4.526     .  0  0 "[    .    1    .    2]" 1 
        313 1  27 LYS HA   1  28 GLY H    1.800 . 5.000 3.349 2.227 3.557     .  0  0 "[    .    1    .    2]" 1 
        314 1  27 LYS HA   1  38 HIS HB2  1.800 . 5.000 4.067 2.917 5.015 0.015 12  0 "[    .    1    .    2]" 1 
        315 1  27 LYS HA   1  38 HIS HB3  1.800 . 5.000 4.349 2.982 5.028 0.028 17  0 "[    .    1    .    2]" 1 
        316 1  27 LYS HB2  1  28 GLY H    1.800 . 5.000 3.810 3.359 4.195     .  0  0 "[    .    1    .    2]" 1 
        317 1  27 LYS HB3  1  28 GLY H    1.800 . 5.000 3.562 1.791 3.981 0.009 15  0 "[    .    1    .    2]" 1 
        318 1  27 LYS HD2  1  28 GLY H    1.800 . 5.000 4.649 4.281 5.091 0.091  1  0 "[    .    1    .    2]" 1 
        319 1  27 LYS HD3  1  28 GLY H    1.800 . 5.000 4.556 4.340 5.102 0.102 18  0 "[    .    1    .    2]" 1 
        320 1  27 LYS QE   1  28 GLY H    1.800 . 5.000 3.944 2.644 4.999     .  0  0 "[    .    1    .    2]" 1 
        321 1  27 LYS HG2  1  28 GLY H    1.800 . 3.500 2.232 2.063 2.671     .  0  0 "[    .    1    .    2]" 1 
        322 1  27 LYS HG3  1  28 GLY H    1.800 . 3.500 2.586 2.269 3.646 0.146 19  0 "[    .    1    .    2]" 1 
        323 1  28 GLY HA2  1  29 GLY H    1.800 . 3.500 3.340 2.738 3.541 0.041  4  0 "[    .    1    .    2]" 1 
        324 1  28 GLY HA3  1  29 GLY H    1.800 . 5.000 3.127 2.873 3.576     .  0  0 "[    .    1    .    2]" 1 
        325 1  29 GLY H    1  30 PRO HA   1.800 . 6.000 5.591 5.095 5.997     .  0  0 "[    .    1    .    2]" 1 
        326 1  29 GLY QA   1  36 ASN QD   1.800 . 5.000 4.486 2.672 5.052 0.052 18  0 "[    .    1    .    2]" 1 
        327 1  30 PRO HA   1  30 PRO HD2  1.800 . 5.000 4.096 4.077 4.101     .  0  0 "[    .    1    .    2]" 1 
        328 1  30 PRO HA   1  30 PRO HD3  1.800 . 5.000 3.627 3.475 3.709     .  0  0 "[    .    1    .    2]" 1 
        329 1  30 PRO HA   1  31 HIS H    1.800 . 3.500 2.960 2.492 3.510 0.010  6  0 "[    .    1    .    2]" 1 
        330 1  30 PRO HA   1  31 HIS HA   1.800 . 6.000 4.712 4.433 5.354     .  0  0 "[    .    1    .    2]" 1 
        331 1  30 PRO QB   1  30 PRO HD2  1.800 . 3.500 3.525 3.517 3.538 0.038  5  0 "[    .    1    .    2]" 1 
        332 1  30 PRO QB   1  30 PRO HD3  1.800 . 3.500 2.935 2.893 2.983     .  0  0 "[    .    1    .    2]" 1 
        333 1  30 PRO QB   1  31 HIS HA   1.800 . 5.000 4.450 4.227 5.084 0.084  8  0 "[    .    1    .    2]" 1 
        334 1  30 PRO HG2  1  31 HIS HA   1.800 . 5.000 4.853 4.510 5.002 0.002  1  0 "[    .    1    .    2]" 1 
        335 1  30 PRO HG3  1  31 HIS HA   1.800 . 6.300 6.357 6.181 6.432 0.132  1  0 "[    .    1    .    2]" 1 
        336 1  31 HIS HA   1  36 ASN H    1.800 . 5.300 3.789 3.188 4.697     .  0  0 "[    .    1    .    2]" 1 
        337 1  31 HIS HA   1  36 ASN HA   1.800 . 5.000 4.886 4.360 5.103 0.103 17  0 "[    .    1    .    2]" 1 
        338 1  31 HIS QB   1  35 PRO HA   1.800 . 5.000 3.264 2.421 4.499     .  0  0 "[    .    1    .    2]" 1 
        339 1  31 HIS QB   1  51 TYR QB   1.800 . 3.500 2.769 2.341 3.552 0.052 17  0 "[    .    1    .    2]" 1 
        340 1  31 HIS QB   1  51 TYR HE1  1.800 . 5.300 3.788 2.999 5.303 0.003 15  0 "[    .    1    .    2]" 1 
        341 1  31 HIS HB2  1  32 LYS H    1.800 . 5.000 4.275 4.115 4.642     .  0  0 "[    .    1    .    2]" 1 
        342 1  31 HIS HB2  1  51 TYR HD1  1.800 . 5.300 3.012 2.281 5.196     .  0  0 "[    .    1    .    2]" 1 
        343 1  31 HIS HB3  1  32 LYS H    1.800 . 5.000 3.608 3.144 4.475     .  0  0 "[    .    1    .    2]" 1 
        344 1  31 HIS HB3  1  51 TYR HD1  1.800 . 5.000 2.608 2.274 3.706     .  0  0 "[    .    1    .    2]" 1 
        345 1  31 HIS HD1  1  48 ALA MB   1.800 . 5.000 4.209 3.562 4.687     .  0  0 "[    .    1    .    2]" 1 
        346 1  31 HIS HD1  1  51 TYR QB   1.800 . 3.500 2.676 2.406 2.911     .  0  0 "[    .    1    .    2]" 1 
        347 1  31 HIS HD1  1  51 TYR HD1  1.800 . 5.000 4.402 4.117 5.013 0.013 17  0 "[    .    1    .    2]" 1 
        348 1  31 HIS HE1  1  35 PRO HA   1.800 . 5.000 3.715 3.157 4.171     .  0  0 "[    .    1    .    2]" 1 
        349 1  31 HIS HE1  1  35 PRO HB2  1.800 . 5.300 4.131 3.753 4.455     .  0  0 "[    .    1    .    2]" 1 
        350 1  31 HIS HE1  1  35 PRO QB   1.800 . 5.000 3.703 3.308 3.971     .  0  0 "[    .    1    .    2]" 1 
        351 1  31 HIS HE1  1  35 PRO HB3  1.800 . 5.000 4.196 3.562 4.776     .  0  0 "[    .    1    .    2]" 1 
        352 1  31 HIS HE1  1  36 ASN H    1.800 . 5.000 2.801 1.796 5.015 0.015  5  0 "[    .    1    .    2]" 1 
        353 1  31 HIS HE1  1  36 ASN HA   1.800 . 5.300 5.229 4.529 5.373 0.073 11  0 "[    .    1    .    2]" 1 
        354 1  31 HIS HE1  1  36 ASN HB2  1.800 . 5.000 3.226 2.776 3.502     .  0  0 "[    .    1    .    2]" 1 
        355 1  31 HIS HE1  1  36 ASN HB3  1.800 . 5.000 4.823 3.424 5.066 0.066  6  0 "[    .    1    .    2]" 1 
        356 1  31 HIS HE1  1  48 ALA MB   1.800 . 2.900 2.790 2.255 2.983 0.083  9  0 "[    .    1    .    2]" 1 
        357 1  31 HIS HE1  1  50 GLY QA   1.800 . 5.000 4.353 3.472 5.000 0.000 19  0 "[    .    1    .    2]" 1 
        358 1  31 HIS HE1  1  51 TYR QB   1.800 . 3.500 3.535 3.282 3.611 0.111  8  0 "[    .    1    .    2]" 1 
        359 1  32 LYS H    1  36 ASN HD21 1.800 . 3.500 3.519 3.295 3.615 0.115  8  0 "[    .    1    .    2]" 1 
        360 1  32 LYS H    1  36 ASN QD   1.800 . 5.000 2.518 2.060 3.130     .  0  0 "[    .    1    .    2]" 1 
        361 1  32 LYS H    1  36 ASN HD22 1.800 . 3.500 2.613 2.074 3.516 0.016 11  0 "[    .    1    .    2]" 1 
        362 1  32 LYS QB   1  33 VAL H    1.800 . 5.000 2.317 1.715 3.793 0.085 12  0 "[    .    1    .    2]" 1 
        363 1  32 LYS QB   1  33 VAL QG   1.800 . 5.000 3.350 2.319 3.891     .  0  0 "[    .    1    .    2]" 1 
        364 1  33 VAL H    1  33 VAL MG1  1.800 . 5.000 3.858 3.760 4.067     .  0  0 "[    .    1    .    2]" 1 
        365 1  33 VAL H    1  33 VAL MG2  1.800 . 5.000 2.382 2.162 2.815     .  0  0 "[    .    1    .    2]" 1 
        366 1  33 VAL HA   1  33 VAL MG1  1.800 . 3.500 2.363 2.217 2.420     .  0  0 "[    .    1    .    2]" 1 
        367 1  33 VAL HA   1  33 VAL MG2  1.800 . 3.500 2.319 2.214 2.613     .  0  0 "[    .    1    .    2]" 1 
        368 1  33 VAL MG1  1  34 GLY H    1.800 . 5.300 3.047 2.000 3.501     .  0  0 "[    .    1    .    2]" 1 
        369 1  33 VAL MG2  1  34 GLY H    1.800 . 5.000 3.759 3.213 3.954     .  0  0 "[    .    1    .    2]" 1 
        370 1  34 GLY QA   1  35 PRO QD   1.800 . 5.000 2.018 1.999 2.057     .  0  0 "[    .    1    .    2]" 1 
        371 1  35 PRO HA   1  36 ASN H    1.800 . 5.000 2.404 2.238 3.300     .  0  0 "[    .    1    .    2]" 1 
        372 1  35 PRO HA   1  36 ASN HA   1.800 . 5.000 4.492 4.398 5.155 0.155  5  0 "[    .    1    .    2]" 1 
        373 1  35 PRO QB   1  48 ALA MB   1.800 . 3.500 2.860 1.941 3.535 0.035  6  0 "[    .    1    .    2]" 1 
        374 1  35 PRO QB   1  51 TYR QB   1.800 . 5.000 2.379 2.201 3.121     .  0  0 "[    .    1    .    2]" 1 
        375 1  35 PRO QB   1  51 TYR QE   1.800 . 5.000 4.553 3.889 5.027 0.027 11  0 "[    .    1    .    2]" 1 
        376 1  35 PRO HB2  1  36 ASN H    1.800 . 5.000 3.240 3.031 3.953     .  0  0 "[    .    1    .    2]" 1 
        377 1  35 PRO HB2  1  51 TYR QD   1.800 . 5.000 4.532 4.008 5.005 0.005 17  0 "[    .    1    .    2]" 1 
        378 1  35 PRO HB3  1  36 ASN H    1.800 . 5.000 3.762 3.581 4.597     .  0  0 "[    .    1    .    2]" 1 
        379 1  35 PRO HB3  1  51 TYR QD   1.800 . 5.000 2.924 2.287 3.297     .  0  0 "[    .    1    .    2]" 1 
        380 1  35 PRO QG   1  36 ASN H    1.800 . 5.000 4.466 3.495 4.811     .  0  0 "[    .    1    .    2]" 1 
        381 1  35 PRO QG   1  40 ILE MD   1.800 . 5.000 4.680 3.988 5.067 0.067  6  0 "[    .    1    .    2]" 1 
        382 1  35 PRO QG   1  51 TYR QD   1.800 . 5.000 3.226 2.559 4.085     .  0  0 "[    .    1    .    2]" 1 
        383 1  35 PRO QG   1  51 TYR QE   1.800 . 5.000 4.191 3.394 5.003 0.003 17  0 "[    .    1    .    2]" 1 
        384 1  36 ASN H    1  37 LEU H    1.800 . 5.000 4.549 3.924 4.668     .  0  0 "[    .    1    .    2]" 1 
        385 1  36 ASN H    1  48 ALA MB   1.800 . 5.000 4.132 3.296 4.855     .  0  0 "[    .    1    .    2]" 1 
        386 1  36 ASN HA   1  37 LEU H    1.800 . 5.000 2.246 2.193 2.292     .  0  0 "[    .    1    .    2]" 1 
        387 1  36 ASN HB2  1  37 LEU H    1.800 . 5.000 4.075 3.882 4.558     .  0  0 "[    .    1    .    2]" 1 
        388 1  36 ASN HB3  1  37 LEU H    1.800 . 5.000 3.195 2.946 3.728     .  0  0 "[    .    1    .    2]" 1 
        389 1  37 LEU H    1  37 LEU MD1  1.800 . 5.000 2.125 1.767 4.091 0.033  6  0 "[    .    1    .    2]" 1 
        390 1  37 LEU H    1  37 LEU MD2  1.800 . 5.000 4.017 3.874 4.417     .  0  0 "[    .    1    .    2]" 1 
        391 1  37 LEU H    1  37 LEU HG   1.800 . 5.000 3.794 3.573 4.532     .  0  0 "[    .    1    .    2]" 1 
        392 1  37 LEU H    1  38 HIS H    1.800 . 5.000 4.393 2.501 4.588     .  0  0 "[    .    1    .    2]" 1 
        393 1  37 LEU H    1  40 ILE MD   1.800 . 6.000 5.559 5.215 6.027 0.027 17  0 "[    .    1    .    2]" 1 
        394 1  37 LEU H    1  40 ILE MG   1.800 . 6.000 5.748 4.685 6.092 0.092 17  0 "[    .    1    .    2]" 1 
        395 1  37 LEU HA   1  37 LEU MD1  1.800 . 5.000 2.822 2.150 3.133     .  0  0 "[    .    1    .    2]" 1 
        396 1  37 LEU HA   1  37 LEU MD2  1.800 . 5.000 3.716 3.552 3.791     .  0  0 "[    .    1    .    2]" 1 
        397 1  37 LEU QB   1 103 LEU QD   1.800 . 5.000 3.081 2.609 3.774     .  0  0 "[    .    1    .    2]" 1 
        398 1  37 LEU HB2  1  40 ILE MG   1.800 . 5.300 4.141 3.527 4.538     .  0  0 "[    .    1    .    2]" 1 
        399 1  37 LEU HB3  1  40 ILE MG   1.800 . 5.000 2.847 2.108 4.460     .  0  0 "[    .    1    .    2]" 1 
        400 1  37 LEU MD1  1 103 LEU MD1  1.800 . 5.000 4.065 3.468 4.895     .  0  0 "[    .    1    .    2]" 1 
        401 1  37 LEU MD1  1 103 LEU MD2  1.800 . 5.000 4.185 3.408 5.011 0.011  8  0 "[    .    1    .    2]" 1 
        402 1  37 LEU MD2  1 103 LEU MD1  1.800 . 5.000 2.475 1.788 3.250 0.012 16  0 "[    .    1    .    2]" 1 
        403 1  37 LEU MD2  1 103 LEU MD2  1.800 . 5.000 3.217 2.085 4.159     .  0  0 "[    .    1    .    2]" 1 
        404 1  37 LEU HG   1  69 MET ME   1.800 . 5.000 4.842 4.067 5.032 0.032 19  0 "[    .    1    .    2]" 1 
        405 1  38 HIS HA   1  39 GLY H    1.800 . 3.500 2.327 2.194 3.529 0.029  9  0 "[    .    1    .    2]" 1 
        406 1  38 HIS HA   1  40 ILE H    1.800 . 6.000 3.703 3.356 4.678     .  0  0 "[    .    1    .    2]" 1 
        407 1  38 HIS HA   1  41 PHE QD   1.800 . 5.300 5.352 5.282 5.391 0.091  4  0 "[    .    1    .    2]" 1 
        408 1  39 GLY H    1  40 ILE MD   1.800 . 6.300 5.913 5.382 6.078     .  0  0 "[    .    1    .    2]" 1 
        409 1  39 GLY H    1  40 ILE MG   1.800 . 6.000 3.762 3.568 4.342     .  0  0 "[    .    1    .    2]" 1 
        410 1  39 GLY HA2  1  40 ILE H    1.800 . 5.000 3.181 2.663 3.251     .  0  0 "[    .    1    .    2]" 1 
        411 1  39 GLY HA3  1  40 ILE H    1.800 . 5.000 3.361 3.319 3.587     .  0  0 "[    .    1    .    2]" 1 
        412 1  40 ILE H    1  40 ILE HA   1.800 . 2.900 2.841 2.825 2.984 0.084  9  0 "[    .    1    .    2]" 1 
        413 1  40 ILE H    1  40 ILE HB   1.800 . 3.500 2.387 2.328 2.860     .  0  0 "[    .    1    .    2]" 1 
        414 1  40 ILE H    1  40 ILE MD   1.800 . 5.000 4.164 3.798 4.502     .  0  0 "[    .    1    .    2]" 1 
        415 1  40 ILE H    1  40 ILE QG   1.800 . 5.000 3.982 3.948 4.067     .  0  0 "[    .    1    .    2]" 1 
        416 1  40 ILE H    1  40 ILE MG   1.800 . 5.000 2.333 2.031 2.485     .  0  0 "[    .    1    .    2]" 1 
        417 1  40 ILE H    1  41 PHE H    1.800 . 2.900 2.674 2.193 2.718     .  0  0 "[    .    1    .    2]" 1 
        418 1  40 ILE HA   1  40 ILE MD   1.800 . 5.000 3.363 2.227 3.658     .  0  0 "[    .    1    .    2]" 1 
        419 1  40 ILE HA   1  40 ILE QG   1.800 . 5.000 2.270 2.215 2.510     .  0  0 "[    .    1    .    2]" 1 
        420 1  40 ILE HA   1  40 ILE MG   1.800 . 3.500 3.182 3.173 3.188     .  0  0 "[    .    1    .    2]" 1 
        421 1  40 ILE HA   1  41 PHE H    1.800 . 3.500 3.462 3.283 3.481     .  0  0 "[    .    1    .    2]" 1 
        422 1  40 ILE HA   1  43 ARG H    1.800 . 5.000 4.479 4.359 4.733     .  0  0 "[    .    1    .    2]" 1 
        423 1  40 ILE HA   1  43 ARG QD   1.800 . 5.300 3.147 2.293 5.109     .  0  0 "[    .    1    .    2]" 1 
        424 1  40 ILE HA   1  43 ARG QG   1.800 . 5.000 3.656 2.242 4.308     .  0  0 "[    .    1    .    2]" 1 
        425 1  40 ILE HB   1  41 PHE H    1.800 . 5.000 4.013 3.967 4.339     .  0  0 "[    .    1    .    2]" 1 
        426 1  40 ILE MD   1  41 PHE H    1.800 . 5.300 4.998 4.908 5.347 0.047  9  0 "[    .    1    .    2]" 1 
        427 1  40 ILE MD   1  64 TRP HD1  1.800 . 5.000 3.286 2.469 3.781     .  0  0 "[    .    1    .    2]" 1 
        428 1  40 ILE MD   1  69 MET ME   1.800 . 5.000 3.280 2.390 4.747     .  0  0 "[    .    1    .    2]" 1 
        429 1  40 ILE QG   1  41 PHE HA   1.800 . 6.000 4.156 4.065 4.296     .  0  0 "[    .    1    .    2]" 1 
        430 1  40 ILE QG   1  64 TRP HD1  1.800 . 5.000 2.866 2.293 3.363     .  0  0 "[    .    1    .    2]" 1 
        431 1  40 ILE QG   1  64 TRP HZ3  1.800 . 6.300 6.286 6.166 6.336 0.036 15  0 "[    .    1    .    2]" 1 
        432 1  40 ILE MG   1  41 PHE H    1.800 . 3.500 2.284 2.119 2.940     .  0  0 "[    .    1    .    2]" 1 
        433 1  40 ILE MG   1  41 PHE QD   1.800 . 3.500 2.695 2.486 3.165     .  0  0 "[    .    1    .    2]" 1 
        434 1  40 ILE MG   1  41 PHE QE   1.800 . 3.500 3.172 2.938 3.506 0.006  9  0 "[    .    1    .    2]" 1 
        435 1  40 ILE MG   1  41 PHE HZ   1.800 . 5.300 4.259 3.983 4.511     .  0  0 "[    .    1    .    2]" 1 
        436 1  40 ILE MG   1  64 TRP HD1  1.800 . 5.300 4.810 4.268 5.274     .  0  0 "[    .    1    .    2]" 1 
        437 1  40 ILE MG   1 100 ILE MG   1.800 . 6.300 5.502 5.262 5.742     .  0  0 "[    .    1    .    2]" 1 
        438 1  41 PHE H    1  41 PHE HB2  1.800 . 3.500 2.392 2.294 2.446     .  0  0 "[    .    1    .    2]" 1 
        439 1  41 PHE H    1  41 PHE HB3  1.800 . 3.500 3.590 3.583 3.597 0.097 13  0 "[    .    1    .    2]" 1 
        440 1  41 PHE H    1  42 GLY H    1.800 . 5.000 4.615 4.560 4.644     .  0  0 "[    .    1    .    2]" 1 
        441 1  41 PHE H    1  69 MET ME   1.800 . 5.000 3.845 3.528 4.280     .  0  0 "[    .    1    .    2]" 1 
        442 1  41 PHE HA   1  41 PHE QD   1.800 . 5.000 2.873 2.730 2.950     .  0  0 "[    .    1    .    2]" 1 
        443 1  41 PHE HA   1  42 GLY H    1.800 . 3.500 2.217 2.192 2.239     .  0  0 "[    .    1    .    2]" 1 
        444 1  41 PHE HB2  1  42 GLY H    1.800 . 5.000 4.222 4.143 4.336     .  0  0 "[    .    1    .    2]" 1 
        445 1  41 PHE HB2  1  69 MET ME   1.800 . 5.000 4.608 4.260 5.027 0.027 18  0 "[    .    1    .    2]" 1 
        446 1  41 PHE HB3  1  42 GLY H    1.800 . 5.000 3.230 3.106 3.339     .  0  0 "[    .    1    .    2]" 1 
        447 1  41 PHE HB3  1  69 MET ME   1.800 . 5.000 4.401 4.120 4.746     .  0  0 "[    .    1    .    2]" 1 
        448 1  41 PHE QD   1  64 TRP QB   1.800 . 5.000 4.630 4.399 4.775     .  0  0 "[    .    1    .    2]" 1 
        449 1  41 PHE QD   1  66 GLU H    1.800 . 5.000 2.974 2.343 3.908     .  0  0 "[    .    1    .    2]" 1 
        450 1  41 PHE QD   1  69 MET QB   1.800 . 6.000 4.540 3.374 5.110     .  0  0 "[    .    1    .    2]" 1 
        451 1  41 PHE QD   1  69 MET ME   1.800 . 3.500 3.031 2.658 3.358     .  0  0 "[    .    1    .    2]" 1 
        452 1  41 PHE QD   1 104 LYS HA   1.800 . 5.000 3.899 3.638 4.105     .  0  0 "[    .    1    .    2]" 1 
        453 1  41 PHE QE   1  66 GLU HA   1.800 . 3.500 2.675 2.278 3.264     .  0  0 "[    .    1    .    2]" 1 
        454 1  41 PHE QE   1  66 GLU QB   1.800 . 5.000 4.345 3.852 4.976     .  0  0 "[    .    1    .    2]" 1 
        455 1  41 PHE QE   1  69 MET ME   1.800 . 3.500 2.797 2.500 3.127     .  0  0 "[    .    1    .    2]" 1 
        456 1  41 PHE QE   1  69 MET QG   1.800 . 5.000 3.004 2.266 3.878     .  0  0 "[    .    1    .    2]" 1 
        457 1  41 PHE QE   1 100 ILE MD   1.800 . 5.000 4.241 3.989 4.685     .  0  0 "[    .    1    .    2]" 1 
        458 1  41 PHE QE   1 103 LEU H    1.800 . 5.000 5.041 4.941 5.095 0.095  4  0 "[    .    1    .    2]" 1 
        459 1  41 PHE QE   1 103 LEU QD   1.800 . 5.000 3.375 3.174 3.570     .  0  0 "[    .    1    .    2]" 1 
        460 1  41 PHE QE   1 104 LYS H    1.800 . 5.000 3.975 3.683 4.129     .  0  0 "[    .    1    .    2]" 1 
        461 1  41 PHE QE   1 104 LYS HA   1.800 . 5.000 3.280 2.819 3.573     .  0  0 "[    .    1    .    2]" 1 
        462 1  41 PHE HZ   1  69 MET QB   1.800 . 5.000 4.482 4.174 4.724     .  0  0 "[    .    1    .    2]" 1 
        463 1  41 PHE HZ   1  69 MET ME   1.800 . 3.500 3.076 2.623 3.334     .  0  0 "[    .    1    .    2]" 1 
        464 1  41 PHE HZ   1 100 ILE QG   1.800 . 5.000 4.588 4.230 4.982     .  0  0 "[    .    1    .    2]" 1 
        465 1  41 PHE HZ   1 100 ILE MG   1.800 . 2.900 2.726 2.465 2.911 0.011 19  0 "[    .    1    .    2]" 1 
        466 1  42 GLY H    1  43 ARG H    1.800 . 3.500 2.532 2.454 2.595     .  0  0 "[    .    1    .    2]" 1 
        467 1  42 GLY H    1  63 LEU QD   1.800 . 6.000 3.781 2.804 4.214     .  0  0 "[    .    1    .    2]" 1 
        468 1  42 GLY H    1  64 TRP QB   1.800 . 5.000 3.699 3.535 3.838     .  0  0 "[    .    1    .    2]" 1 
        469 1  42 GLY QA   1  63 LEU MD1  1.800 . 5.000 3.236 2.619 3.578     .  0  0 "[    .    1    .    2]" 1 
        470 1  42 GLY QA   1  63 LEU MD2  1.800 . 5.000 3.396 2.329 4.129     .  0  0 "[    .    1    .    2]" 1 
        471 1  42 GLY HA2  1  43 ARG H    1.800 . 5.000 3.036 2.952 3.096     .  0  0 "[    .    1    .    2]" 1 
        472 1  42 GLY HA3  1  43 ARG H    1.800 . 5.000 3.485 3.449 3.531     .  0  0 "[    .    1    .    2]" 1 
        473 1  43 ARG H    1  43 ARG HA   1.800 . 2.900 2.976 2.957 2.992 0.092 16  0 "[    .    1    .    2]" 1 
        474 1  43 ARG H    1  43 ARG QB   1.800 . 3.500 2.691 2.577 2.781     .  0  0 "[    .    1    .    2]" 1 
        475 1  43 ARG H    1  43 ARG QD   1.800 . 5.000 4.454 3.868 4.928     .  0  0 "[    .    1    .    2]" 1 
        476 1  43 ARG H    1  43 ARG QG   1.800 . 5.000 3.100 2.706 4.132     .  0  0 "[    .    1    .    2]" 1 
        477 1  43 ARG H    1  62 VAL MG1  1.800 . 8.300 7.191 7.050 7.357     .  0  0 "[    .    1    .    2]" 1 
        478 1  43 ARG H    1  63 LEU MD1  1.800 . 6.000 3.056 2.268 4.753     .  0  0 "[    .    1    .    2]" 1 
        479 1  43 ARG H    1  63 LEU MD2  1.800 . 6.000 4.629 2.713 5.287     .  0  0 "[    .    1    .    2]" 1 
        480 1  43 ARG H    1  64 TRP H    1.800 . 5.000 3.258 2.833 3.537     .  0  0 "[    .    1    .    2]" 1 
        481 1  43 ARG H    1  64 TRP HB2  1.800 . 5.000 3.047 2.798 3.231     .  0  0 "[    .    1    .    2]" 1 
        482 1  43 ARG H    1  64 TRP HB3  1.800 . 6.300 4.307 3.963 4.532     .  0  0 "[    .    1    .    2]" 1 
        483 1  43 ARG H    1  64 TRP HD1  1.800 . 5.000 4.812 4.568 5.009 0.009 20  0 "[    .    1    .    2]" 1 
        484 1  43 ARG HA   1  43 ARG QD   1.800 . 5.000 3.605 2.144 4.199     .  0  0 "[    .    1    .    2]" 1 
        485 1  43 ARG HA   1  43 ARG QG   1.800 . 5.000 2.436 2.280 2.923     .  0  0 "[    .    1    .    2]" 1 
        486 1  43 ARG HA   1  44 HIS H    1.800 . 3.500 2.407 2.306 2.479     .  0  0 "[    .    1    .    2]" 1 
        487 1  43 ARG HA   1  64 TRP HD1  1.800 . 7.000 5.894 5.634 6.134     .  0  0 "[    .    1    .    2]" 1 
        488 1  43 ARG QB   1  44 HIS H    1.800 . 5.000 2.577 2.338 3.482     .  0  0 "[    .    1    .    2]" 1 
        489 1  43 ARG QB   1  64 TRP HD1  1.800 . 6.800 4.291 3.450 4.732     .  0  0 "[    .    1    .    2]" 1 
        490 1  43 ARG QD   1  44 HIS H    1.800 . 5.000 4.314 3.560 4.894     .  0  0 "[    .    1    .    2]" 1 
        491 1  43 ARG QD   1  47 GLN QB   1.800 . 5.000 3.644 2.240 4.227     .  0  0 "[    .    1    .    2]" 1 
        492 1  43 ARG QG   1  64 TRP HD1  1.800 . 6.800 6.042 4.701 6.609     .  0  0 "[    .    1    .    2]" 1 
        493 1  44 HIS H    1  44 HIS HA   1.800 . 2.900 2.962 2.947 2.987 0.087 12  0 "[    .    1    .    2]" 1 
        494 1  44 HIS H    1  45 SER H    1.800 . 5.000 4.592 4.437 4.627     .  0  0 "[    .    1    .    2]" 1 
        495 1  44 HIS H    1  47 GLN QB   1.800 . 5.000 3.961 2.399 4.811     .  0  0 "[    .    1    .    2]" 1 
        496 1  44 HIS H    1  47 GLN QE   1.800 . 5.000 4.715 3.853 5.060 0.060  1  0 "[    .    1    .    2]" 1 
        497 1  44 HIS H    1  63 LEU MD1  1.800 . 6.000 3.708 3.430 5.768     .  0  0 "[    .    1    .    2]" 1 
        498 1  44 HIS H    1  63 LEU MD2  1.800 . 6.000 5.890 5.048 6.022 0.022 20  0 "[    .    1    .    2]" 1 
        499 1  44 HIS HA   1  44 HIS HD2  1.800 . 5.000 3.209 2.668 3.284     .  0  0 "[    .    1    .    2]" 1 
        500 1  44 HIS HA   1  45 SER H    1.800 . 5.000 2.342 2.214 2.485     .  0  0 "[    .    1    .    2]" 1 
        501 1  44 HIS HA   1  63 LEU HA   1.800 . 5.300 2.471 2.284 2.865     .  0  0 "[    .    1    .    2]" 1 
        502 1  44 HIS HA   1  63 LEU QB   1.800 . 7.300 4.323 3.857 4.711     .  0  0 "[    .    1    .    2]" 1 
        503 1  44 HIS HA   1  63 LEU MD1  1.800 . 6.800 3.084 2.676 5.113     .  0  0 "[    .    1    .    2]" 1 
        504 1  44 HIS HA   1  63 LEU MD2  1.800 . 6.800 5.234 4.168 5.577     .  0  0 "[    .    1    .    2]" 1 
        505 1  44 HIS HA   1  63 LEU HG   1.800 . 6.000 4.799 3.350 5.191     .  0  0 "[    .    1    .    2]" 1 
        506 1  44 HIS HA   1  64 TRP H    1.800 . 5.000 3.049 2.758 3.535     .  0  0 "[    .    1    .    2]" 1 
        507 1  44 HIS HB2  1  45 SER H    1.800 . 5.000 3.875 3.595 4.386     .  0  0 "[    .    1    .    2]" 1 
        508 1  44 HIS HB3  1  45 SER H    1.800 . 5.000 2.773 2.397 3.780     .  0  0 "[    .    1    .    2]" 1 
        509 1  44 HIS HD2  1  61 ASN HA   1.800 . 6.800 6.047 4.478 6.822 0.022 16  0 "[    .    1    .    2]" 1 
        510 1  44 HIS HD2  1  62 VAL HA   1.800 . 6.300 4.448 3.914 4.849     .  0  0 "[    .    1    .    2]" 1 
        511 1  44 HIS HD2  1  62 VAL MG1  1.800 . 6.300 5.466 4.259 6.050     .  0  0 "[    .    1    .    2]" 1 
        512 1  44 HIS HD2  1  62 VAL MG2  1.800 . 6.300 5.327 4.803 5.672     .  0  0 "[    .    1    .    2]" 1 
        513 1  44 HIS HD2  1  63 LEU H    1.800 . 6.000 3.994 3.403 4.376     .  0  0 "[    .    1    .    2]" 1 
        514 1  44 HIS HD2  1  63 LEU QB   1.800 . 5.000 3.186 2.469 4.405     .  0  0 "[    .    1    .    2]" 1 
        515 1  44 HIS HD2  1  63 LEU MD1  1.800 . 6.000 3.152 2.868 4.319     .  0  0 "[    .    1    .    2]" 1 
        516 1  44 HIS HD2  1  63 LEU MD2  1.800 . 6.000 4.819 4.213 6.022 0.022 12  0 "[    .    1    .    2]" 1 
        517 1  44 HIS HE1  1  63 LEU QB   1.800 . 5.300 4.588 2.583 5.077     .  0  0 "[    .    1    .    2]" 1 
        518 1  44 HIS HE1  1  63 LEU MD1  1.800 . 6.000 3.110 2.504 3.712     .  0  0 "[    .    1    .    2]" 1 
        519 1  44 HIS HE1  1  63 LEU MD2  1.800 . 5.300 4.239 3.156 5.306 0.006  7  0 "[    .    1    .    2]" 1 
        520 1  45 SER H    1  45 SER HA   1.800 . 2.900 2.816 2.342 2.934 0.034 18  0 "[    .    1    .    2]" 1 
        521 1  45 SER H    1  46 GLY H    1.800 . 5.000 4.567 2.745 4.687     .  0  0 "[    .    1    .    2]" 1 
        522 1  45 SER H    1  61 ASN HA   1.800 . 6.000 4.585 3.816 5.113     .  0  0 "[    .    1    .    2]" 1 
        523 1  45 SER H    1  61 ASN HD22 1.800 . 5.000 2.319 1.782 4.958 0.018 17  0 "[    .    1    .    2]" 1 
        524 1  45 SER H    1  62 VAL MG1  1.800 . 6.000 3.999 3.626 4.705     .  0  0 "[    .    1    .    2]" 1 
        525 1  45 SER H    1  62 VAL MG2  1.800 . 6.800 5.621 5.341 6.058     .  0  0 "[    .    1    .    2]" 1 
        526 1  45 SER HA   1  46 GLY H    1.800 . 3.500 2.452 2.274 3.543 0.043  9  0 "[    .    1    .    2]" 1 
        527 1  45 SER HA   1  64 TRP HD1  1.800 . 6.300 3.269 2.610 4.948     .  0  0 "[    .    1    .    2]" 1 
        528 1  45 SER HA   1  64 TRP HE1  1.800 . 5.300 3.239 2.208 4.269     .  0  0 "[    .    1    .    2]" 1 
        529 1  45 SER QB   1  57 ASN QD   1.800 . 5.300 2.424 1.828 5.343 0.043 12  0 "[    .    1    .    2]" 1 
        530 1  45 SER QB   1  62 VAL H    1.800 . 6.000 3.505 2.608 5.336     .  0  0 "[    .    1    .    2]" 1 
        531 1  45 SER QB   1  62 VAL MG1  1.800 . 6.800 3.527 2.576 6.058     .  0  0 "[    .    1    .    2]" 1 
        532 1  45 SER QB   1  62 VAL MG2  1.800 . 8.000 5.657 4.899 7.542     .  0  0 "[    .    1    .    2]" 1 
        533 1  45 SER HB2  1  46 GLY QA   1.800 . 5.300 4.352 3.936 5.208     .  0  0 "[    .    1    .    2]" 1 
        534 1  45 SER HB3  1  46 GLY H    1.800 . 5.000 3.666 2.400 4.041     .  0  0 "[    .    1    .    2]" 1 
        535 1  46 GLY H    1  46 GLY HA2  1.800 . 2.900 2.481 2.375 2.928 0.028 12  0 "[    .    1    .    2]" 1 
        536 1  46 GLY H    1  46 GLY HA3  1.800 . 2.900 2.869 2.337 2.970 0.070 20  0 "[    .    1    .    2]" 1 
        537 1  46 GLY H    1  47 GLN H    1.800 . 5.000 2.665 2.376 3.912     .  0  0 "[    .    1    .    2]" 1 
        538 1  46 GLY H    1  57 ASN QD   1.800 . 5.000 5.007 4.794 5.080 0.080  4  0 "[    .    1    .    2]" 1 
        539 1  46 GLY H    1  61 ASN QD   1.800 . 6.300 4.331 2.634 4.903     .  0  0 "[    .    1    .    2]" 1 
        540 1  46 GLY H    1  64 TRP HD1  1.800 . 6.000 5.476 4.798 6.030 0.030 16  0 "[    .    1    .    2]" 1 
        541 1  46 GLY QA   1  47 GLN H    1.800 . 3.500 2.863 2.437 2.939     .  0  0 "[    .    1    .    2]" 1 
        542 1  46 GLY QA   1  48 ALA H    1.800 . 5.300 3.728 3.309 3.902     .  0  0 "[    .    1    .    2]" 1 
        543 1  46 GLY QA   1  53 TYR QB   1.800 . 5.000 4.116 3.676 4.578     .  0  0 "[    .    1    .    2]" 1 
        544 1  46 GLY QA   1  53 TYR QD   1.800 . 5.000 3.342 2.949 3.774     .  0  0 "[    .    1    .    2]" 1 
        545 1  46 GLY QA   1  58 ILE QG   1.800 . 5.000 4.832 4.551 5.082 0.082 17  0 "[    .    1    .    2]" 1 
        546 1  46 GLY QA   1  58 ILE MG   1.800 . 6.000 5.678 5.136 6.091 0.091 12  0 "[    .    1    .    2]" 1 
        547 1  47 GLN H    1  47 GLN HG2  1.800 . 5.000 4.481 3.914 4.658     .  0  0 "[    .    1    .    2]" 1 
        548 1  47 GLN H    1  47 GLN HG3  1.800 . 5.000 4.338 2.730 4.485     .  0  0 "[    .    1    .    2]" 1 
        549 1  47 GLN HA   1  47 GLN HG2  1.800 . 3.500 2.910 2.419 3.654 0.154 17  0 "[    .    1    .    2]" 1 
        550 1  47 GLN QG   1  49 GLU HB2  1.800 . 6.000 5.700 5.351 6.080 0.080  3  0 "[    .    1    .    2]" 1 
        551 1  47 GLN QG   1  49 GLU HB3  1.800 . 6.800 6.773 6.601 6.863 0.063  3  0 "[    .    1    .    2]" 1 
        552 1  47 GLN QG   1  49 GLU QG   1.800 . 5.000 4.099 3.926 4.307     .  0  0 "[    .    1    .    2]" 1 
        553 1  48 ALA H    1  48 ALA HA   1.800 . 2.900 2.845 2.817 2.894     .  0  0 "[    .    1    .    2]" 1 
        554 1  48 ALA H    1  48 ALA MB   1.800 . 2.900 2.187 2.096 2.262     .  0  0 "[    .    1    .    2]" 1 
        555 1  48 ALA HA   1  49 GLU H    1.800 . 3.500 2.991 2.229 3.556 0.056  4  0 "[    .    1    .    2]" 1 
        556 1  48 ALA MB   1  49 GLU H    1.800 . 3.500 2.922 2.392 3.705 0.205  2  0 "[    .    1    .    2]" 1 
        557 1  49 GLU H    1  49 GLU QG   1.800 . 3.500 2.536 2.126 2.805     .  0  0 "[    .    1    .    2]" 1 
        558 1  49 GLU H    1  50 GLY QA   1.800 . 6.000 4.875 4.535 5.418     .  0  0 "[    .    1    .    2]" 1 
        559 1  49 GLU HA   1  49 GLU QG   1.800 . 5.000 2.438 2.320 2.902     .  0  0 "[    .    1    .    2]" 1 
        560 1  50 GLY QA   1  51 TYR QD   1.800 . 6.000 5.350 5.264 5.451     .  0  0 "[    .    1    .    2]" 1 
        561 1  51 TYR QB   1  53 TYR QD   1.800 . 6.000 4.803 4.296 5.111     .  0  0 "[    .    1    .    2]" 1 
        562 1  51 TYR HE2  1  84 LYS HE2  1.800 . 5.000 4.993 4.777 5.062 0.062 11  0 "[    .    1    .    2]" 1 
        563 1  51 TYR HE2  1  84 LYS HE3  1.800 . 5.300 5.124 4.487 5.350 0.050  2  0 "[    .    1    .    2]" 1 
        564 1  53 TYR H    1  54 THR H    1.800 . 5.000 4.519 4.474 4.571     .  0  0 "[    .    1    .    2]" 1 
        565 1  53 TYR HA   1  54 THR H    1.800 . 5.000 2.281 2.231 2.389     .  0  0 "[    .    1    .    2]" 1 
        566 1  53 TYR HB2  1  54 THR H    1.800 . 5.000 4.093 3.935 4.283     .  0  0 "[    .    1    .    2]" 1 
        567 1  53 TYR HB3  1  54 THR H    1.800 . 5.000 2.937 2.641 3.162     .  0  0 "[    .    1    .    2]" 1 
        568 1  53 TYR QD   1  54 THR H    1.800 . 5.000 3.756 3.410 4.032     .  0  0 "[    .    1    .    2]" 1 
        569 1  53 TYR QD   1  57 ASN QB   1.800 . 5.000 2.921 2.642 3.489     .  0  0 "[    .    1    .    2]" 1 
        570 1  53 TYR QD   1  57 ASN HD21 1.800 . 5.300 5.190 4.392 5.411 0.111 16  0 "[    .    1    .    2]" 1 
        571 1  53 TYR QD   1  57 ASN HD22 1.800 . 6.300 5.037 4.073 5.424     .  0  0 "[    .    1    .    2]" 1 
        572 1  53 TYR QD   1  58 ILE MD   1.800 . 5.000 4.052 3.027 4.817     .  0  0 "[    .    1    .    2]" 1 
        573 1  53 TYR QD   1  58 ILE QG   1.800 . 5.300 3.846 3.483 4.235     .  0  0 "[    .    1    .    2]" 1 
        574 1  53 TYR QE   1  54 THR H    1.800 . 6.300 5.770 5.461 5.945     .  0  0 "[    .    1    .    2]" 1 
        575 1  54 THR H    1  54 THR MG   1.800 . 5.000 2.615 1.844 3.785     .  0  0 "[    .    1    .    2]" 1 
        576 1  54 THR H    1  55 ASP H    1.800 . 5.000 4.654 4.633 4.686     .  0  0 "[    .    1    .    2]" 1 
        577 1  54 THR H    1  57 ASN H    1.800 . 5.000 4.402 4.253 4.687     .  0  0 "[    .    1    .    2]" 1 
        578 1  54 THR H    1  57 ASN QB   1.800 . 5.000 3.770 3.375 4.084     .  0  0 "[    .    1    .    2]" 1 
        579 1  54 THR H    1  83 THR HB   1.800 . 6.000 5.488 4.728 6.033 0.033 20  0 "[    .    1    .    2]" 1 
        580 1  54 THR HA   1  54 THR MG   1.800 . 3.500 2.463 2.223 3.180     .  0  0 "[    .    1    .    2]" 1 
        581 1  54 THR HA   1  55 ASP H    1.800 . 3.500 2.364 2.271 2.450     .  0  0 "[    .    1    .    2]" 1 
        582 1  54 THR HB   1  55 ASP H    1.800 . 5.000 3.132 2.513 4.123     .  0  0 "[    .    1    .    2]" 1 
        583 1  54 THR MG   1  55 ASP H    1.800 . 5.000 3.293 1.885 3.976     .  0  0 "[    .    1    .    2]" 1 
        584 1  54 THR MG   1  83 THR HB   1.800 . 3.500 3.267 2.021 3.517 0.017 18  0 "[    .    1    .    2]" 1 
        585 1  54 THR MG   1  84 LYS H    1.800 . 5.000 3.254 2.549 4.233     .  0  0 "[    .    1    .    2]" 1 
        586 1  55 ASP H    1  55 ASP HA   1.800 . 2.900 2.814 2.778 2.837     .  0  0 "[    .    1    .    2]" 1 
        587 1  55 ASP H    1  55 ASP HB2  1.800 . 3.500 2.475 2.453 2.510     .  0  0 "[    .    1    .    2]" 1 
        588 1  55 ASP HA   1  55 ASP HB2  1.800 . 2.900 3.020 3.018 3.021 0.121 16  0 "[    .    1    .    2]" 1 
        589 1  55 ASP HA   1  55 ASP HB3  1.800 . 2.900 2.516 2.513 2.522     .  0  0 "[    .    1    .    2]" 1 
        590 1  55 ASP HA   1  56 ALA H    1.800 . 5.000 3.526 3.505 3.547     .  0  0 "[    .    1    .    2]" 1 
        591 1  55 ASP HA   1  58 ILE HB   1.800 . 2.900 2.310 2.259 2.473     .  0  0 "[    .    1    .    2]" 1 
        592 1  55 ASP HA   1  58 ILE MD   1.800 . 5.000 2.824 2.055 4.889     .  0  0 "[    .    1    .    2]" 1 
        593 1  55 ASP HA   1  59 LYS H    1.800 . 5.000 3.478 3.187 3.801     .  0  0 "[    .    1    .    2]" 1 
        594 1  55 ASP HA   1  59 LYS QB   1.800 . 5.000 4.265 3.736 5.018 0.018  5  0 "[    .    1    .    2]" 1 
        595 1  55 ASP HB2  1  56 ALA H    1.800 . 3.500 2.786 2.698 2.847     .  0  0 "[    .    1    .    2]" 1 
        596 1  55 ASP HB3  1  56 ALA H    1.800 . 5.000 3.726 3.651 3.786     .  0  0 "[    .    1    .    2]" 1 
        597 1  56 ALA H    1  56 ALA MB   1.800 . 2.900 2.140 2.047 2.256     .  0  0 "[    .    1    .    2]" 1 
        598 1  56 ALA H    1  57 ASN H    1.800 . 5.000 3.269 2.941 3.461     .  0  0 "[    .    1    .    2]" 1 
        599 1  56 ALA HA   1  57 ASN H    1.800 . 5.000 3.583 3.559 3.602     .  0  0 "[    .    1    .    2]" 1 
        600 1  56 ALA MB   1  57 ASN H    1.800 . 2.900 1.923 1.769 2.294 0.031 18  0 "[    .    1    .    2]" 1 
        601 1  56 ALA MB   1  80 ILE MG   1.800 . 5.000 2.634 1.933 3.988     .  0  0 "[    .    1    .    2]" 1 
        602 1  56 ALA MB   1  81 PRO QD   1.800 . 5.000 3.351 2.282 4.255     .  0  0 "[    .    1    .    2]" 1 
        603 1  56 ALA MB   1  82 GLY QA   1.800 . 5.000 2.980 2.007 4.975     .  0  0 "[    .    1    .    2]" 1 
        604 1  56 ALA MB   1  83 THR H    1.800 . 5.000 3.270 2.842 3.844     .  0  0 "[    .    1    .    2]" 1 
        605 1  56 ALA MB   1  83 THR HB   1.800 . 5.000 3.038 2.014 4.570     .  0  0 "[    .    1    .    2]" 1 
        606 1  57 ASN H    1  58 ILE H    1.800 . 5.000 2.874 2.786 2.949     .  0  0 "[    .    1    .    2]" 1 
        607 1  57 ASN H    1  59 LYS H    1.800 . 5.000 4.488 4.270 4.665     .  0  0 "[    .    1    .    2]" 1 
        608 1  57 ASN H    1  80 ILE MG   1.800 . 5.000 3.354 2.687 5.068 0.068  8  0 "[    .    1    .    2]" 1 
        609 1  57 ASN H    1  83 THR H    1.800 . 6.000 5.983 5.046 6.097 0.097 15  0 "[    .    1    .    2]" 1 
        610 1  57 ASN HA   1  80 ILE MD   1.800 . 5.000 3.517 2.022 5.056 0.056  9  0 "[    .    1    .    2]" 1 
        611 1  57 ASN QB   1  58 ILE QG   1.800 . 3.500 3.210 3.114 3.328     .  0  0 "[    .    1    .    2]" 1 
        612 1  57 ASN HB2  1  58 ILE H    1.800 . 5.000 3.897 3.824 3.957     .  0  0 "[    .    1    .    2]" 1 
        613 1  57 ASN HB3  1  58 ILE H    1.800 . 5.000 2.605 2.546 2.651     .  0  0 "[    .    1    .    2]" 1 
        614 1  57 ASN QD   1  62 VAL MG1  1.800 . 3.500 2.737 2.542 3.011     .  0  0 "[    .    1    .    2]" 1 
        615 1  57 ASN QD   1  62 VAL MG2  1.800 . 6.000 5.086 4.889 5.307     .  0  0 "[    .    1    .    2]" 1 
        616 1  57 ASN QD   1  80 ILE MD   1.800 . 5.300 3.093 1.735 4.876 0.065  5  0 "[    .    1    .    2]" 1 
        617 1  57 ASN HD21 1  62 VAL HA   1.800 . 6.800 6.733 6.259 6.847 0.047 17  0 "[    .    1    .    2]" 1 
        618 1  57 ASN HD21 1  64 TRP HH2  1.800 . 5.300 5.099 4.230 5.345 0.045  5  0 "[    .    1    .    2]" 1 
        619 1  57 ASN HD21 1  79 TYR HH   1.800 . 5.000 5.084 5.016 5.132 0.132 12  0 "[    .    1    .    2]" 1 
        620 1  57 ASN HD22 1  62 VAL HA   1.800 . 6.000 6.034 6.011 6.110 0.110 16  0 "[    .    1    .    2]" 1 
        621 1  57 ASN HD22 1  64 TRP HD1  1.800 . 5.300 5.175 4.912 5.376 0.076 11  0 "[    .    1    .    2]" 1 
        622 1  58 ILE H    1  58 ILE HB   1.800 . 2.900 2.533 2.489 2.597     .  0  0 "[    .    1    .    2]" 1 
        623 1  58 ILE H    1  58 ILE MD   1.800 . 3.500 3.383 2.938 3.502 0.002  5  0 "[    .    1    .    2]" 1 
        624 1  58 ILE H    1  58 ILE HG12 1.800 . 3.500 3.140 2.009 3.434     .  0  0 "[    .    1    .    2]" 1 
        625 1  58 ILE H    1  58 ILE HG13 1.800 . 3.500 2.233 1.887 3.569 0.069 17  0 "[    .    1    .    2]" 1 
        626 1  58 ILE H    1  58 ILE MG   1.800 . 3.500 3.748 3.743 3.752 0.252 12  0 "[    .    1    .    2]" 1 
        627 1  58 ILE H    1  59 LYS H    1.800 . 3.500 2.804 2.704 2.902     .  0  0 "[    .    1    .    2]" 1 
        628 1  58 ILE H    1  60 LYS H    1.800 . 5.000 4.072 3.922 4.394     .  0  0 "[    .    1    .    2]" 1 
        629 1  58 ILE HA   1  58 ILE MD   1.800 . 5.000 3.552 2.021 3.837     .  0  0 "[    .    1    .    2]" 1 
        630 1  58 ILE HA   1  58 ILE HG12 1.800 . 3.500 2.631 2.521 3.151     .  0  0 "[    .    1    .    2]" 1 
        631 1  58 ILE HA   1  58 ILE HG13 1.800 . 3.500 3.081 2.918 3.678 0.178  3  0 "[    .    1    .    2]" 1 
        632 1  58 ILE HA   1  58 ILE MG   1.800 . 3.500 2.303 2.276 2.341     .  0  0 "[    .    1    .    2]" 1 
        633 1  58 ILE HA   1  59 LYS H    1.800 . 5.000 3.576 3.550 3.590     .  0  0 "[    .    1    .    2]" 1 
        634 1  58 ILE HB   1  58 ILE MD   1.800 . 3.500 2.452 2.225 3.211     .  0  0 "[    .    1    .    2]" 1 
        635 1  58 ILE HB   1  59 LYS H    1.800 . 2.900 2.406 2.249 2.609     .  0  0 "[    .    1    .    2]" 1 
        636 1  58 ILE MD   1  59 LYS H    1.800 . 5.000 4.345 4.197 4.576     .  0  0 "[    .    1    .    2]" 1 
        637 1  58 ILE QG   1  59 LYS H    1.800 . 5.000 3.941 3.876 4.019     .  0  0 "[    .    1    .    2]" 1 
        638 1  58 ILE MG   1  59 LYS H    1.800 . 5.000 3.321 3.126 3.465     .  0  0 "[    .    1    .    2]" 1 
        639 1  59 LYS H    1  59 LYS QD   1.800 . 5.000 4.335 3.862 4.617     .  0  0 "[    .    1    .    2]" 1 
        640 1  59 LYS H    1  59 LYS HG2  1.800 . 5.000 4.339 3.361 4.667     .  0  0 "[    .    1    .    2]" 1 
        641 1  59 LYS H    1  59 LYS HG3  1.800 . 5.000 4.104 2.204 4.467     .  0  0 "[    .    1    .    2]" 1 
        642 1  59 LYS H    1  60 LYS H    1.800 . 5.000 2.681 2.633 2.802     .  0  0 "[    .    1    .    2]" 1 
        643 1  59 LYS HA   1  59 LYS QD   1.800 . 5.000 3.885 2.211 3.988     .  0  0 "[    .    1    .    2]" 1 
        644 1  59 LYS HA   1  60 LYS H    1.800 . 5.000 3.540 3.520 3.586     .  0  0 "[    .    1    .    2]" 1 
        645 1  59 LYS HB2  1  60 LYS H    1.800 . 5.000 3.674 2.698 3.880     .  0  0 "[    .    1    .    2]" 1 
        646 1  59 LYS HB3  1  60 LYS H    1.800 . 5.000 2.762 2.257 3.742     .  0  0 "[    .    1    .    2]" 1 
        647 1  59 LYS QD   1  60 LYS H    1.800 . 5.000 4.614 4.124 5.069 0.069 20  0 "[    .    1    .    2]" 1 
        648 1  60 LYS H    1  60 LYS QG   1.800 . 5.000 3.903 2.545 4.130     .  0  0 "[    .    1    .    2]" 1 
        649 1  60 LYS HA   1  60 LYS QG   1.800 . 3.500 2.384 2.260 2.736     .  0  0 "[    .    1    .    2]" 1 
        650 1  60 LYS HB2  1  80 ILE MG   1.800 . 6.000 5.332 2.996 6.202 0.202 13  0 "[    .    1    .    2]" 1 
        651 1  60 LYS HB3  1  80 ILE MG   1.800 . 6.000 4.396 3.255 5.847     .  0  0 "[    .    1    .    2]" 1 
        652 1  60 LYS QG   1  79 TYR QD   1.800 . 6.000 6.004 5.263 6.098 0.098  1  0 "[    .    1    .    2]" 1 
        653 1  61 ASN HA   1  62 VAL H    1.800 . 5.000 2.210 2.159 2.246     .  0  0 "[    .    1    .    2]" 1 
        654 1  61 ASN HA   1  62 VAL MG1  1.800 . 5.300 3.669 3.555 3.784     .  0  0 "[    .    1    .    2]" 1 
        655 1  61 ASN HA   1  62 VAL MG2  1.800 . 6.000 5.451 5.411 5.545     .  0  0 "[    .    1    .    2]" 1 
        656 1  61 ASN HB2  1  62 VAL H    1.800 . 5.000 4.328 4.197 4.597     .  0  0 "[    .    1    .    2]" 1 
        657 1  61 ASN HB3  1  62 VAL H    1.800 . 5.000 3.911 3.020 4.153     .  0  0 "[    .    1    .    2]" 1 
        658 1  62 VAL H    1  62 VAL MG1  1.800 . 5.000 1.936 1.822 2.065     .  0  0 "[    .    1    .    2]" 1 
        659 1  62 VAL H    1  62 VAL MG2  1.800 . 5.000 3.891 3.854 3.916     .  0  0 "[    .    1    .    2]" 1 
        660 1  62 VAL H    1  63 LEU H    1.800 . 5.300 4.459 4.445 4.493     .  0  0 "[    .    1    .    2]" 1 
        661 1  62 VAL HA   1  62 VAL MG1  1.800 . 5.000 3.177 3.172 3.186     .  0  0 "[    .    1    .    2]" 1 
        662 1  62 VAL HA   1  62 VAL MG2  1.800 . 5.000 2.288 2.228 2.362     .  0  0 "[    .    1    .    2]" 1 
        663 1  62 VAL HA   1  63 LEU H    1.800 . 3.500 2.287 2.273 2.319     .  0  0 "[    .    1    .    2]" 1 
        664 1  62 VAL MG1  1  63 LEU H    1.800 . 5.000 3.698 3.612 3.746     .  0  0 "[    .    1    .    2]" 1 
        665 1  62 VAL MG1  1  64 TRP H    1.800 . 5.000 4.531 4.389 4.717     .  0  0 "[    .    1    .    2]" 1 
        666 1  62 VAL MG1  1  64 TRP HD1  1.800 . 6.000 4.152 3.634 4.692     .  0  0 "[    .    1    .    2]" 1 
        667 1  62 VAL MG1  1  64 TRP HZ3  1.800 . 5.000 4.366 3.661 4.742     .  0  0 "[    .    1    .    2]" 1 
        668 1  62 VAL MG1  1  68 ASN HB3  1.800 . 6.000 4.955 4.517 5.379     .  0  0 "[    .    1    .    2]" 1 
        669 1  62 VAL MG1  1  68 ASN HD21 1.800 . 3.500 3.065 2.580 3.466     .  0  0 "[    .    1    .    2]" 1 
        670 1  62 VAL MG1  1  68 ASN HD22 1.800 . 3.500 2.273 1.784 3.015 0.016 15  0 "[    .    1    .    2]" 1 
        671 1  62 VAL MG1  1  79 TYR QD   1.800 . 6.000 4.277 3.841 4.626     .  0  0 "[    .    1    .    2]" 1 
        672 1  62 VAL MG1  1  79 TYR QE   1.800 . 5.000 2.533 2.181 2.992     .  0  0 "[    .    1    .    2]" 1 
        673 1  62 VAL MG1  1  79 TYR HH   1.800 . 3.500 1.842 1.738 2.142 0.062  2  0 "[    .    1    .    2]" 1 
        674 1  62 VAL MG2  1  63 LEU H    1.800 . 5.000 2.126 1.865 2.227     .  0  0 "[    .    1    .    2]" 1 
        675 1  62 VAL MG2  1  64 TRP H    1.800 . 5.300 4.680 4.605 4.835     .  0  0 "[    .    1    .    2]" 1 
        676 1  62 VAL MG2  1  64 TRP HD1  1.800 . 6.300 5.559 5.189 6.164     .  0  0 "[    .    1    .    2]" 1 
        677 1  62 VAL MG2  1  64 TRP HH2  1.800 . 6.000 5.233 4.918 5.559     .  0  0 "[    .    1    .    2]" 1 
        678 1  62 VAL MG2  1  64 TRP HZ3  1.800 . 5.300 5.184 4.655 5.349 0.049 17  0 "[    .    1    .    2]" 1 
        679 1  62 VAL MG2  1  68 ASN H    1.800 . 6.300 5.901 5.561 6.208     .  0  0 "[    .    1    .    2]" 1 
        680 1  62 VAL MG2  1  68 ASN HB2  1.800 . 6.000 3.964 3.633 4.415     .  0  0 "[    .    1    .    2]" 1 
        681 1  62 VAL MG2  1  68 ASN HD21 1.800 . 3.500 2.810 2.395 3.195     .  0  0 "[    .    1    .    2]" 1 
        682 1  62 VAL MG2  1  68 ASN HD22 1.800 . 3.500 1.860 1.708 2.258 0.092 17  0 "[    .    1    .    2]" 1 
        683 1  62 VAL MG2  1  79 TYR QD   1.800 . 6.000 4.626 3.955 5.556     .  0  0 "[    .    1    .    2]" 1 
        684 1  62 VAL MG2  1  79 TYR QE   1.800 . 5.000 2.884 2.175 3.935     .  0  0 "[    .    1    .    2]" 1 
        685 1  62 VAL MG2  1  79 TYR HH   1.800 . 5.000 2.905 2.516 3.462     .  0  0 "[    .    1    .    2]" 1 
        686 1  63 LEU H    1  63 LEU QB   1.800 . 3.500 2.288 2.251 2.305     .  0  0 "[    .    1    .    2]" 1 
        687 1  63 LEU H    1  63 LEU MD1  1.800 . 5.000 4.106 4.050 4.305     .  0  0 "[    .    1    .    2]" 1 
        688 1  63 LEU H    1  63 LEU MD2  1.800 . 5.000 4.262 4.105 4.334     .  0  0 "[    .    1    .    2]" 1 
        689 1  63 LEU H    1  63 LEU HG   1.800 . 5.300 4.419 4.405 4.445     .  0  0 "[    .    1    .    2]" 1 
        690 1  63 LEU H    1  79 TYR HH   1.800 . 6.000 5.837 5.502 6.047 0.047 15  0 "[    .    1    .    2]" 1 
        691 1  63 LEU HA   1  63 LEU MD1  1.800 . 5.000 2.279 2.101 3.685     .  0  0 "[    .    1    .    2]" 1 
        692 1  63 LEU HA   1  63 LEU MD2  1.800 . 5.000 3.747 2.926 3.875     .  0  0 "[    .    1    .    2]" 1 
        693 1  63 LEU HA   1  64 TRP H    1.800 . 3.500 2.221 2.208 2.239     .  0  0 "[    .    1    .    2]" 1 
        694 1  63 LEU HA   1  64 TRP HD1  1.800 . 5.000 4.235 3.943 4.621     .  0  0 "[    .    1    .    2]" 1 
        695 1  63 LEU HA   1  64 TRP HE3  1.800 . 7.000 6.705 6.357 6.887     .  0  0 "[    .    1    .    2]" 1 
        696 1  63 LEU QB   1  63 LEU MD1  1.800 . 5.000 2.174 2.048 2.192     .  0  0 "[    .    1    .    2]" 1 
        697 1  63 LEU QB   1  63 LEU MD2  1.800 . 5.000 2.082 2.061 2.155     .  0  0 "[    .    1    .    2]" 1 
        698 1  63 LEU QB   1  64 TRP H    1.800 . 5.000 3.747 3.716 3.787     .  0  0 "[    .    1    .    2]" 1 
        699 1  63 LEU MD1  1  64 TRP H    1.800 . 6.000 2.520 2.216 4.493     .  0  0 "[    .    1    .    2]" 1 
        700 1  63 LEU MD1  1  65 ASP H    1.800 . 5.300 5.374 5.343 5.497 0.197 19  0 "[    .    1    .    2]" 1 
        701 1  63 LEU MD2  1  64 TRP H    1.800 . 6.000 4.137 2.252 4.429     .  0  0 "[    .    1    .    2]" 1 
        702 1  63 LEU MD2  1  65 ASP H    1.800 . 5.300 5.106 3.076 5.368 0.068 18  0 "[    .    1    .    2]" 1 
        703 1  63 LEU HG   1  64 TRP H    1.800 . 6.000 2.874 2.771 3.150     .  0  0 "[    .    1    .    2]" 1 
        704 1  64 TRP H    1  64 TRP HB2  1.800 . 3.500 2.398 2.351 2.433     .  0  0 "[    .    1    .    2]" 1 
        705 1  64 TRP H    1  64 TRP HZ2  1.800 . 7.000 6.991 6.890 7.076 0.076 20  0 "[    .    1    .    2]" 1 
        706 1  64 TRP H    1  69 MET ME   1.800 . 5.300 5.321 5.236 5.438 0.138 13  0 "[    .    1    .    2]" 1 
        707 1  64 TRP HA   1  65 ASP H    1.800 . 5.000 2.142 2.118 2.175     .  0  0 "[    .    1    .    2]" 1 
        708 1  64 TRP HA   1  79 TYR HH   1.800 . 5.000 4.715 4.131 5.037 0.037 13  0 "[    .    1    .    2]" 1 
        709 1  64 TRP QB   1  65 ASP H    1.800 . 5.000 3.292 3.168 3.562     .  0  0 "[    .    1    .    2]" 1 
        710 1  64 TRP HB2  1  64 TRP HD1  1.800 . 3.500 2.556 2.535 2.589     .  0  0 "[    .    1    .    2]" 1 
        711 1  64 TRP HD1  1  69 MET ME   1.800 . 5.000 5.090 5.011 5.190 0.190 17  0 "[    .    1    .    2]" 1 
        712 1  64 TRP HE1  1  68 ASN HD21 1.800 . 6.000 5.712 5.062 6.056 0.056 17  0 "[    .    1    .    2]" 1 
        713 1  64 TRP HE1  1  68 ASN HD22 1.800 . 6.300 5.788 4.712 6.311 0.011 17  0 "[    .    1    .    2]" 1 
        714 1  64 TRP HE3  1  68 ASN HD21 1.800 . 6.000 2.767 2.176 3.569     .  0  0 "[    .    1    .    2]" 1 
        715 1  64 TRP HE3  1  68 ASN HD22 1.800 . 5.000 4.008 3.627 4.849     .  0  0 "[    .    1    .    2]" 1 
        716 1  64 TRP HE3  1  69 MET H    1.800 . 5.000 4.054 3.714 4.335     .  0  0 "[    .    1    .    2]" 1 
        717 1  64 TRP HE3  1  69 MET HA   1.800 . 3.500 3.099 2.346 3.511 0.011 11  0 "[    .    1    .    2]" 1 
        718 1  64 TRP HE3  1  69 MET QB   1.800 . 5.000 4.018 2.553 4.604     .  0  0 "[    .    1    .    2]" 1 
        719 1  64 TRP HE3  1  69 MET ME   1.800 . 5.000 2.782 2.333 3.300     .  0  0 "[    .    1    .    2]" 1 
        720 1  64 TRP HH2  1  72 HIS HE1  1.800 . 6.000 3.250 2.776 3.840     .  0  0 "[    .    1    .    2]" 1 
        721 1  64 TRP HH2  1  79 TYR QD   1.800 . 6.000 3.876 3.375 4.199     .  0  0 "[    .    1    .    2]" 1 
        722 1  64 TRP HH2  1  79 TYR QE   1.800 . 5.000 2.386 2.251 3.214     .  0  0 "[    .    1    .    2]" 1 
        723 1  64 TRP HZ2  1  72 HIS HE1  1.800 . 6.000 4.680 4.371 5.308     .  0  0 "[    .    1    .    2]" 1 
        724 1  64 TRP HZ2  1  79 TYR QD   1.800 . 5.000 4.919 4.315 5.129 0.129 20  0 "[    .    1    .    2]" 1 
        725 1  64 TRP HZ2  1  79 TYR QE   1.800 . 5.000 2.943 2.463 3.385     .  0  0 "[    .    1    .    2]" 1 
        726 1  64 TRP HZ2  1  79 TYR HH   1.800 . 5.000 3.184 2.659 3.695     .  0  0 "[    .    1    .    2]" 1 
        727 1  64 TRP HZ3  1  69 MET HA   1.800 . 3.500 2.709 2.279 3.139     .  0  0 "[    .    1    .    2]" 1 
        728 1  64 TRP HZ3  1  69 MET ME   1.800 . 5.000 4.364 3.869 5.003 0.003 11  0 "[    .    1    .    2]" 1 
        729 1  64 TRP HZ3  1  72 HIS HD2  1.800 . 5.000 3.921 3.462 4.556     .  0  0 "[    .    1    .    2]" 1 
        730 1  64 TRP HZ3  1  79 TYR HH   1.800 . 5.300 3.316 2.545 3.885     .  0  0 "[    .    1    .    2]" 1 
        731 1  65 ASP H    1  68 ASN H    1.800 . 5.000 3.426 3.167 3.747     .  0  0 "[    .    1    .    2]" 1 
        732 1  65 ASP H    1  68 ASN HD21 1.800 . 5.000 3.215 2.948 3.416     .  0  0 "[    .    1    .    2]" 1 
        733 1  65 ASP H    1  68 ASN HD22 1.800 . 5.000 4.819 4.568 5.044 0.044 13  0 "[    .    1    .    2]" 1 
        734 1  65 ASP H    1  69 MET ME   1.800 . 6.000 3.667 3.337 4.029     .  0  0 "[    .    1    .    2]" 1 
        735 1  65 ASP HA   1  66 GLU H    1.800 . 5.000 2.569 2.460 2.770     .  0  0 "[    .    1    .    2]" 1 
        736 1  65 ASP HB2  1  66 GLU H    1.800 . 5.000 3.281 2.079 3.982     .  0  0 "[    .    1    .    2]" 1 
        737 1  65 ASP HB3  1  66 GLU H    1.800 . 5.000 3.435 2.138 3.749     .  0  0 "[    .    1    .    2]" 1 
        738 1  66 GLU H    1  66 GLU QG   1.800 . 5.000 2.062 1.984 2.120     .  0  0 "[    .    1    .    2]" 1 
        739 1  66 GLU H    1  67 ASN H    1.800 . 5.000 2.788 2.716 2.841     .  0  0 "[    .    1    .    2]" 1 
        740 1  66 GLU H    1  68 ASN H    1.800 . 5.000 4.453 4.243 4.668     .  0  0 "[    .    1    .    2]" 1 
        741 1  66 GLU H    1 100 ILE MD   1.800 . 6.000 5.670 5.326 6.027 0.027 10  0 "[    .    1    .    2]" 1 
        742 1  66 GLU H    1 100 ILE MG   1.800 . 5.000 4.655 4.234 5.071 0.071 13  0 "[    .    1    .    2]" 1 
        743 1  66 GLU HA   1  66 GLU QG   1.800 . 5.000 2.379 2.338 2.901     .  0  0 "[    .    1    .    2]" 1 
        744 1  66 GLU HA   1  67 ASN H    1.800 . 5.000 3.559 3.538 3.573     .  0  0 "[    .    1    .    2]" 1 
        745 1  66 GLU HA   1  68 ASN H    1.800 . 5.000 4.873 4.713 5.117 0.117 13  0 "[    .    1    .    2]" 1 
        746 1  66 GLU HA   1  69 MET H    1.800 . 5.000 3.807 3.627 3.999     .  0  0 "[    .    1    .    2]" 1 
        747 1  66 GLU HA   1  69 MET HB2  1.800 . 5.000 3.086 2.737 3.877     .  0  0 "[    .    1    .    2]" 1 
        748 1  66 GLU HA   1  69 MET QB   1.800 . 3.500 2.882 2.685 3.276     .  0  0 "[    .    1    .    2]" 1 
        749 1  66 GLU HA   1  69 MET HB3  1.800 . 5.000 4.182 2.805 4.952     .  0  0 "[    .    1    .    2]" 1 
        750 1  66 GLU HA   1  70 SER H    1.800 . 5.000 4.407 4.056 4.570     .  0  0 "[    .    1    .    2]" 1 
        751 1  66 GLU HA   1 100 ILE MG   1.800 . 3.500 2.417 2.104 2.792     .  0  0 "[    .    1    .    2]" 1 
        752 1  66 GLU HB2  1  67 ASN H    1.800 . 5.000 2.623 2.548 2.725     .  0  0 "[    .    1    .    2]" 1 
        753 1  66 GLU HB2  1 100 ILE MG   1.800 . 5.000 4.318 3.872 4.811     .  0  0 "[    .    1    .    2]" 1 
        754 1  66 GLU HB3  1  67 ASN H    1.800 . 5.000 3.663 3.591 3.736     .  0  0 "[    .    1    .    2]" 1 
        755 1  66 GLU HB3  1 100 ILE MG   1.800 . 5.000 3.038 2.558 3.662     .  0  0 "[    .    1    .    2]" 1 
        756 1  66 GLU QG   1  67 ASN H    1.800 . 5.000 4.034 3.992 4.079     .  0  0 "[    .    1    .    2]" 1 
        757 1  67 ASN H    1  67 ASN HB2  1.800 . 3.500 2.782 2.546 3.582 0.082 18  0 "[    .    1    .    2]" 1 
        758 1  67 ASN H    1  67 ASN HB3  1.800 . 3.500 2.593 2.255 3.467     .  0  0 "[    .    1    .    2]" 1 
        759 1  67 ASN H    1  68 ASN H    1.800 . 3.500 2.692 2.553 2.783     .  0  0 "[    .    1    .    2]" 1 
        760 1  67 ASN H    1  69 MET H    1.800 . 5.000 4.056 3.882 4.222     .  0  0 "[    .    1    .    2]" 1 
        761 1  67 ASN HA   1  67 ASN HD21 1.800 . 5.000 4.061 3.976 4.236     .  0  0 "[    .    1    .    2]" 1 
        762 1  67 ASN HA   1  67 ASN HD22 1.800 . 5.000 4.532 4.376 5.096 0.096  1  0 "[    .    1    .    2]" 1 
        763 1  67 ASN HA   1  68 ASN H    1.800 . 5.000 3.571 3.563 3.581     .  0  0 "[    .    1    .    2]" 1 
        764 1  67 ASN HA   1  69 MET H    1.800 . 5.000 4.483 4.343 4.636     .  0  0 "[    .    1    .    2]" 1 
        765 1  67 ASN HA   1  70 SER H    1.800 . 5.000 3.656 3.449 3.765     .  0  0 "[    .    1    .    2]" 1 
        766 1  67 ASN HA   1  71 GLU H    1.800 . 5.000 4.749 4.466 4.884     .  0  0 "[    .    1    .    2]" 1 
        767 1  67 ASN HB2  1  68 ASN H    1.800 . 5.000 3.633 2.561 3.874     .  0  0 "[    .    1    .    2]" 1 
        768 1  67 ASN HB3  1  68 ASN H    1.800 . 5.000 2.653 2.169 4.055     .  0  0 "[    .    1    .    2]" 1 
        769 1  67 ASN QD   1  68 ASN QB   1.800 . 3.500 3.556 3.417 3.579 0.079 16  0 "[    .    1    .    2]" 1 
        770 1  68 ASN H    1  69 MET H    1.800 . 5.000 2.764 2.711 2.824     .  0  0 "[    .    1    .    2]" 1 
        771 1  68 ASN H    1  70 SER H    1.800 . 5.000 4.303 4.190 4.410     .  0  0 "[    .    1    .    2]" 1 
        772 1  68 ASN HA   1  69 MET H    1.800 . 3.500 3.555 3.541 3.567 0.067  8  0 "[    .    1    .    2]" 1 
        773 1  68 ASN HA   1  71 GLU H    1.800 . 3.500 3.378 3.206 3.507 0.007  8  0 "[    .    1    .    2]" 1 
        774 1  68 ASN HB2  1  69 MET H    1.800 . 5.000 3.831 3.750 3.874     .  0  0 "[    .    1    .    2]" 1 
        775 1  68 ASN HB3  1  69 MET H    1.800 . 5.000 2.623 2.543 2.726     .  0  0 "[    .    1    .    2]" 1 
        776 1  68 ASN QD   1  69 MET H    1.800 . 5.000 4.040 3.693 4.631     .  0  0 "[    .    1    .    2]" 1 
        777 1  68 ASN QD   1  69 MET ME   1.800 . 6.000 4.708 4.278 5.139     .  0  0 "[    .    1    .    2]" 1 
        778 1  68 ASN HD21 1  79 TYR HH   1.800 . 5.000 3.192 2.963 3.630     .  0  0 "[    .    1    .    2]" 1 
        779 1  68 ASN HD22 1  72 HIS QB   1.800 . 5.000 4.312 3.686 4.926     .  0  0 "[    .    1    .    2]" 1 
        780 1  68 ASN HD22 1  79 TYR HH   1.800 . 5.000 2.213 1.785 2.934 0.015  5  0 "[    .    1    .    2]" 1 
        781 1  69 MET H    1  69 MET ME   1.800 . 5.000 4.333 4.103 4.721     .  0  0 "[    .    1    .    2]" 1 
        782 1  69 MET H    1  69 MET QG   1.800 . 5.000 2.638 2.247 4.083     .  0  0 "[    .    1    .    2]" 1 
        783 1  69 MET H    1  70 SER H    1.800 . 5.000 2.751 2.703 2.797     .  0  0 "[    .    1    .    2]" 1 
        784 1  69 MET H    1  71 GLU H    1.800 . 5.000 4.246 4.058 4.377     .  0  0 "[    .    1    .    2]" 1 
        785 1  69 MET H    1  72 HIS H    1.800 . 5.000 4.802 4.649 5.025 0.025 18  0 "[    .    1    .    2]" 1 
        786 1  69 MET HA   1  69 MET ME   1.800 . 5.000 4.123 3.558 4.421     .  0  0 "[    .    1    .    2]" 1 
        787 1  69 MET HA   1  72 HIS QB   1.800 . 5.000 2.597 2.294 3.026     .  0  0 "[    .    1    .    2]" 1 
        788 1  69 MET HA   1  73 LEU H    1.800 . 5.000 4.414 3.876 4.747     .  0  0 "[    .    1    .    2]" 1 
        789 1  69 MET QB   1  70 SER H    1.800 . 3.500 2.617 2.540 2.681     .  0  0 "[    .    1    .    2]" 1 
        790 1  69 MET HB2  1  69 MET ME   1.800 . 5.000 3.683 2.131 4.173     .  0  0 "[    .    1    .    2]" 1 
        791 1  69 MET HB3  1  69 MET ME   1.800 . 5.000 3.779 3.057 4.006     .  0  0 "[    .    1    .    2]" 1 
        792 1  69 MET ME   1  70 SER H    1.800 . 6.000 5.923 5.276 6.107 0.107  4  0 "[    .    1    .    2]" 1 
        793 1  69 MET ME   1  73 LEU QD   1.800 . 6.000 5.269 4.437 5.796     .  0  0 "[    .    1    .    2]" 1 
        794 1  69 MET ME   1 100 ILE MD   1.800 . 6.000 5.259 4.851 5.525     .  0  0 "[    .    1    .    2]" 1 
        795 1  69 MET ME   1 100 ILE MG   1.800 . 4.300 3.993 3.726 4.297     .  0  0 "[    .    1    .    2]" 1 
        796 1  69 MET ME   1 103 LEU QD   1.800 . 3.500 3.458 3.202 3.532 0.032  5  0 "[    .    1    .    2]" 1 
        797 1  69 MET ME   1 104 LYS H    1.800 . 6.000 6.039 5.971 6.085 0.085 13  0 "[    .    1    .    2]" 1 
        798 1  69 MET QG   1 100 ILE MG   1.800 . 3.500 3.373 2.642 3.643 0.143  9  0 "[    .    1    .    2]" 1 
        799 1  70 SER H    1  71 GLU H    1.800 . 3.500 2.707 2.607 2.785     .  0  0 "[    .    1    .    2]" 1 
        800 1  70 SER H    1  72 HIS H    1.800 . 5.000 4.078 3.927 4.237     .  0  0 "[    .    1    .    2]" 1 
        801 1  70 SER H    1  73 LEU QD   1.800 . 5.000 4.662 4.326 5.054 0.054 19  0 "[    .    1    .    2]" 1 
        802 1  70 SER H    1 100 ILE MD   1.800 . 3.500 2.558 2.264 2.956     .  0  0 "[    .    1    .    2]" 1 
        803 1  70 SER H    1 100 ILE MG   1.800 . 5.000 4.258 3.995 4.595     .  0  0 "[    .    1    .    2]" 1 
        804 1  70 SER HA   1  71 GLU H    1.800 . 5.000 3.553 3.525 3.571     .  0  0 "[    .    1    .    2]" 1 
        805 1  70 SER HA   1  73 LEU MD1  1.800 . 5.000 3.208 2.657 3.897     .  0  0 "[    .    1    .    2]" 1 
        806 1  70 SER HA   1  73 LEU MD2  1.800 . 5.000 4.299 2.829 5.052 0.052 12  0 "[    .    1    .    2]" 1 
        807 1  70 SER HA   1  96 ARG QD   1.800 . 2.900 2.466 2.213 2.954 0.054  7  0 "[    .    1    .    2]" 1 
        808 1  70 SER QB   1  71 GLU H    1.800 . 5.000 2.976 2.434 3.488     .  0  0 "[    .    1    .    2]" 1 
        809 1  70 SER HB2  1  96 ARG QD   1.800 . 5.000 3.325 2.077 4.684     .  0  0 "[    .    1    .    2]" 1 
        810 1  70 SER HB2  1 100 ILE MD   1.800 . 3.500 3.360 2.542 3.586 0.086  5  0 "[    .    1    .    2]" 1 
        811 1  70 SER HB3  1  96 ARG QD   1.800 . 3.500 3.262 2.682 3.565 0.065  1  0 "[    .    1    .    2]" 1 
        812 1  70 SER HB3  1 100 ILE MD   1.800 . 3.500 2.745 2.026 3.524 0.024  7  0 "[    .    1    .    2]" 1 
        813 1  71 GLU H    1  71 GLU HB2  1.800 . 3.500 2.478 2.429 2.545     .  0  0 "[    .    1    .    2]" 1 
        814 1  71 GLU H    1  71 GLU HB3  1.800 . 3.500 3.200 2.588 3.604 0.104 14  0 "[    .    1    .    2]" 1 
        815 1  71 GLU H    1  71 GLU HG2  1.800 . 5.000 3.667 2.177 4.673     .  0  0 "[    .    1    .    2]" 1 
        816 1  71 GLU H    1  71 GLU HG3  1.800 . 5.000 3.321 2.142 4.473     .  0  0 "[    .    1    .    2]" 1 
        817 1  71 GLU H    1  72 HIS H    1.800 . 5.000 2.592 2.533 2.674     .  0  0 "[    .    1    .    2]" 1 
        818 1  71 GLU HA   1  72 HIS H    1.800 . 5.000 3.529 3.509 3.552     .  0  0 "[    .    1    .    2]" 1 
        819 1  71 GLU HB2  1  72 HIS H    1.800 . 5.000 3.200 2.700 3.942     .  0  0 "[    .    1    .    2]" 1 
        820 1  71 GLU HB3  1  72 HIS H    1.800 . 5.000 3.320 2.663 3.773     .  0  0 "[    .    1    .    2]" 1 
        821 1  71 GLU HG2  1  72 HIS H    1.800 . 5.000 4.514 3.899 5.018 0.018  5  0 "[    .    1    .    2]" 1 
        822 1  71 GLU HG3  1  72 HIS H    1.800 . 5.000 4.606 3.922 5.053 0.053 15  0 "[    .    1    .    2]" 1 
        823 1  72 HIS H    1  72 HIS HD2  1.800 . 5.300 5.321 5.208 5.384 0.084 16  0 "[    .    1    .    2]" 1 
        824 1  72 HIS H    1  73 LEU H    1.800 . 3.500 2.793 2.753 2.908     .  0  0 "[    .    1    .    2]" 1 
        825 1  72 HIS H    1  73 LEU QB   1.800 . 5.000 4.752 4.565 4.897     .  0  0 "[    .    1    .    2]" 1 
        826 1  72 HIS H    1  73 LEU QD   1.800 . 5.000 4.206 3.500 4.763     .  0  0 "[    .    1    .    2]" 1 
        827 1  72 HIS HA   1  73 LEU H    1.800 . 3.500 3.561 3.550 3.575 0.075  5  0 "[    .    1    .    2]" 1 
        828 1  72 HIS HA   1  74 THR H    1.800 . 5.000 4.239 4.060 4.528     .  0  0 "[    .    1    .    2]" 1 
        829 1  72 HIS HA   1  79 TYR QD   1.800 . 5.300 2.967 2.263 3.734     .  0  0 "[    .    1    .    2]" 1 
        830 1  72 HIS QB   1  73 LEU H    1.800 . 3.500 2.397 2.324 2.497     .  0  0 "[    .    1    .    2]" 1 
        831 1  72 HIS HB2  1  73 LEU QD   1.800 . 5.000 4.213 3.551 4.850     .  0  0 "[    .    1    .    2]" 1 
        832 1  72 HIS HB3  1  73 LEU QD   1.800 . 5.000 2.826 2.116 3.553     .  0  0 "[    .    1    .    2]" 1 
        833 1  72 HIS HD1  1  79 TYR H    1.800 . 6.000 5.673 5.228 6.042 0.042 11  0 "[    .    1    .    2]" 1 
        834 1  72 HIS HD1  1  80 ILE H    1.800 . 7.300 5.106 4.610 5.797     .  0  0 "[    .    1    .    2]" 1 
        835 1  72 HIS HD2  1  79 TYR HH   1.800 . 6.300 6.390 6.326 6.436 0.136  4  0 "[    .    1    .    2]" 1 
        836 1  72 HIS HE1  1  79 TYR QE   1.800 . 3.500 3.462 3.045 3.618 0.118 13  0 "[    .    1    .    2]" 1 
        837 1  72 HIS HE1  1  80 ILE MG   1.800 . 3.500 3.179 2.003 3.588 0.088  7  0 "[    .    1    .    2]" 1 
        838 1  72 HIS HE1  1  85 MET ME   1.800 . 3.500 2.821 2.110 3.522 0.022 15  0 "[    .    1    .    2]" 1 
        839 1  73 LEU H    1  73 LEU HB2  1.800 . 3.500 2.427 2.242 2.619     .  0  0 "[    .    1    .    2]" 1 
        840 1  73 LEU H    1  73 LEU HB3  1.800 . 3.500 3.589 3.549 3.607 0.107  6  0 "[    .    1    .    2]" 1 
        841 1  73 LEU H    1  73 LEU MD1  1.800 . 6.000 2.760 1.756 3.653 0.044 18  0 "[    .    1    .    2]" 1 
        842 1  73 LEU H    1  73 LEU MD2  1.800 . 5.000 3.342 2.721 3.826     .  0  0 "[    .    1    .    2]" 1 
        843 1  73 LEU H    1  73 LEU HG   1.800 . 5.000 2.848 1.998 3.987     .  0  0 "[    .    1    .    2]" 1 
        844 1  73 LEU HA   1  73 LEU MD1  1.800 . 5.000 3.150 2.200 3.828     .  0  0 "[    .    1    .    2]" 1 
        845 1  73 LEU HA   1  73 LEU MD2  1.800 . 5.000 2.825 2.026 3.797     .  0  0 "[    .    1    .    2]" 1 
        846 1  73 LEU HA   1  74 THR H    1.800 . 5.000 3.516 3.468 3.548     .  0  0 "[    .    1    .    2]" 1 
        847 1  73 LEU HA   1  76 PRO QB   1.800 . 5.000 3.755 3.264 4.385     .  0  0 "[    .    1    .    2]" 1 
        848 1  73 LEU HA   1  76 PRO QD   1.800 . 3.500 3.127 2.365 3.654 0.154 11  0 "[    .    1    .    2]" 1 
        849 1  73 LEU HA   1  76 PRO QG   1.800 . 3.500 3.060 2.329 3.545 0.045 20  0 "[    .    1    .    2]" 1 
        850 1  73 LEU HA   1  87 PHE QD   1.800 . 6.000 3.584 2.986 5.226     .  0  0 "[    .    1    .    2]" 1 
        851 1  73 LEU HA   1  87 PHE QE   1.800 . 5.000 3.584 2.869 5.048 0.048 20  0 "[    .    1    .    2]" 1 
        852 1  73 LEU HA   1  89 GLY QA   1.800 . 5.000 3.961 2.791 4.535     .  0  0 "[    .    1    .    2]" 1 
        853 1  73 LEU HA   1  90 LEU QD   1.800 . 6.000 4.692 4.231 5.246     .  0  0 "[    .    1    .    2]" 1 
        854 1  73 LEU QB   1  73 LEU QD   1.800 . 3.500 1.923 1.880 1.954     .  0  0 "[    .    1    .    2]" 1 
        855 1  73 LEU QB   1  74 THR H    1.800 . 5.000 2.814 2.656 3.036     .  0  0 "[    .    1    .    2]" 1 
        856 1  73 LEU QB   1  90 LEU H    1.800 . 5.000 3.417 2.210 4.117     .  0  0 "[    .    1    .    2]" 1 
        857 1  73 LEU HB2  1  73 LEU MD1  1.800 . 3.500 2.389 2.217 2.496     .  0  0 "[    .    1    .    2]" 1 
        858 1  73 LEU HB2  1  73 LEU MD2  1.800 . 3.500 2.778 2.191 3.200     .  0  0 "[    .    1    .    2]" 1 
        859 1  73 LEU HB3  1  73 LEU MD1  1.800 . 3.500 2.704 2.213 3.195     .  0  0 "[    .    1    .    2]" 1 
        860 1  73 LEU HB3  1  73 LEU MD2  1.800 . 3.500 2.341 2.223 2.545     .  0  0 "[    .    1    .    2]" 1 
        861 1  73 LEU QD   1  76 PRO HA   1.800 . 6.800 5.475 5.028 5.910     .  0  0 "[    .    1    .    2]" 1 
        862 1  73 LEU QD   1  96 ARG HA   1.800 . 5.000 3.009 2.354 3.551     .  0  0 "[    .    1    .    2]" 1 
        863 1  73 LEU QD   1  99 LEU MD1  1.800 . 5.000 3.583 2.010 3.941     .  0  0 "[    .    1    .    2]" 1 
        864 1  73 LEU QD   1 100 ILE H    1.800 . 5.000 3.936 3.479 4.670     .  0  0 "[    .    1    .    2]" 1 
        865 1  73 LEU QD   1 100 ILE MG   1.800 . 5.000 4.489 3.911 4.997     .  0  0 "[    .    1    .    2]" 1 
        866 1  73 LEU MD1  1  74 THR H    1.800 . 5.000 4.349 3.793 4.875     .  0  0 "[    .    1    .    2]" 1 
        867 1  73 LEU MD1  1  87 PHE QD   1.800 . 5.300 4.913 4.291 5.403 0.103 19  0 "[    .    1    .    2]" 1 
        868 1  73 LEU MD1  1  87 PHE QE   1.800 . 5.000 4.123 3.419 4.897     .  0  0 "[    .    1    .    2]" 1 
        869 1  73 LEU MD1  1  99 LEU MD1  1.800 . 5.300 4.428 3.738 5.338 0.038 18  0 "[    .    1    .    2]" 1 
        870 1  73 LEU MD1  1  99 LEU MD2  1.800 . 3.500 2.512 1.868 3.500     . 10  0 "[    .    1    .    2]" 1 
        871 1  73 LEU MD1  1 100 ILE MD   1.800 . 5.000 3.632 2.833 4.550     .  0  0 "[    .    1    .    2]" 1 
        872 1  73 LEU MD1  1 103 LEU MD1  1.800 . 6.000 4.626 4.057 5.116     .  0  0 "[    .    1    .    2]" 1 
        873 1  73 LEU MD1  1 103 LEU QD   1.800 . 5.000 4.543 4.006 5.002 0.002  6  0 "[    .    1    .    2]" 1 
        874 1  73 LEU MD2  1  74 THR H    1.800 . 5.000 4.690 4.377 5.042 0.042 15  0 "[    .    1    .    2]" 1 
        875 1  73 LEU MD2  1  87 PHE QD   1.800 . 5.300 3.947 2.971 5.331 0.031 13  0 "[    .    1    .    2]" 1 
        876 1  73 LEU MD2  1  87 PHE QE   1.800 . 5.000 2.900 2.209 4.424     .  0  0 "[    .    1    .    2]" 1 
        877 1  73 LEU MD2  1  87 PHE HZ   1.800 . 5.300 3.708 3.100 4.876     .  0  0 "[    .    1    .    2]" 1 
        878 1  73 LEU MD2  1  90 LEU HG   1.800 . 5.300 3.856 3.207 4.690     .  0  0 "[    .    1    .    2]" 1 
        879 1  73 LEU MD2  1  99 LEU MD1  1.800 . 5.300 3.994 2.016 4.843     .  0  0 "[    .    1    .    2]" 1 
        880 1  73 LEU MD2  1  99 LEU MD2  1.800 . 3.500 2.065 1.765 2.730 0.035  5  0 "[    .    1    .    2]" 1 
        881 1  73 LEU MD2  1 100 ILE MD   1.800 . 5.300 4.429 2.938 5.339 0.039  6  0 "[    .    1    .    2]" 1 
        882 1  73 LEU MD2  1 103 LEU MD1  1.800 . 5.000 4.637 3.924 5.080 0.080  6  0 "[    .    1    .    2]" 1 
        883 1  73 LEU MD2  1 103 LEU QD   1.800 . 5.000 4.547 3.875 4.970     .  0  0 "[    .    1    .    2]" 1 
        884 1  73 LEU HG   1  87 PHE QD   1.800 . 6.000 4.976 3.208 6.028 0.028 19  0 "[    .    1    .    2]" 1 
        885 1  73 LEU HG   1  87 PHE QE   1.800 . 5.000 4.194 2.445 5.038 0.038  3  0 "[    .    1    .    2]" 1 
        886 1  73 LEU HG   1  87 PHE HZ   1.800 . 6.000 5.418 4.059 6.096 0.096 12  0 "[    .    1    .    2]" 1 
        887 1  74 THR H    1  74 THR MG   1.800 . 5.000 3.783 3.759 3.813     .  0  0 "[    .    1    .    2]" 1 
        888 1  74 THR H    1  75 ASN H    1.800 . 5.000 3.578 2.741 4.559     .  0  0 "[    .    1    .    2]" 1 
        889 1  74 THR HA   1  75 ASN H    1.800 . 3.500 2.941 2.169 3.565 0.065  5  0 "[    .    1    .    2]" 1 
        890 1  74 THR HA   1  75 ASN QB   1.800 . 5.000 4.586 4.139 4.984     .  0  0 "[    .    1    .    2]" 1 
        891 1  74 THR HA   1  90 LEU H    1.800 . 5.000 3.346 2.838 3.793     .  0  0 "[    .    1    .    2]" 1 
        892 1  74 THR MG   1  75 ASN H    1.800 . 5.000 3.206 2.473 3.701     .  0  0 "[    .    1    .    2]" 1 
        893 1  74 THR MG   1  91 LYS HA   1.800 . 5.000 4.952 3.642 5.076 0.076 15  0 "[    .    1    .    2]" 1 
        894 1  75 ASN H    1  76 PRO HD2  1.800 . 3.500 3.313 2.776 3.651 0.151  6  0 "[    .    1    .    2]" 1 
        895 1  75 ASN HA   1  76 PRO QB   1.800 . 5.000 4.892 4.679 4.994     .  0  0 "[    .    1    .    2]" 1 
        896 1  75 ASN HA   1  76 PRO QD   1.800 . 2.900 2.203 2.145 2.254     .  0  0 "[    .    1    .    2]" 1 
        897 1  75 ASN HA   1  78 LYS H    1.800 . 7.300 4.885 4.348 7.391 0.091 17  0 "[    .    1    .    2]" 1 
        898 1  75 ASN HA   1  89 GLY QA   1.800 . 3.500 3.530 3.168 3.596 0.096  7  0 "[    .    1    .    2]" 1 
        899 1  75 ASN HB2  1  76 PRO HA   1.800 . 6.000 5.423 4.907 6.084 0.084  5  0 "[    .    1    .    2]" 1 
        900 1  75 ASN HB3  1  76 PRO HA   1.800 . 6.300 5.345 4.808 6.256     .  0  0 "[    .    1    .    2]" 1 
        901 1  76 PRO HA   1  76 PRO QD   1.800 . 3.500 3.298 3.212 3.327     .  0  0 "[    .    1    .    2]" 1 
        902 1  76 PRO HA   1  76 PRO QG   1.800 . 3.500 3.352 2.996 3.500     .  0  0 "[    .    1    .    2]" 1 
        903 1  76 PRO HA   1  80 ILE H    1.800 . 6.800 4.431 3.431 6.535     .  0  0 "[    .    1    .    2]" 1 
        904 1  76 PRO HB2  1  77 ALA H    1.800 . 5.000 3.381 2.934 3.647     .  0  0 "[    .    1    .    2]" 1 
        905 1  76 PRO HB3  1  77 ALA H    1.800 . 5.000 4.304 3.886 4.417     .  0  0 "[    .    1    .    2]" 1 
        906 1  76 PRO QD   1  90 LEU H    1.800 . 5.000 4.302 3.799 4.765     .  0  0 "[    .    1    .    2]" 1 
        907 1  76 PRO HG2  1  89 GLY QA   1.800 . 5.000 3.804 2.567 4.577     .  0  0 "[    .    1    .    2]" 1 
        908 1  77 ALA H    1  77 ALA HA   1.800 . 2.900 2.852 2.757 2.891     .  0  0 "[    .    1    .    2]" 1 
        909 1  77 ALA H    1  77 ALA MB   1.800 . 2.900 2.189 2.046 2.983 0.083 18  0 "[    .    1    .    2]" 1 
        910 1  77 ALA H    1  78 LYS H    1.800 . 5.000 3.064 2.753 4.660     .  0  0 "[    .    1    .    2]" 1 
        911 1  77 ALA H    1  79 TYR H    1.800 . 5.000 3.754 2.604 4.255     .  0  0 "[    .    1    .    2]" 1 
        912 1  77 ALA HA   1  78 LYS H    1.800 . 5.000 3.511 2.317 3.593     .  0  0 "[    .    1    .    2]" 1 
        913 1  77 ALA MB   1  78 LYS H    1.800 . 3.500 2.240 1.888 2.735     .  0  0 "[    .    1    .    2]" 1 
        914 1  78 LYS H    1  78 LYS HA   1.800 . 2.900 2.842 2.339 2.959 0.059 15  0 "[    .    1    .    2]" 1 
        915 1  78 LYS H    1  78 LYS QD   1.800 . 5.300 4.043 3.662 5.164     .  0  0 "[    .    1    .    2]" 1 
        916 1  78 LYS H    1  78 LYS QG   1.800 . 5.000 2.645 2.024 4.115     .  0  0 "[    .    1    .    2]" 1 
        917 1  78 LYS H    1  79 TYR H    1.800 . 3.500 2.653 2.342 3.273     .  0  0 "[    .    1    .    2]" 1 
        918 1  78 LYS H    1  80 ILE H    1.800 . 6.800 4.906 4.060 6.842 0.042  5  0 "[    .    1    .    2]" 1 
        919 1  78 LYS HA   1  78 LYS QD   1.800 . 5.000 3.954 3.912 4.266     .  0  0 "[    .    1    .    2]" 1 
        920 1  78 LYS HA   1  78 LYS QG   1.800 . 5.000 2.386 2.293 3.305     .  0  0 "[    .    1    .    2]" 1 
        921 1  78 LYS HA   1  81 PRO QB   1.800 . 6.800 3.944 3.020 6.878 0.078  9  0 "[    .    1    .    2]" 1 
        922 1  78 LYS HB2  1  79 TYR H    1.800 . 5.000 3.275 2.698 4.300     .  0  0 "[    .    1    .    2]" 1 
        923 1  78 LYS HB2  1  80 ILE H    1.800 . 6.800 5.804 5.332 6.668     .  0  0 "[    .    1    .    2]" 1 
        924 1  78 LYS HB3  1  79 TYR H    1.800 . 5.000 3.631 2.682 4.313     .  0  0 "[    .    1    .    2]" 1 
        925 1  78 LYS HB3  1  80 ILE H    1.800 . 6.300 5.796 5.243 6.325 0.025 11  0 "[    .    1    .    2]" 1 
        926 1  78 LYS QD   1  79 TYR H    1.800 . 6.000 4.936 4.605 5.570     .  0  0 "[    .    1    .    2]" 1 
        927 1  79 TYR H    1  80 ILE H    1.800 . 5.000 3.104 2.752 4.544     .  0  0 "[    .    1    .    2]" 1 
        928 1  79 TYR HA   1  80 ILE H    1.800 . 5.000 3.381 2.183 3.608     .  0  0 "[    .    1    .    2]" 1 
        929 1  79 TYR QD   1  80 ILE MD   1.800 . 5.000 3.423 2.570 4.198     .  0  0 "[    .    1    .    2]" 1 
        930 1  79 TYR QE   1  80 ILE MD   1.800 . 5.000 3.642 2.003 4.925     .  0  0 "[    .    1    .    2]" 1 
        931 1  79 TYR QE   1  80 ILE HG12 1.800 . 6.000 3.963 2.830 4.579     .  0  0 "[    .    1    .    2]" 1 
        932 1  79 TYR QE   1  80 ILE HG13 1.800 . 6.000 4.413 2.261 6.008 0.008 15  0 "[    .    1    .    2]" 1 
        933 1  80 ILE H    1  80 ILE MD   1.800 . 5.000 4.082 2.442 4.513     .  0  0 "[    .    1    .    2]" 1 
        934 1  80 ILE H    1  80 ILE HG12 1.800 . 5.000 3.345 2.285 5.150 0.150 13  0 "[    .    1    .    2]" 1 
        935 1  80 ILE H    1  80 ILE HG13 1.800 . 5.000 3.407 2.092 4.738     .  0  0 "[    .    1    .    2]" 1 
        936 1  80 ILE H    1  80 ILE MG   1.800 . 5.000 3.446 2.248 4.050     .  0  0 "[    .    1    .    2]" 1 
        937 1  80 ILE H    1  83 THR MG   1.800 . 6.300 5.027 4.003 6.245     .  0  0 "[    .    1    .    2]" 1 
        938 1  80 ILE HA   1  80 ILE MG   1.800 . 3.500 2.435 2.144 3.200     .  0  0 "[    .    1    .    2]" 1 
        939 1  80 ILE MD   1  81 PRO QD   1.800 . 5.000 4.407 3.346 5.155 0.155 19  0 "[    .    1    .    2]" 1 
        940 1  80 ILE MD   1  83 THR HB   1.800 . 6.800 4.336 2.254 6.804 0.004 20  0 "[    .    1    .    2]" 1 
        941 1  80 ILE QG   1  83 THR HB   1.800 . 6.800 5.030 2.999 6.669     .  0  0 "[    .    1    .    2]" 1 
        942 1  80 ILE MG   1  83 THR HB   1.800 . 5.300 3.783 2.443 5.307 0.007  9  0 "[    .    1    .    2]" 1 
        943 1  80 ILE MG   1  83 THR MG   1.800 . 5.000 2.759 1.782 4.144 0.018  7  0 "[    .    1    .    2]" 1 
        944 1  81 PRO HA   1  81 PRO QD   1.800 . 5.000 3.426 3.174 3.521     .  0  0 "[    .    1    .    2]" 1 
        945 1  81 PRO HA   1  81 PRO QG   1.800 . 3.500 3.355 2.970 3.530 0.030  4  0 "[    .    1    .    2]" 1 
        946 1  81 PRO HA   1  82 GLY H    1.800 . 3.500 2.572 2.230 3.539 0.039  2  0 "[    .    1    .    2]" 1 
        947 1  81 PRO HA   1  83 THR H    1.800 . 5.300 3.630 3.194 5.367 0.067 16  0 "[    .    1    .    2]" 1 
        948 1  81 PRO HA   1  83 THR HB   1.800 . 7.000 5.890 5.207 6.872     .  0  0 "[    .    1    .    2]" 1 
        949 1  81 PRO HB2  1  82 GLY H    1.800 . 5.000 3.344 2.798 3.928     .  0  0 "[    .    1    .    2]" 1 
        950 1  81 PRO HB2  1  83 THR H    1.800 . 6.000 5.008 3.793 5.446     .  0  0 "[    .    1    .    2]" 1 
        951 1  81 PRO HB3  1  82 GLY H    1.800 . 5.000 3.870 3.507 4.620     .  0  0 "[    .    1    .    2]" 1 
        952 1  81 PRO HB3  1  83 THR H    1.800 . 6.000 5.502 5.315 6.015 0.015 16  0 "[    .    1    .    2]" 1 
        953 1  81 PRO QD   1  81 PRO QG   1.800 . 5.000 1.969 1.958 1.983     .  0  0 "[    .    1    .    2]" 1 
        954 1  81 PRO QD   1  82 GLY H    1.800 . 5.000 4.460 2.287 5.034 0.034 20  0 "[    .    1    .    2]" 1 
        955 1  81 PRO QG   1  82 GLY H    1.800 . 5.000 4.302 2.846 4.823     .  0  0 "[    .    1    .    2]" 1 
        956 1  82 GLY H    1  82 GLY HA2  1.800 . 2.900 2.482 2.377 2.947 0.047 11  0 "[    .    1    .    2]" 1 
        957 1  82 GLY H    1  82 GLY HA3  1.800 . 2.900 2.870 2.343 2.980 0.080 18  0 "[    .    1    .    2]" 1 
        958 1  82 GLY H    1  83 THR H    1.800 . 3.500 2.402 2.092 2.812     .  0  0 "[    .    1    .    2]" 1 
        959 1  82 GLY HA2  1  83 THR H    1.800 . 3.500 3.214 2.723 3.520 0.020  2  0 "[    .    1    .    2]" 1 
        960 1  82 GLY HA3  1  83 THR H    1.800 . 5.000 3.354 2.987 3.573     .  0  0 "[    .    1    .    2]" 1 
        961 1  83 THR H    1  83 THR MG   1.800 . 3.500 2.174 1.883 2.778     .  0  0 "[    .    1    .    2]" 1 
        962 1  83 THR H    1  84 LYS H    1.800 . 5.000 4.541 3.938 4.654     .  0  0 "[    .    1    .    2]" 1 
        963 1  83 THR HA   1  84 LYS H    1.800 . 5.000 2.496 2.303 3.315     .  0  0 "[    .    1    .    2]" 1 
        964 1  84 LYS H    1  84 LYS QD   1.800 . 5.000 4.153 3.605 4.415     .  0  0 "[    .    1    .    2]" 1 
        965 1  84 LYS H    1  84 LYS HE2  1.800 . 5.000 4.204 3.467 5.036 0.036 20  0 "[    .    1    .    2]" 1 
        966 1  84 LYS H    1  84 LYS HE3  1.800 . 5.000 4.164 3.349 5.151 0.151 13  0 "[    .    1    .    2]" 1 
        967 1  84 LYS H    1  84 LYS HG2  1.800 . 5.000 3.254 1.897 3.580     .  0  0 "[    .    1    .    2]" 1 
        968 1  84 LYS H    1  84 LYS HG3  1.800 . 5.000 2.370 1.866 3.241     .  0  0 "[    .    1    .    2]" 1 
        969 1  84 LYS HB2  1  85 MET H    1.800 . 5.000 3.618 2.779 4.390     .  0  0 "[    .    1    .    2]" 1 
        970 1  84 LYS HB3  1  85 MET H    1.800 . 5.000 4.299 3.847 4.442     .  0  0 "[    .    1    .    2]" 1 
        971 1  86 ALA H    1  86 ALA MB   1.800 . 3.500 2.475 2.262 2.815     .  0  0 "[    .    1    .    2]" 1 
        972 1  86 ALA H    1  87 PHE H    1.800 . 5.000 3.025 2.264 3.732     .  0  0 "[    .    1    .    2]" 1 
        973 1  86 ALA MB   1  87 PHE H    1.800 . 3.500 3.597 3.389 3.695 0.195 17  0 "[    .    1    .    2]" 1 
        974 1  87 PHE HB2  1  87 PHE QE   1.800 . 5.000 4.454 4.441 4.468     .  0  0 "[    .    1    .    2]" 1 
        975 1  87 PHE HB3  1  87 PHE QE   1.800 . 5.000 4.437 4.427 4.449     .  0  0 "[    .    1    .    2]" 1 
        976 1  87 PHE QD   1  88 GLY H    1.800 . 3.500 3.432 2.150 3.548 0.048  8  0 "[    .    1    .    2]" 1 
        977 1  87 PHE QE   1  90 LEU MD1  1.800 . 3.500 3.127 2.605 3.545 0.045  5  0 "[    .    1    .    2]" 1 
        978 1  87 PHE QE   1  90 LEU MD2  1.800 . 3.500 3.082 2.755 3.411     .  0  0 "[    .    1    .    2]" 1 
        979 1  87 PHE QE   1  90 LEU HG   1.800 . 5.000 2.624 2.261 4.334     .  0  0 "[    .    1    .    2]" 1 
        980 1  87 PHE QE   1  99 LEU MD1  1.800 . 6.000 4.577 3.247 5.198     .  0  0 "[    .    1    .    2]" 1 
        981 1  87 PHE QE   1  99 LEU MD2  1.800 . 5.000 3.631 3.025 5.021 0.021 10  0 "[    .    1    .    2]" 1 
        982 1  87 PHE HZ   1  88 GLY H    1.800 . 6.000 5.329 5.120 5.635     .  0  0 "[    .    1    .    2]" 1 
        983 1  87 PHE HZ   1  90 LEU MD1  1.800 . 2.900 2.605 2.194 2.936 0.036 18  0 "[    .    1    .    2]" 1 
        984 1  87 PHE HZ   1  90 LEU MD2  1.800 . 2.900 2.726 2.301 2.958 0.058  6  0 "[    .    1    .    2]" 1 
        985 1  87 PHE HZ   1  90 LEU HG   1.800 . 5.000 3.492 2.989 4.085     .  0  0 "[    .    1    .    2]" 1 
        986 1  87 PHE HZ   1  99 LEU MD1  1.800 . 5.000 4.647 2.767 5.036 0.036 11  0 "[    .    1    .    2]" 1 
        987 1  87 PHE HZ   1  99 LEU MD2  1.800 . 5.000 3.401 2.572 5.026 0.026  2  0 "[    .    1    .    2]" 1 
        988 1  88 GLY QA   1  89 GLY H    1.800 . 5.000 2.275 2.170 2.335     .  0  0 "[    .    1    .    2]" 1 
        989 1  89 GLY QA   1  90 LEU H    1.800 . 5.000 2.297 2.203 2.783     .  0  0 "[    .    1    .    2]" 1 
        990 1  90 LEU H    1  90 LEU MD1  1.800 . 5.000 3.808 3.652 3.876     .  0  0 "[    .    1    .    2]" 1 
        991 1  90 LEU H    1  90 LEU MD2  1.800 . 5.000 3.280 3.124 3.385     .  0  0 "[    .    1    .    2]" 1 
        992 1  90 LEU H    1  90 LEU HG   1.800 . 5.000 2.374 2.119 2.488     .  0  0 "[    .    1    .    2]" 1 
        993 1  90 LEU HA   1  90 LEU MD1  1.800 . 5.000 3.790 3.779 3.821     .  0  0 "[    .    1    .    2]" 1 
        994 1  90 LEU HA   1  90 LEU MD2  1.800 . 5.000 2.057 2.048 2.104     .  0  0 "[    .    1    .    2]" 1 
        995 1  90 LEU HA   1  90 LEU HG   1.800 . 3.500 3.174 3.150 3.243     .  0  0 "[    .    1    .    2]" 1 
        996 1  90 LEU QD   1  91 LYS H    1.800 . 5.000 3.564 3.418 3.615     .  0  0 "[    .    1    .    2]" 1 
        997 1  90 LEU QD   1  95 ASP QB   1.800 . 3.500 3.037 2.456 3.591 0.091 20  0 "[    .    1    .    2]" 1 
        998 1  90 LEU QD   1  99 LEU MD1  1.800 . 5.000 4.112 2.296 4.627     .  0  0 "[    .    1    .    2]" 1 
        999 1  90 LEU QD   1  99 LEU MD2  1.800 . 5.000 2.902 2.221 4.510     .  0  0 "[    .    1    .    2]" 1 
       1000 1  90 LEU MD1  1  95 ASP HB2  1.800 . 5.000 3.474 2.740 4.172     .  0  0 "[    .    1    .    2]" 1 
       1001 1  90 LEU MD1  1  95 ASP HB3  1.800 . 5.000 3.539 2.840 4.693     .  0  0 "[    .    1    .    2]" 1 
       1002 1  90 LEU MD1  1  96 ARG HA   1.800 . 5.000 2.601 2.196 3.499     .  0  0 "[    .    1    .    2]" 1 
       1003 1  90 LEU MD2  1  95 ASP QB   1.800 . 5.000 4.285 3.797 5.025 0.025 20  0 "[    .    1    .    2]" 1 
       1004 1  90 LEU MD2  1  96 ARG HA   1.800 . 6.000 5.238 4.769 5.989     .  0  0 "[    .    1    .    2]" 1 
       1005 1  91 LYS H    1  91 LYS QE   1.800 . 5.000 3.944 3.391 4.927     .  0  0 "[    .    1    .    2]" 1 
       1006 1  91 LYS H    1  91 LYS QG   1.800 . 5.000 2.591 1.938 3.990     .  0  0 "[    .    1    .    2]" 1 
       1007 1  91 LYS HA   1  91 LYS QE   1.800 . 6.000 4.555 3.722 5.472     .  0  0 "[    .    1    .    2]" 1 
       1008 1  91 LYS HA   1  91 LYS QG   1.800 . 5.000 2.388 2.307 3.304     .  0  0 "[    .    1    .    2]" 1 
       1009 1  91 LYS HA   1  92 LYS H    1.800 . 5.000 3.426 2.306 3.566     .  0  0 "[    .    1    .    2]" 1 
       1010 1  91 LYS QB   1  92 LYS H    1.800 . 5.000 2.889 1.783 3.757 0.017  6  0 "[    .    1    .    2]" 1 
       1011 1  91 LYS QE   1  92 LYS H    1.800 . 5.300 4.882 4.069 5.489 0.189 17  0 "[    .    1    .    2]" 1 
       1012 1  92 LYS H    1  92 LYS HA   1.800 . 2.900 2.946 2.768 2.985 0.085 14  0 "[    .    1    .    2]" 1 
       1013 1  92 LYS H    1  92 LYS QD   1.800 . 5.000 4.121 3.387 4.844     .  0  0 "[    .    1    .    2]" 1 
       1014 1  92 LYS H    1  92 LYS QG   1.800 . 5.000 2.724 2.048 4.119     .  0  0 "[    .    1    .    2]" 1 
       1015 1  92 LYS H    1  93 GLU H    1.800 . 5.000 4.480 4.138 4.598     .  0  0 "[    .    1    .    2]" 1 
       1016 1  92 LYS HA   1  92 LYS QG   1.800 . 5.000 2.342 2.297 2.963     .  0  0 "[    .    1    .    2]" 1 
       1017 1  92 LYS HA   1  93 GLU H    1.800 . 5.000 2.177 2.165 2.209     .  0  0 "[    .    1    .    2]" 1 
       1018 1  92 LYS HB2  1  93 GLU H    1.800 . 5.000 4.263 4.202 4.444     .  0  0 "[    .    1    .    2]" 1 
       1019 1  92 LYS HB3  1  93 GLU H    1.800 . 5.000 3.460 3.259 4.281     .  0  0 "[    .    1    .    2]" 1 
       1020 1  92 LYS QD   1  93 GLU H    1.800 . 5.000 5.018 3.907 5.120 0.120 18  0 "[    .    1    .    2]" 1 
       1021 1  92 LYS QG   1  93 GLU H    1.800 . 5.000 3.932 2.919 4.783     .  0  0 "[    .    1    .    2]" 1 
       1022 1  93 GLU H    1  93 GLU QG   1.800 . 5.000 2.821 2.208 4.229     .  0  0 "[    .    1    .    2]" 1 
       1023 1  93 GLU H    1  96 ARG H    1.800 . 5.000 4.765 3.550 5.085 0.085 11  0 "[    .    1    .    2]" 1 
       1024 1  93 GLU HA   1  94 LYS H    1.800 . 5.000 3.419 2.286 3.577     .  0  0 "[    .    1    .    2]" 1 
       1025 1  93 GLU HA   1  96 ARG QB   1.800 . 5.000 2.749 2.273 4.818     .  0  0 "[    .    1    .    2]" 1 
       1026 1  93 GLU HB2  1  94 LYS H    1.800 . 5.000 3.126 2.632 4.124     .  0  0 "[    .    1    .    2]" 1 
       1027 1  93 GLU HB3  1  94 LYS H    1.800 . 5.000 3.542 2.495 3.863     .  0  0 "[    .    1    .    2]" 1 
       1028 1  94 LYS H    1  94 LYS HA   1.800 . 2.900 2.832 2.818 2.846     .  0  0 "[    .    1    .    2]" 1 
       1029 1  94 LYS H    1  94 LYS HB2  1.800 . 3.500 2.492 2.393 2.541     .  0  0 "[    .    1    .    2]" 1 
       1030 1  94 LYS H    1  94 LYS QD   1.800 . 5.000 3.954 3.831 4.417     .  0  0 "[    .    1    .    2]" 1 
       1031 1  94 LYS H    1  94 LYS QG   1.800 . 5.000 2.471 2.053 3.964     .  0  0 "[    .    1    .    2]" 1 
       1032 1  94 LYS H    1  95 ASP H    1.800 . 5.000 2.842 2.702 2.937     .  0  0 "[    .    1    .    2]" 1 
       1033 1  94 LYS HA   1  95 ASP H    1.800 . 5.000 3.574 3.531 3.592     .  0  0 "[    .    1    .    2]" 1 
       1034 1  94 LYS HA   1  97 ASN QB   1.800 . 3.500 3.087 2.750 3.469     .  0  0 "[    .    1    .    2]" 1 
       1035 1  94 LYS HB2  1  95 ASP H    1.800 . 3.500 2.747 2.401 3.652 0.152 17  0 "[    .    1    .    2]" 1 
       1036 1  94 LYS HB3  1  95 ASP H    1.800 . 5.000 3.297 2.188 3.805     .  0  0 "[    .    1    .    2]" 1 
       1037 1  94 LYS QD   1  95 ASP H    1.800 . 5.000 4.576 4.099 4.911     .  0  0 "[    .    1    .    2]" 1 
       1038 1  94 LYS QG   1  95 ASP H    1.800 . 5.000 3.929 3.445 4.093     .  0  0 "[    .    1    .    2]" 1 
       1039 1  95 ASP H    1  95 ASP HB3  1.800 . 3.500 3.551 2.596 3.613 0.113 10  0 "[    .    1    .    2]" 1 
       1040 1  95 ASP H    1  96 ARG H    1.800 . 5.000 2.665 2.609 2.783     .  0  0 "[    .    1    .    2]" 1 
       1041 1  95 ASP H    1  97 ASN H    1.800 . 5.000 4.294 4.199 4.436     .  0  0 "[    .    1    .    2]" 1 
       1042 1  95 ASP HA   1  96 ARG H    1.800 . 5.000 3.539 3.504 3.564     .  0  0 "[    .    1    .    2]" 1 
       1043 1  95 ASP HA   1  97 ASN QB   1.800 . 5.300 4.919 4.782 5.237     .  0  0 "[    .    1    .    2]" 1 
       1044 1  95 ASP HA   1  98 ASP H    1.800 . 5.000 3.458 3.262 3.615     .  0  0 "[    .    1    .    2]" 1 
       1045 1  95 ASP HA   1  99 LEU H    1.800 . 5.000 4.374 3.614 4.649     .  0  0 "[    .    1    .    2]" 1 
       1046 1  95 ASP HB2  1  96 ARG H    1.800 . 5.000 2.704 2.562 3.927     .  0  0 "[    .    1    .    2]" 1 
       1047 1  95 ASP HB3  1  96 ARG H    1.800 . 5.000 3.652 3.558 4.057     .  0  0 "[    .    1    .    2]" 1 
       1048 1  96 ARG H    1  96 ARG QB   1.800 . 3.500 2.276 2.232 2.480     .  0  0 "[    .    1    .    2]" 1 
       1049 1  96 ARG H    1  96 ARG QD   1.800 . 5.000 4.628 3.751 4.814     .  0  0 "[    .    1    .    2]" 1 
       1050 1  96 ARG H    1  97 ASN H    1.800 . 5.000 2.771 2.715 2.815     .  0  0 "[    .    1    .    2]" 1 
       1051 1  96 ARG HA   1  97 ASN H    1.800 . 5.000 3.568 3.555 3.577     .  0  0 "[    .    1    .    2]" 1 
       1052 1  96 ARG HA   1  98 ASP H    1.800 . 5.300 4.450 4.308 4.828     .  0  0 "[    .    1    .    2]" 1 
       1053 1  96 ARG HA   1  99 LEU H    1.800 . 5.000 3.496 3.373 3.741     .  0  0 "[    .    1    .    2]" 1 
       1054 1  96 ARG HA   1  99 LEU HB2  1.800 . 3.500 3.453 2.965 3.590 0.090  3  0 "[    .    1    .    2]" 1 
       1055 1  96 ARG HA   1  99 LEU HB3  1.800 . 3.500 3.066 2.599 3.366     .  0  0 "[    .    1    .    2]" 1 
       1056 1  96 ARG QB   1  97 ASN H    1.800 . 3.500 2.488 2.401 2.565     .  0  0 "[    .    1    .    2]" 1 
       1057 1  96 ARG QD   1  97 ASN H    1.800 . 5.000 4.664 4.289 5.130 0.130 11  0 "[    .    1    .    2]" 1 
       1058 1  97 ASN H    1  97 ASN HB2  1.800 . 3.500 2.445 2.316 2.523     .  0  0 "[    .    1    .    2]" 1 
       1059 1  97 ASN H    1  97 ASN HB3  1.800 . 3.500 3.320 2.622 3.605 0.105 16  0 "[    .    1    .    2]" 1 
       1060 1  97 ASN HA   1  97 ASN QD   1.800 . 5.000 3.094 1.962 4.040     .  0  0 "[    .    1    .    2]" 1 
       1061 1  97 ASN HA   1  98 ASP H    1.800 . 5.000 3.567 3.547 3.588     .  0  0 "[    .    1    .    2]" 1 
       1062 1  97 ASN QB   1 101 THR MG   1.800 . 6.000 5.543 5.170 6.056 0.056 10  0 "[    .    1    .    2]" 1 
       1063 1  97 ASN HB2  1  98 ASP H    1.800 . 5.000 2.986 2.601 3.826     .  0  0 "[    .    1    .    2]" 1 
       1064 1  97 ASN HB3  1  98 ASP H    1.800 . 5.000 3.274 2.400 3.679     .  0  0 "[    .    1    .    2]" 1 
       1065 1  98 ASP H    1  98 ASP HB2  1.800 . 3.500 2.454 2.408 2.540     .  0  0 "[    .    1    .    2]" 1 
       1066 1  98 ASP H    1  98 ASP HB3  1.800 . 3.500 3.495 2.572 3.607 0.107 19  0 "[    .    1    .    2]" 1 
       1067 1  98 ASP H    1  99 LEU H    1.800 . 2.900 2.699 2.628 2.737     .  0  0 "[    .    1    .    2]" 1 
       1068 1  98 ASP H    1 100 ILE H    1.800 . 5.000 4.372 4.258 4.463     .  0  0 "[    .    1    .    2]" 1 
       1069 1  98 ASP HA   1  99 LEU H    1.800 . 5.000 3.561 3.547 3.571     .  0  0 "[    .    1    .    2]" 1 
       1070 1  98 ASP HA   1 100 ILE H    1.800 . 5.000 4.492 4.418 4.592     .  0  0 "[    .    1    .    2]" 1 
       1071 1  98 ASP HA   1 101 THR H    1.800 . 5.000 3.389 3.262 3.595     .  0  0 "[    .    1    .    2]" 1 
       1072 1  98 ASP QB   1  99 LEU H    1.800 . 3.500 2.578 2.538 2.614     .  0  0 "[    .    1    .    2]" 1 
       1073 1  99 LEU H    1  99 LEU HB2  1.800 . 3.500 2.508 2.381 2.564     .  0  0 "[    .    1    .    2]" 1 
       1074 1  99 LEU H    1  99 LEU HB3  1.800 . 3.500 2.600 2.543 2.717     .  0  0 "[    .    1    .    2]" 1 
       1075 1  99 LEU H    1  99 LEU MD1  1.800 . 5.000 3.977 3.912 4.222     .  0  0 "[    .    1    .    2]" 1 
       1076 1  99 LEU H    1  99 LEU MD2  1.800 . 5.000 4.244 4.194 4.269     .  0  0 "[    .    1    .    2]" 1 
       1077 1  99 LEU H    1  99 LEU HG   1.800 . 5.000 4.470 4.329 4.502     .  0  0 "[    .    1    .    2]" 1 
       1078 1  99 LEU H    1 100 ILE H    1.800 . 5.000 2.814 2.750 2.899     .  0  0 "[    .    1    .    2]" 1 
       1079 1  99 LEU HA   1  99 LEU MD1  1.800 . 5.000 2.215 2.030 3.655     .  0  0 "[    .    1    .    2]" 1 
       1080 1  99 LEU HA   1  99 LEU MD2  1.800 . 5.000 3.709 2.971 3.811     .  0  0 "[    .    1    .    2]" 1 
       1081 1  99 LEU HA   1 100 ILE H    1.800 . 5.000 3.576 3.563 3.586     .  0  0 "[    .    1    .    2]" 1 
       1082 1  99 LEU HA   1 102 TYR H    1.800 . 5.000 3.551 3.416 3.666     .  0  0 "[    .    1    .    2]" 1 
       1083 1  99 LEU HA   1 103 LEU HG   1.800 . 5.300 4.963 4.453 5.227     .  0  0 "[    .    1    .    2]" 1 
       1084 1  99 LEU QB   1  99 LEU MD1  1.800 . 2.900 2.203 2.053 2.262     .  0  0 "[    .    1    .    2]" 1 
       1085 1  99 LEU QB   1  99 LEU MD2  1.800 . 2.900 2.069 2.052 2.135     .  0  0 "[    .    1    .    2]" 1 
       1086 1  99 LEU HB2  1 100 ILE H    1.800 . 5.000 3.835 3.735 3.877     .  0  0 "[    .    1    .    2]" 1 
       1087 1  99 LEU HB3  1 100 ILE H    1.800 . 3.500 2.508 2.475 2.561     .  0  0 "[    .    1    .    2]" 1 
       1088 1  99 LEU QD   1 100 ILE H    1.800 . 5.000 3.783 2.988 3.931     .  0  0 "[    .    1    .    2]" 1 
       1089 1  99 LEU MD1  1 103 LEU H    1.800 . 6.000 4.404 3.961 6.075 0.075  2  0 "[    .    1    .    2]" 1 
       1090 1  99 LEU MD2  1 103 LEU H    1.800 . 6.000 5.746 3.522 6.045 0.045  8  0 "[    .    1    .    2]" 1 
       1091 1 100 ILE H    1 100 ILE HB   1.800 . 2.900 2.562 2.509 2.613     .  0  0 "[    .    1    .    2]" 1 
       1092 1 100 ILE H    1 100 ILE MD   1.800 . 3.500 3.479 3.436 3.523 0.023 10  0 "[    .    1    .    2]" 1 
       1093 1 100 ILE H    1 100 ILE MG   1.800 . 5.000 3.775 3.766 3.783     .  0  0 "[    .    1    .    2]" 1 
       1094 1 100 ILE H    1 101 THR H    1.800 . 5.000 2.619 2.552 2.699     .  0  0 "[    .    1    .    2]" 1 
       1095 1 100 ILE HA   1 100 ILE HB   1.800 . 2.900 3.025 3.022 3.028 0.128 10  0 "[    .    1    .    2]" 1 
       1096 1 100 ILE HA   1 100 ILE MD   1.800 . 5.000 3.832 3.818 3.849     .  0  0 "[    .    1    .    2]" 1 
       1097 1 100 ILE HA   1 100 ILE MG   1.800 . 5.000 2.313 2.262 2.405     .  0  0 "[    .    1    .    2]" 1 
       1098 1 100 ILE HA   1 101 THR H    1.800 . 5.000 3.536 3.519 3.561     .  0  0 "[    .    1    .    2]" 1 
       1099 1 100 ILE HA   1 103 LEU H    1.800 . 5.000 3.580 3.452 3.747     .  0  0 "[    .    1    .    2]" 1 
       1100 1 100 ILE HB   1 101 THR H    1.800 . 2.900 2.599 2.504 2.698     .  0  0 "[    .    1    .    2]" 1 
       1101 1 100 ILE MD   1 101 THR H    1.800 . 5.000 4.451 4.369 4.546     .  0  0 "[    .    1    .    2]" 1 
       1102 1 100 ILE MG   1 101 THR H    1.800 . 5.000 3.586 3.496 3.698     .  0  0 "[    .    1    .    2]" 1 
       1103 1 100 ILE MG   1 103 LEU H    1.800 . 5.000 4.583 4.446 4.811     .  0  0 "[    .    1    .    2]" 1 
       1104 1 101 THR H    1 101 THR MG   1.800 . 5.000 3.750 3.729 3.763     .  0  0 "[    .    1    .    2]" 1 
       1105 1 101 THR H    1 102 TYR H    1.800 . 5.000 2.769 2.716 2.805     .  0  0 "[    .    1    .    2]" 1 
       1106 1 101 THR H    1 103 LEU H    1.800 . 5.000 4.502 4.433 4.628     .  0  0 "[    .    1    .    2]" 1 
       1107 1 101 THR H    1 104 LYS QG   1.800 . 6.000 5.866 4.725 6.209 0.209 20  0 "[    .    1    .    2]" 1 
       1108 1 101 THR HA   1 101 THR MG   1.800 . 3.500 2.299 2.217 2.366     .  0  0 "[    .    1    .    2]" 1 
       1109 1 101 THR HA   1 102 TYR H    1.800 . 5.000 3.567 3.557 3.580     .  0  0 "[    .    1    .    2]" 1 
       1110 1 101 THR HA   1 103 LEU H    1.800 . 5.000 4.660 4.492 4.929     .  0  0 "[    .    1    .    2]" 1 
       1111 1 101 THR HA   1 104 LYS H    1.800 . 5.000 3.372 3.157 3.676     .  0  0 "[    .    1    .    2]" 1 
       1112 1 101 THR HA   1 104 LYS QB   1.800 . 5.000 2.241 2.028 2.969     .  0  0 "[    .    1    .    2]" 1 
       1113 1 101 THR HA   1 104 LYS QG   1.800 . 5.000 3.766 2.767 4.128     .  0  0 "[    .    1    .    2]" 1 
       1114 1 101 THR HB   1 102 TYR H    1.800 . 5.000 2.602 2.556 2.673     .  0  0 "[    .    1    .    2]" 1 
       1115 1 101 THR MG   1 102 TYR H    1.800 . 5.000 3.660 3.552 3.739     .  0  0 "[    .    1    .    2]" 1 
       1116 1 102 TYR H    1 102 TYR HB3  1.800 . 3.500 2.607 2.578 2.634     .  0  0 "[    .    1    .    2]" 1 
       1117 1 102 TYR HA   1 103 LEU H    1.800 . 5.000 3.590 3.580 3.606     .  0  0 "[    .    1    .    2]" 1 
       1118 1 102 TYR HB2  1 103 LEU H    1.800 . 5.000 3.776 3.710 3.906     .  0  0 "[    .    1    .    2]" 1 
       1119 1 102 TYR HB3  1 103 LEU H    1.800 . 5.000 2.399 2.310 2.579     .  0  0 "[    .    1    .    2]" 1 
       1120 1 102 TYR QD   1 103 LEU HG   1.800 . 5.000 2.899 2.608 3.377     .  0  0 "[    .    1    .    2]" 1 
       1121 1 103 LEU H    1 103 LEU QB   1.800 . 2.900 2.422 2.364 2.452     .  0  0 "[    .    1    .    2]" 1 
       1122 1 103 LEU H    1 103 LEU MD1  1.800 . 5.000 3.635 3.605 3.681     .  0  0 "[    .    1    .    2]" 1 
       1123 1 103 LEU H    1 103 LEU MD2  1.800 . 5.000 3.395 3.321 3.596     .  0  0 "[    .    1    .    2]" 1 
       1124 1 103 LEU H    1 104 LYS H    1.800 . 3.500 2.554 2.481 2.708     .  0  0 "[    .    1    .    2]" 1 
       1125 1 103 LEU HA   1 104 LYS H    1.800 . 3.500 3.517 3.498 3.547 0.047 13  0 "[    .    1    .    2]" 1 
       1126 1 103 LEU HA   1 106 ALA H    1.800 . 5.000 3.285 3.174 3.580     .  0  0 "[    .    1    .    2]" 1 
       1127 1 103 LEU QD   1 104 LYS HA   1.800 . 5.000 5.118 5.047 5.147 0.147 15  0 "[    .    1    .    2]" 1 
       1128 1 103 LEU MD1  1 104 LYS H    1.800 . 5.000 4.655 4.530 4.710     .  0  0 "[    .    1    .    2]" 1 
       1129 1 103 LEU MD2  1 104 LYS H    1.800 . 5.000 4.619 4.589 4.664     .  0  0 "[    .    1    .    2]" 1 
       1130 1 104 LYS H    1 104 LYS HB2  1.800 . 3.500 2.437 2.376 2.514     .  0  0 "[    .    1    .    2]" 1 
       1131 1 104 LYS H    1 104 LYS HB3  1.800 . 3.500 2.842 2.564 3.610 0.110  5  0 "[    .    1    .    2]" 1 
       1132 1 104 LYS H    1 104 LYS QD   1.800 . 5.000 4.227 3.618 4.420     .  0  0 "[    .    1    .    2]" 1 
       1133 1 104 LYS H    1 104 LYS QG   1.800 . 5.000 3.612 2.154 4.066     .  0  0 "[    .    1    .    2]" 1 
       1134 1 104 LYS H    1 105 LYS H    1.800 . 5.000 2.760 2.688 2.861     .  0  0 "[    .    1    .    2]" 1 
       1135 1 104 LYS HA   1 104 LYS QD   1.800 . 5.000 3.753 2.207 4.163     .  0  0 "[    .    1    .    2]" 1 
       1136 1 104 LYS HA   1 104 LYS QG   1.800 . 5.000 2.408 2.321 2.700     .  0  0 "[    .    1    .    2]" 1 
       1137 1 104 LYS HA   1 105 LYS H    1.800 . 5.000 3.559 3.541 3.588     .  0  0 "[    .    1    .    2]" 1 
       1138 1 104 LYS QB   1 105 LYS H    1.800 . 3.500 2.497 2.377 2.645     .  0  0 "[    .    1    .    2]" 1 
       1139 1 105 LYS H    1 105 LYS QB   1.800 . 2.900 2.333 2.252 2.443     .  0  0 "[    .    1    .    2]" 1 
       1140 1 105 LYS H    1 105 LYS HD2  1.800 . 5.000 4.438 3.953 4.835     .  0  0 "[    .    1    .    2]" 1 
       1141 1 105 LYS H    1 105 LYS HD3  1.800 . 5.000 4.873 4.386 5.057 0.057 20  0 "[    .    1    .    2]" 1 
       1142 1 105 LYS H    1 105 LYS QG   1.800 . 5.000 3.160 2.107 4.062     .  0  0 "[    .    1    .    2]" 1 
       1143 1 105 LYS H    1 106 ALA H    1.800 . 2.900 2.712 2.677 2.795     .  0  0 "[    .    1    .    2]" 1 
       1144 1 105 LYS H    1 106 ALA HA   1.800 . 6.000 5.340 5.052 5.386     .  0  0 "[    .    1    .    2]" 1 
       1145 1 105 LYS H    1 106 ALA MB   1.800 . 5.000 4.358 4.260 4.959     .  0  0 "[    .    1    .    2]" 1 
       1146 1 105 LYS H    1 108 GLU QB   1.800 . 6.300 5.568 4.256 6.334 0.034  5  0 "[    .    1    .    2]" 1 
       1147 1 105 LYS HA   1 105 LYS HD2  1.800 . 6.000 4.368 2.266 4.634     .  0  0 "[    .    1    .    2]" 1 
       1148 1 105 LYS HA   1 105 LYS HD3  1.800 . 6.000 4.378 2.657 4.660     .  0  0 "[    .    1    .    2]" 1 
       1149 1 105 LYS HA   1 105 LYS QG   1.800 . 5.000 2.386 2.314 2.827     .  0  0 "[    .    1    .    2]" 1 
       1150 1 105 LYS HA   1 106 ALA H    1.800 . 3.500 3.544 3.529 3.553 0.053  6  0 "[    .    1    .    2]" 1 
       1151 1 105 LYS HA   1 108 GLU QB   1.800 . 5.300 3.392 2.194 5.336 0.036  4  0 "[    .    1    .    2]" 1 
       1152 1 105 LYS QB   1 106 ALA H    1.800 . 3.500 2.466 2.327 2.545     .  0  0 "[    .    1    .    2]" 1 
       1153 1 105 LYS HD2  1 106 ALA H    1.800 . 5.300 5.149 4.826 5.394 0.094 20  0 "[    .    1    .    2]" 1 
       1154 1 105 LYS HD3  1 106 ALA H    1.800 . 5.300 5.062 4.628 5.467 0.167  8  0 "[    .    1    .    2]" 1 
       1155 1 105 LYS QG   1 106 ALA H    1.800 . 5.000 3.809 3.625 4.021     .  0  0 "[    .    1    .    2]" 1 
       1156 1 106 ALA H    1 106 ALA HA   1.800 . 2.900 2.837 2.713 2.860     .  0  0 "[    .    1    .    2]" 1 
       1157 1 106 ALA H    1 106 ALA MB   1.800 . 2.900 2.195 2.047 3.033 0.133  4  0 "[    .    1    .    2]" 1 
       1158 1 106 ALA H    1 107 THR H    1.800 . 3.500 2.695 2.473 2.773     .  0  0 "[    .    1    .    2]" 1 
       1159 1 106 ALA H    1 108 GLU H    1.800 . 5.000 4.063 2.452 4.581     .  0  0 "[    .    1    .    2]" 1 
       1160 1 106 ALA HA   1 107 THR H    1.800 . 5.000 3.475 2.521 3.553     .  0  0 "[    .    1    .    2]" 1 
       1161 1 106 ALA HA   1 108 GLU H    1.800 . 5.000 3.946 3.800 4.193     .  0  0 "[    .    1    .    2]" 1 
       1162 1 106 ALA MB   1 107 THR H    1.800 . 3.500 2.798 2.585 3.700 0.200  4  0 "[    .    1    .    2]" 1 
       1163 1 106 ALA MB   1 108 GLU H    1.800 . 5.000 4.339 3.279 4.581     .  0  0 "[    .    1    .    2]" 1 
       1164 1 107 THR H    1 107 THR MG   1.800 . 2.900 2.266 1.836 2.919 0.019 15  0 "[    .    1    .    2]" 1 
       1165 1 107 THR H    1 108 GLU H    1.800 . 2.900 2.604 2.404 2.862     .  0  0 "[    .    1    .    2]" 1 
       1166 1 107 THR HB   1 108 GLU H    1.800 . 5.000 3.969 3.582 4.473     .  0  0 "[    .    1    .    2]" 1 
       1167 1 107 THR MG   1 108 GLU H    1.800 . 5.000 3.397 1.808 4.127     .  0  0 "[    .    1    .    2]" 1 
       1168 1 108 GLU H    1 108 GLU HA   1.800 . 2.900 2.829 2.366 2.979 0.079  4  0 "[    .    1    .    2]" 1 
       1169 1 108 GLU H    1 108 GLU HB2  1.800 . 2.900 2.572 2.435 2.927 0.027  5  0 "[    .    1    .    2]" 1 
    stop_

save_



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