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
414537 2ctk 11136 cing 4-filtered-FRED Wattos check violation distance


data_2ctk


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              2065
    _Distance_constraint_stats_list.Viol_count                    257
    _Distance_constraint_stats_list.Viol_total                    31.062
    _Distance_constraint_stats_list.Viol_max                      0.070
    _Distance_constraint_stats_list.Viol_rms                      0.0010
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0000
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0060
    _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   7 GLY 0.000 0.000  . 0 "[    .    1    .    2]" 
       1   8 LYS 0.007 0.005 18 0 "[    .    1    .    2]" 
       1   9 GLU 0.063 0.044 14 0 "[    .    1    .    2]" 
       1  10 ALA 0.072 0.044 14 0 "[    .    1    .    2]" 
       1  11 LEU 0.182 0.059  2 0 "[    .    1    .    2]" 
       1  12 GLU 0.073 0.036 10 0 "[    .    1    .    2]" 
       1  13 ALA 0.009 0.005  2 0 "[    .    1    .    2]" 
       1  14 LEU 0.005 0.003 11 0 "[    .    1    .    2]" 
       1  15 VAL 0.010 0.009 20 0 "[    .    1    .    2]" 
       1  16 PRO 0.014 0.009 20 0 "[    .    1    .    2]" 
       1  17 VAL 0.006 0.004  9 0 "[    .    1    .    2]" 
       1  18 THR 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  19 ILE 0.001 0.001  2 0 "[    .    1    .    2]" 
       1  20 GLU 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  21 VAL 0.009 0.003 14 0 "[    .    1    .    2]" 
       1  22 GLU 0.021 0.004  1 0 "[    .    1    .    2]" 
       1  23 VAL 0.051 0.021  2 0 "[    .    1    .    2]" 
       1  24 PRO 0.023 0.021  2 0 "[    .    1    .    2]" 
       1  25 PHE 0.005 0.002 18 0 "[    .    1    .    2]" 
       1  26 ASP 0.002 0.002 20 0 "[    .    1    .    2]" 
       1  27 LEU 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  28 HIS 0.004 0.003  2 0 "[    .    1    .    2]" 
       1  29 ARG 0.003 0.003 14 0 "[    .    1    .    2]" 
       1  30 TYR 0.007 0.002  1 0 "[    .    1    .    2]" 
       1  31 VAL 0.002 0.002  2 0 "[    .    1    .    2]" 
       1  32 ILE 0.002 0.001  6 0 "[    .    1    .    2]" 
       1  33 GLY 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  34 GLN 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  35 LYS 0.003 0.003 19 0 "[    .    1    .    2]" 
       1  36 GLY 0.001 0.001  6 0 "[    .    1    .    2]" 
       1  37 SER 0.006 0.006 18 0 "[    .    1    .    2]" 
       1  38 GLY 0.028 0.015 18 0 "[    .    1    .    2]" 
       1  39 ILE 0.017 0.012 18 0 "[    .    1    .    2]" 
       1  40 ARG 0.099 0.027  9 0 "[    .    1    .    2]" 
       1  41 LYS 0.198 0.070 18 0 "[    .    1    .    2]" 
       1  42 MET 0.202 0.070 18 0 "[    .    1    .    2]" 
       1  43 MET 0.058 0.015 20 0 "[    .    1    .    2]" 
       1  44 ASP 0.040 0.013 20 0 "[    .    1    .    2]" 
       1  45 GLU 0.133 0.051 20 0 "[    .    1    .    2]" 
       1  46 PHE 0.053 0.015 20 0 "[    .    1    .    2]" 
       1  47 GLU 0.036 0.018  2 0 "[    .    1    .    2]" 
       1  48 VAL 0.022 0.007 20 0 "[    .    1    .    2]" 
       1  49 ASN 0.003 0.003 16 0 "[    .    1    .    2]" 
       1  50 ILE 0.003 0.001 18 0 "[    .    1    .    2]" 
       1  51 HIS 0.055 0.022 12 0 "[    .    1    .    2]" 
       1  52 VAL 0.014 0.014 12 0 "[    .    1    .    2]" 
       1  53 PRO 0.026 0.022 12 0 "[    .    1    .    2]" 
       1  54 ALA 0.014 0.006 19 0 "[    .    1    .    2]" 
       1  55 PRO 0.013 0.006 19 0 "[    .    1    .    2]" 
       1  56 GLU 0.084 0.043  9 0 "[    .    1    .    2]" 
       1  57 LEU 0.003 0.001 19 0 "[    .    1    .    2]" 
       1  58 GLN 0.009 0.005 19 0 "[    .    1    .    2]" 
       1  59 SER 0.012 0.012 12 0 "[    .    1    .    2]" 
       1  60 ASP 0.017 0.009  2 0 "[    .    1    .    2]" 
       1  61 ILE 0.025 0.012 12 0 "[    .    1    .    2]" 
       1  62 ILE 0.025 0.005  5 0 "[    .    1    .    2]" 
       1  63 ALA 0.047 0.022 12 0 "[    .    1    .    2]" 
       1  64 ILE 0.004 0.002  2 0 "[    .    1    .    2]" 
       1  65 THR 0.003 0.003 16 0 "[    .    1    .    2]" 
       1  66 GLY 0.003 0.002 17 0 "[    .    1    .    2]" 
       1  67 LEU 0.008 0.003 11 0 "[    .    1    .    2]" 
       1  68 ALA 0.002 0.001 16 0 "[    .    1    .    2]" 
       1  69 ALA 0.001 0.001 16 0 "[    .    1    .    2]" 
       1  70 ASN 0.002 0.001  1 0 "[    .    1    .    2]" 
       1  71 LEU 0.002 0.001 16 0 "[    .    1    .    2]" 
       1  72 ASP 0.004 0.002  2 0 "[    .    1    .    2]" 
       1  73 ARG 0.095 0.034 17 0 "[    .    1    .    2]" 
       1  74 ALA 0.034 0.011  2 0 "[    .    1    .    2]" 
       1  75 LYS 0.000 0.000  8 0 "[    .    1    .    2]" 
       1  76 ALA 0.000 0.000 20 0 "[    .    1    .    2]" 
       1  77 GLY 0.008 0.003 13 0 "[    .    1    .    2]" 
       1  78 LEU 0.009 0.005 11 0 "[    .    1    .    2]" 
       1  79 LEU 0.016 0.004  1 0 "[    .    1    .    2]" 
       1  80 GLU 0.014 0.009 11 0 "[    .    1    .    2]" 
       1  81 ARG 0.003 0.002 18 0 "[    .    1    .    2]" 
       1  82 VAL 0.008 0.005 11 0 "[    .    1    .    2]" 
       1  83 LYS 0.021 0.009 11 0 "[    .    1    .    2]" 
       1  84 GLU 0.067 0.037 19 0 "[    .    1    .    2]" 
       1  85 LEU 0.010 0.002  1 0 "[    .    1    .    2]" 
       1  86 GLN 0.017 0.006  6 0 "[    .    1    .    2]" 
       1  87 ALA 0.023 0.006  6 0 "[    .    1    .    2]" 
       1  88 GLU 0.010 0.005  9 0 "[    .    1    .    2]" 
       1  89 GLN 0.002 0.001 10 0 "[    .    1    .    2]" 
       1  90 GLU 0.001 0.001  6 0 "[    .    1    .    2]" 
       1  91 ASP 0.006 0.003 16 0 "[    .    1    .    2]" 
       1  92 ARG 0.080 0.027 17 0 "[    .    1    .    2]" 
       1  93 ALA 0.085 0.027 17 0 "[    .    1    .    2]" 
       1  94 LEU 0.082 0.063 20 0 "[    .    1    .    2]" 
       1  95 ARG 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  98 LYS 0.000 0.000  . 0 "[    .    1    .    2]" 
       1  99 SER 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 100 GLY 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 101 PRO 0.000 0.000  . 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   7 GLY H    1   8 LYS H    . . 4.750 3.661 2.188 4.636     .  0 0 "[    .    1    .    2]" 1 
          2 1   7 GLY QA   1   8 LYS QG   . . 5.390 4.090 3.436 4.895     .  0 0 "[    .    1    .    2]" 1 
          3 1   8 LYS H    1   8 LYS QE   . . 4.780 3.966 2.466 4.704     .  0 0 "[    .    1    .    2]" 1 
          4 1   8 LYS H    1   8 LYS QG   . . 4.430 2.655 1.899 3.602     .  0 0 "[    .    1    .    2]" 1 
          5 1   8 LYS H    1   9 GLU H    . . 4.890 4.271 2.217 4.639     .  0 0 "[    .    1    .    2]" 1 
          6 1   8 LYS HA   1   9 GLU QB   . . 4.990 4.190 3.787 4.990     .  0 0 "[    .    1    .    2]" 1 
          7 1   8 LYS HA   1   9 GLU QG   . . 5.500 4.418 3.473 5.505 0.005 18 0 "[    .    1    .    2]" 1 
          8 1   8 LYS QB   1   9 GLU H    . . 4.420 2.675 2.037 3.564     .  0 0 "[    .    1    .    2]" 1 
          9 1   8 LYS QB   1   9 GLU HA   . . 4.150 4.060 3.855 4.152 0.002  3 0 "[    .    1    .    2]" 1 
         10 1   8 LYS QG   1   9 GLU H    . . 5.380 3.909 3.149 4.373     .  0 0 "[    .    1    .    2]" 1 
         11 1   9 GLU H    1   9 GLU QB   . . 3.730 2.910 2.492 3.276     .  0 0 "[    .    1    .    2]" 1 
         12 1   9 GLU H    1   9 GLU QG   . . 4.240 3.302 2.385 4.246 0.006  4 0 "[    .    1    .    2]" 1 
         13 1   9 GLU H    1  10 ALA H    . . 4.460 4.266 3.708 4.461 0.001 15 0 "[    .    1    .    2]" 1 
         14 1   9 GLU H    1  10 ALA MB   . . 5.500 4.360 3.797 5.124     .  0 0 "[    .    1    .    2]" 1 
         15 1   9 GLU HA   1   9 GLU QG   . . 3.500 2.776 2.150 3.468     .  0 0 "[    .    1    .    2]" 1 
         16 1   9 GLU HA   1  10 ALA H    . . 3.480 2.262 2.153 2.505     .  0 0 "[    .    1    .    2]" 1 
         17 1   9 GLU HA   1  10 ALA MB   . . 4.800 3.893 3.755 4.164     .  0 0 "[    .    1    .    2]" 1 
         18 1   9 GLU QB   1  10 ALA H    . . 4.440 2.900 2.244 3.876     .  0 0 "[    .    1    .    2]" 1 
         19 1   9 GLU QB   1  10 ALA HA   . . 5.500 4.208 3.732 4.815     .  0 0 "[    .    1    .    2]" 1 
         20 1   9 GLU QG   1  10 ALA HA   . . 5.500 4.534 3.348 5.544 0.044 14 0 "[    .    1    .    2]" 1 
         21 1  10 ALA H    1  10 ALA MB   . . 3.400 2.663 2.288 2.948     .  0 0 "[    .    1    .    2]" 1 
         22 1  10 ALA H    1  11 LEU H    . . 3.950 3.680 2.483 3.944     .  0 0 "[    .    1    .    2]" 1 
         23 1  10 ALA HA   1  11 LEU H    . . 3.070 2.299 2.142 3.059     .  0 0 "[    .    1    .    2]" 1 
         24 1  10 ALA MB   1  11 LEU H    . . 3.560 3.420 3.218 3.583 0.023 17 0 "[    .    1    .    2]" 1 
         25 1  11 LEU H    1  11 LEU QB   . . 3.120 2.723 2.419 3.103     .  0 0 "[    .    1    .    2]" 1 
         26 1  11 LEU H    1  12 GLU H    . . 4.340 4.247 3.996 4.355 0.015  2 0 "[    .    1    .    2]" 1 
         27 1  11 LEU HA   1  11 LEU MD1  . . 4.020 2.877 2.232 4.045 0.025  2 0 "[    .    1    .    2]" 1 
         28 1  11 LEU HA   1  11 LEU MD2  . . 4.020 3.784 3.313 4.023 0.003 10 0 "[    .    1    .    2]" 1 
         29 1  11 LEU HA   1  11 LEU HG   . . 3.520 3.112 2.540 3.579 0.059  2 0 "[    .    1    .    2]" 1 
         30 1  11 LEU HA   1  12 GLU H    . . 3.230 2.222 2.146 2.637     .  0 0 "[    .    1    .    2]" 1 
         31 1  11 LEU QB   1  11 LEU QD   . . 2.800 1.861 1.774 1.912     .  0 0 "[    .    1    .    2]" 1 
         32 1  11 LEU QB   1  12 GLU H    . . 4.190 3.550 2.333 3.770     .  0 0 "[    .    1    .    2]" 1 
         33 1  11 LEU QD   1  12 GLU H    . . 4.790 2.335 1.865 3.121     .  0 0 "[    .    1    .    2]" 1 
         34 1  11 LEU QD   1  12 GLU HA   . . 3.920 3.433 2.634 3.884     .  0 0 "[    .    1    .    2]" 1 
         35 1  11 LEU QD   1  12 GLU QB   . . 4.210 4.070 3.743 4.246 0.036 10 0 "[    .    1    .    2]" 1 
         36 1  11 LEU QD   1  12 GLU QG   . . 4.780 4.226 3.078 4.771     .  0 0 "[    .    1    .    2]" 1 
         37 1  11 LEU QD   1  13 ALA H    . . 4.730 3.675 2.563 4.377     .  0 0 "[    .    1    .    2]" 1 
         38 1  11 LEU MD1  1  13 ALA MB   . . 4.300 3.304 2.797 3.900     .  0 0 "[    .    1    .    2]" 1 
         39 1  11 LEU MD2  1  13 ALA MB   . . 4.300 3.295 2.071 4.305 0.005  2 0 "[    .    1    .    2]" 1 
         40 1  11 LEU HG   1  12 GLU H    . . 4.080 2.837 2.261 3.375     .  0 0 "[    .    1    .    2]" 1 
         41 1  11 LEU HG   1  13 ALA H    . . 4.900 4.207 3.520 4.887     .  0 0 "[    .    1    .    2]" 1 
         42 1  12 GLU H    1  12 GLU HB2  . . 4.040 3.521 2.731 4.030     .  0 0 "[    .    1    .    2]" 1 
         43 1  12 GLU H    1  12 GLU QB   . . 3.230 2.774 2.435 3.232 0.002  2 0 "[    .    1    .    2]" 1 
         44 1  12 GLU H    1  12 GLU HB3  . . 4.040 2.945 2.527 3.721     .  0 0 "[    .    1    .    2]" 1 
         45 1  12 GLU H    1  12 GLU QG   . . 4.000 3.280 1.936 4.000 0.000 11 0 "[    .    1    .    2]" 1 
         46 1  12 GLU H    1  13 ALA H    . . 4.240 4.177 3.831 4.241 0.001 15 0 "[    .    1    .    2]" 1 
         47 1  12 GLU H    1  13 ALA MB   . . 4.520 4.250 3.826 4.522 0.002 10 0 "[    .    1    .    2]" 1 
         48 1  12 GLU HA   1  13 ALA H    . . 3.130 2.148 2.138 2.182     .  0 0 "[    .    1    .    2]" 1 
         49 1  12 GLU HA   1  13 ALA MB   . . 4.080 3.978 3.861 4.027     .  0 0 "[    .    1    .    2]" 1 
         50 1  12 GLU QB   1  12 GLU QG   . . 2.340 2.061 1.994 2.086     .  0 0 "[    .    1    .    2]" 1 
         51 1  12 GLU QB   1  13 ALA H    . . 3.860 3.559 3.046 3.860     .  0 0 "[    .    1    .    2]" 1 
         52 1  12 GLU HB2  1  13 ALA H    . . 4.470 3.881 3.124 4.330     .  0 0 "[    .    1    .    2]" 1 
         53 1  12 GLU HB3  1  13 ALA H    . . 4.470 4.286 3.249 4.421     .  0 0 "[    .    1    .    2]" 1 
         54 1  12 GLU QG   1  13 ALA H    . . 4.790 3.505 2.764 4.406     .  0 0 "[    .    1    .    2]" 1 
         55 1  12 GLU QG   1  13 ALA HA   . . 5.340 3.744 3.317 5.341 0.001 15 0 "[    .    1    .    2]" 1 
         56 1  13 ALA H    1  13 ALA MB   . . 3.010 2.626 2.403 2.898     .  0 0 "[    .    1    .    2]" 1 
         57 1  13 ALA HA   1  14 LEU H    . . 3.350 2.224 2.142 2.505     .  0 0 "[    .    1    .    2]" 1 
         58 1  13 ALA HA   1  14 LEU HG   . . 4.730 4.342 3.545 4.704     .  0 0 "[    .    1    .    2]" 1 
         59 1  13 ALA HA   1  15 VAL H    . . 4.700 4.083 3.625 4.557     .  0 0 "[    .    1    .    2]" 1 
         60 1  13 ALA MB   1  14 LEU H    . . 3.570 2.941 2.234 3.271     .  0 0 "[    .    1    .    2]" 1 
         61 1  13 ALA MB   1  15 VAL H    . . 4.900 3.287 2.784 4.211     .  0 0 "[    .    1    .    2]" 1 
         62 1  13 ALA MB   1  15 VAL QG   . . 4.510 3.417 2.398 4.453     .  0 0 "[    .    1    .    2]" 1 
         63 1  14 LEU H    1  14 LEU QB   . . 3.110 2.635 2.330 3.042     .  0 0 "[    .    1    .    2]" 1 
         64 1  14 LEU H    1  14 LEU MD1  . . 3.930 3.364 1.871 3.930     .  0 0 "[    .    1    .    2]" 1 
         65 1  14 LEU H    1  14 LEU QD   . . 3.420 2.523 1.852 3.206     .  0 0 "[    .    1    .    2]" 1 
         66 1  14 LEU H    1  14 LEU MD2  . . 3.930 3.075 1.855 3.916     .  0 0 "[    .    1    .    2]" 1 
         67 1  14 LEU H    1  14 LEU HG   . . 2.910 2.490 2.092 2.843     .  0 0 "[    .    1    .    2]" 1 
         68 1  14 LEU H    1  15 VAL H    . . 3.230 2.431 1.890 3.028     .  0 0 "[    .    1    .    2]" 1 
         69 1  14 LEU H    1  15 VAL QG   . . 4.570 3.684 3.215 4.473     .  0 0 "[    .    1    .    2]" 1 
         70 1  14 LEU H    1  67 LEU MD2  . . 4.710 4.535 4.174 4.713 0.003 11 0 "[    .    1    .    2]" 1 
         71 1  14 LEU HA   1  14 LEU MD1  . . 4.170 3.764 3.448 4.108     .  0 0 "[    .    1    .    2]" 1 
         72 1  14 LEU HA   1  14 LEU QD   . . 3.360 3.048 1.970 3.357     .  0 0 "[    .    1    .    2]" 1 
         73 1  14 LEU HA   1  14 LEU MD2  . . 4.170 3.408 1.975 4.095     .  0 0 "[    .    1    .    2]" 1 
         74 1  14 LEU HA   1  14 LEU HG   . . 3.990 3.340 2.528 3.726     .  0 0 "[    .    1    .    2]" 1 
         75 1  14 LEU HA   1  67 LEU MD1  . . 4.630 4.167 3.834 4.456     .  0 0 "[    .    1    .    2]" 1 
         76 1  14 LEU HA   1  67 LEU MD2  . . 3.560 3.315 2.987 3.561 0.001 12 0 "[    .    1    .    2]" 1 
         77 1  14 LEU QB   1  14 LEU QD   . . 2.780 1.813 1.738 1.918     .  0 0 "[    .    1    .    2]" 1 
         78 1  14 LEU QB   1  15 VAL H    . . 3.500 3.015 2.085 3.481     .  0 0 "[    .    1    .    2]" 1 
         79 1  14 LEU QB   1  15 VAL HA   . . 4.910 4.169 3.816 4.574     .  0 0 "[    .    1    .    2]" 1 
         80 1  14 LEU HB2  1  15 VAL H    . . 4.000 3.232 2.111 3.974     .  0 0 "[    .    1    .    2]" 1 
         81 1  14 LEU HB3  1  15 VAL H    . . 4.000 3.807 3.239 4.000 0.000 14 0 "[    .    1    .    2]" 1 
         82 1  14 LEU QD   1  15 VAL H    . . 4.730 3.065 2.421 4.002     .  0 0 "[    .    1    .    2]" 1 
         83 1  14 LEU HG   1  15 VAL H    . . 5.240 2.979 1.899 4.813     .  0 0 "[    .    1    .    2]" 1 
         84 1  15 VAL H    1  15 VAL HB   . . 3.100 2.682 2.474 2.908     .  0 0 "[    .    1    .    2]" 1 
         85 1  15 VAL H    1  15 VAL MG1  . . 4.160 2.475 1.865 3.805     .  0 0 "[    .    1    .    2]" 1 
         86 1  15 VAL H    1  15 VAL QG   . . 2.900 2.032 1.860 2.432     .  0 0 "[    .    1    .    2]" 1 
         87 1  15 VAL H    1  15 VAL MG2  . . 4.160 3.352 2.169 3.816     .  0 0 "[    .    1    .    2]" 1 
         88 1  15 VAL H    1  16 PRO HD2  . . 4.890 4.830 4.807 4.842     .  0 0 "[    .    1    .    2]" 1 
         89 1  15 VAL H    1  16 PRO HD3  . . 4.970 4.893 4.842 4.920     .  0 0 "[    .    1    .    2]" 1 
         90 1  15 VAL H    1  67 LEU MD2  . . 4.210 4.122 3.919 4.210     .  5 0 "[    .    1    .    2]" 1 
         91 1  15 VAL HA   1  15 VAL MG1  . . 3.310 2.977 2.429 3.204     .  0 0 "[    .    1    .    2]" 1 
         92 1  15 VAL HA   1  15 VAL MG2  . . 3.310 2.391 2.290 2.471     .  0 0 "[    .    1    .    2]" 1 
         93 1  15 VAL HA   1  16 PRO HD2  . . 3.100 2.158 2.106 2.180     .  0 0 "[    .    1    .    2]" 1 
         94 1  15 VAL HA   1  16 PRO HD3  . . 3.000 2.254 2.252 2.258     .  0 0 "[    .    1    .    2]" 1 
         95 1  15 VAL HA   1  16 PRO QG   . . 4.280 3.862 3.835 3.874     .  0 0 "[    .    1    .    2]" 1 
         96 1  15 VAL HA   1  67 LEU MD2  . . 4.080 3.747 3.489 3.966     .  0 0 "[    .    1    .    2]" 1 
         97 1  15 VAL HB   1  16 PRO HD2  . . 4.070 3.706 3.489 4.079 0.009 20 0 "[    .    1    .    2]" 1 
         98 1  15 VAL HB   1  16 PRO HD3  . . 4.990 4.642 4.454 4.954     .  0 0 "[    .    1    .    2]" 1 
         99 1  15 VAL QG   1  16 PRO HB2  . . 4.860 4.205 4.148 4.286     .  0 0 "[    .    1    .    2]" 1 
        100 1  15 VAL QG   1  16 PRO HD2  . . 3.340 1.826 1.801 1.908     .  0 0 "[    .    1    .    2]" 1 
        101 1  15 VAL QG   1  16 PRO HD3  . . 3.710 3.099 3.036 3.170     .  0 0 "[    .    1    .    2]" 1 
        102 1  15 VAL QG   1  16 PRO QG   . . 4.480 2.859 2.814 2.920     .  0 0 "[    .    1    .    2]" 1 
        103 1  15 VAL MG1  1  16 PRO HD2  . . 4.110 3.308 1.811 4.029     .  0 0 "[    .    1    .    2]" 1 
        104 1  15 VAL MG1  1  16 PRO HD3  . . 4.750 4.221 3.136 4.720     .  0 0 "[    .    1    .    2]" 1 
        105 1  15 VAL MG2  1  16 PRO HD2  . . 4.110 2.281 1.804 3.412     .  0 0 "[    .    1    .    2]" 1 
        106 1  15 VAL MG2  1  16 PRO HD3  . . 4.750 3.434 3.144 4.110     .  0 0 "[    .    1    .    2]" 1 
        107 1  16 PRO HA   1  17 VAL H    . . 2.800 2.538 2.498 2.631     .  0 0 "[    .    1    .    2]" 1 
        108 1  16 PRO HA   1  17 VAL MG1  . . 4.370 3.769 3.637 3.977     .  0 0 "[    .    1    .    2]" 1 
        109 1  16 PRO HA   1  17 VAL MG2  . . 4.020 3.331 3.244 3.409     .  0 0 "[    .    1    .    2]" 1 
        110 1  16 PRO HA   1  65 THR MG   . . 4.760 4.588 4.469 4.752     .  0 0 "[    .    1    .    2]" 1 
        111 1  16 PRO HA   1  66 GLY H    . . 4.380 4.279 4.118 4.374     .  0 0 "[    .    1    .    2]" 1 
        112 1  16 PRO HA   1  67 LEU H    . . 4.060 3.875 3.653 4.060     .  0 0 "[    .    1    .    2]" 1 
        113 1  16 PRO HA   1  67 LEU MD2  . . 3.450 2.173 1.984 2.412     .  0 0 "[    .    1    .    2]" 1 
        114 1  16 PRO HA   1  67 LEU HG   . . 4.900 3.628 3.343 3.985     .  0 0 "[    .    1    .    2]" 1 
        115 1  16 PRO HA   1  68 ALA H    . . 4.260 4.042 3.891 4.173     .  0 0 "[    .    1    .    2]" 1 
        116 1  16 PRO HB2  1  17 VAL H    . . 3.780 2.289 2.084 2.378     .  0 0 "[    .    1    .    2]" 1 
        117 1  16 PRO HB2  1  17 VAL HA   . . 4.420 4.071 4.050 4.105     .  0 0 "[    .    1    .    2]" 1 
        118 1  16 PRO HB2  1  17 VAL MG2  . . 5.180 4.077 3.877 4.208     .  0 0 "[    .    1    .    2]" 1 
        119 1  16 PRO HB2  1  65 THR HA   . . 5.260 4.246 4.014 4.524     .  0 0 "[    .    1    .    2]" 1 
        120 1  16 PRO HB2  1  65 THR MG   . . 3.470 2.265 2.099 2.414     .  0 0 "[    .    1    .    2]" 1 
        121 1  16 PRO HB2  1  66 GLY H    . . 4.190 2.490 2.187 2.776     .  0 0 "[    .    1    .    2]" 1 
        122 1  16 PRO HB2  1  66 GLY HA2  . . 4.520 2.608 2.234 2.921     .  0 0 "[    .    1    .    2]" 1 
        123 1  16 PRO HB2  1  66 GLY HA3  . . 4.520 3.985 3.565 4.316     .  0 0 "[    .    1    .    2]" 1 
        124 1  16 PRO HB2  1  67 LEU MD2  . . 4.490 4.236 3.955 4.486     .  0 0 "[    .    1    .    2]" 1 
        125 1  16 PRO HB3  1  17 VAL H    . . 3.660 3.300 3.213 3.339     .  0 0 "[    .    1    .    2]" 1 
        126 1  16 PRO HB3  1  65 THR MG   . . 3.770 3.589 3.359 3.761     .  0 0 "[    .    1    .    2]" 1 
        127 1  16 PRO HB3  1  66 GLY H    . . 4.170 3.702 3.471 3.927     .  0 0 "[    .    1    .    2]" 1 
        128 1  16 PRO HB3  1  66 GLY HA2  . . 4.460 2.361 2.014 2.652     .  0 0 "[    .    1    .    2]" 1 
        129 1  16 PRO HB3  1  66 GLY QA   . . 3.900 2.342 2.003 2.627     .  0 0 "[    .    1    .    2]" 1 
        130 1  16 PRO HB3  1  66 GLY HA3  . . 4.460 3.933 3.567 4.268     .  0 0 "[    .    1    .    2]" 1 
        131 1  16 PRO HB3  1  67 LEU H    . . 4.510 3.078 2.595 3.369     .  0 0 "[    .    1    .    2]" 1 
        132 1  16 PRO HB3  1  67 LEU HA   . . 5.280 3.543 3.229 3.747     .  0 0 "[    .    1    .    2]" 1 
        133 1  16 PRO HB3  1  67 LEU MD2  . . 3.410 3.090 2.775 3.390     .  0 0 "[    .    1    .    2]" 1 
        134 1  16 PRO HD2  1  17 VAL H    . . 5.500 5.468 5.373 5.504 0.004  9 0 "[    .    1    .    2]" 1 
        135 1  16 PRO HD2  1  67 LEU MD2  . . 4.690 4.392 4.044 4.654     .  0 0 "[    .    1    .    2]" 1 
        136 1  16 PRO HD3  1  17 VAL H    . . 5.500 5.456 5.389 5.483     .  0 0 "[    .    1    .    2]" 1 
        137 1  16 PRO HD3  1  67 LEU MD2  . . 4.140 3.303 2.941 3.667     .  0 0 "[    .    1    .    2]" 1 
        138 1  16 PRO HD3  1  67 LEU HG   . . 4.720 4.330 3.923 4.691     .  0 0 "[    .    1    .    2]" 1 
        139 1  16 PRO QG   1  17 VAL H    . . 4.400 3.930 3.764 4.000     .  0 0 "[    .    1    .    2]" 1 
        140 1  16 PRO QG   1  66 GLY H    . . 4.890 4.206 3.864 4.501     .  0 0 "[    .    1    .    2]" 1 
        141 1  16 PRO HG2  1  17 VAL H    . . 5.080 4.158 3.970 4.236     .  0 0 "[    .    1    .    2]" 1 
        142 1  16 PRO HG2  1  65 THR MG   . . 4.420 2.937 2.568 3.281     .  0 0 "[    .    1    .    2]" 1 
        143 1  16 PRO HG3  1  17 VAL H    . . 5.080 4.841 4.672 4.913     .  0 0 "[    .    1    .    2]" 1 
        144 1  16 PRO HG3  1  65 THR MG   . . 4.420 3.417 3.141 3.756     .  0 0 "[    .    1    .    2]" 1 
        145 1  17 VAL H    1  17 VAL HB   . . 3.930 3.813 3.753 3.859     .  0 0 "[    .    1    .    2]" 1 
        146 1  17 VAL H    1  17 VAL MG1  . . 4.230 3.369 3.264 3.515     .  0 0 "[    .    1    .    2]" 1 
        147 1  17 VAL H    1  17 VAL MG2  . . 3.260 2.009 1.923 2.095     .  0 0 "[    .    1    .    2]" 1 
        148 1  17 VAL H    1  18 THR H    . . 4.580 4.392 4.360 4.422     .  0 0 "[    .    1    .    2]" 1 
        149 1  17 VAL H    1  65 THR HA   . . 4.330 4.102 3.946 4.210     .  0 0 "[    .    1    .    2]" 1 
        150 1  17 VAL H    1  65 THR MG   . . 4.180 3.342 3.104 3.601     .  0 0 "[    .    1    .    2]" 1 
        151 1  17 VAL H    1  66 GLY H    . . 3.360 2.327 2.191 2.451     .  0 0 "[    .    1    .    2]" 1 
        152 1  17 VAL H    1  66 GLY HA2  . . 5.280 3.743 3.525 3.973     .  0 0 "[    .    1    .    2]" 1 
        153 1  17 VAL H    1  66 GLY QA   . . 4.580 3.527 3.342 3.723     .  0 0 "[    .    1    .    2]" 1 
        154 1  17 VAL H    1  66 GLY HA3  . . 5.280 4.315 4.142 4.495     .  0 0 "[    .    1    .    2]" 1 
        155 1  17 VAL H    1  67 LEU HA   . . 4.780 3.505 3.309 3.683     .  0 0 "[    .    1    .    2]" 1 
        156 1  17 VAL H    1  67 LEU MD2  . . 4.400 4.283 4.076 4.400 0.000 12 0 "[    .    1    .    2]" 1 
        157 1  17 VAL H    1  68 ALA H    . . 4.760 4.514 4.361 4.673     .  0 0 "[    .    1    .    2]" 1 
        158 1  17 VAL H    1  68 ALA HA   . . 5.500 5.413 5.285 5.501 0.001  2 0 "[    .    1    .    2]" 1 
        159 1  17 VAL H    1  71 LEU MD1  . . 4.410 3.086 2.898 3.252     .  0 0 "[    .    1    .    2]" 1 
        160 1  17 VAL H    1  71 LEU MD2  . . 4.600 3.510 3.201 3.712     .  0 0 "[    .    1    .    2]" 1 
        161 1  17 VAL HA   1  17 VAL MG1  . . 3.330 2.215 2.157 2.293     .  0 0 "[    .    1    .    2]" 1 
        162 1  17 VAL HA   1  17 VAL MG2  . . 3.510 3.163 3.141 3.178     .  0 0 "[    .    1    .    2]" 1 
        163 1  17 VAL HA   1  18 THR H    . . 2.800 2.323 2.270 2.418     .  0 0 "[    .    1    .    2]" 1 
        164 1  17 VAL HA   1  18 THR HA   . . 5.270 4.359 4.348 4.379     .  0 0 "[    .    1    .    2]" 1 
        165 1  17 VAL HA   1  18 THR HB   . . 4.830 4.764 4.661 4.830     .  0 0 "[    .    1    .    2]" 1 
        166 1  17 VAL HA   1  66 GLY H    . . 4.730 4.248 4.075 4.457     .  0 0 "[    .    1    .    2]" 1 
        167 1  17 VAL HB   1  18 THR H    . . 3.280 2.607 2.363 2.739     .  0 0 "[    .    1    .    2]" 1 
        168 1  17 VAL HB   1  18 THR HA   . . 5.340 4.515 4.392 4.621     .  0 0 "[    .    1    .    2]" 1 
        169 1  17 VAL HB   1  18 THR HB   . . 4.970 4.911 4.788 4.968     .  0 0 "[    .    1    .    2]" 1 
        170 1  17 VAL HB   1  19 ILE MG   . . 4.650 3.881 3.573 4.074     .  0 0 "[    .    1    .    2]" 1 
        171 1  17 VAL HB   1  66 GLY H    . . 5.450 5.164 5.019 5.411     .  0 0 "[    .    1    .    2]" 1 
        172 1  17 VAL HB   1  71 LEU MD1  . . 3.680 3.468 3.285 3.597     .  0 0 "[    .    1    .    2]" 1 
        173 1  17 VAL HB   1  71 LEU MD2  . . 4.890 4.757 4.559 4.882     .  0 0 "[    .    1    .    2]" 1 
        174 1  17 VAL MG1  1  18 THR H    . . 3.660 3.395 3.211 3.545     .  0 0 "[    .    1    .    2]" 1 
        175 1  17 VAL MG2  1  18 THR H    . . 4.050 3.853 3.710 3.977     .  0 0 "[    .    1    .    2]" 1 
        176 1  17 VAL MG2  1  66 GLY H    . . 4.320 3.567 3.451 3.747     .  0 0 "[    .    1    .    2]" 1 
        177 1  17 VAL MG2  1  67 LEU HA   . . 4.100 3.313 3.118 3.542     .  0 0 "[    .    1    .    2]" 1 
        178 1  17 VAL MG2  1  68 ALA H    . . 3.800 2.976 2.816 3.200     .  0 0 "[    .    1    .    2]" 1 
        179 1  17 VAL MG2  1  68 ALA HA   . . 3.860 3.175 3.073 3.321     .  0 0 "[    .    1    .    2]" 1 
        180 1  17 VAL MG2  1  68 ALA MB   . . 3.360 3.047 2.856 3.201     .  0 0 "[    .    1    .    2]" 1 
        181 1  17 VAL MG2  1  71 LEU MD2  . . 3.720 3.222 3.040 3.383     .  0 0 "[    .    1    .    2]" 1 
        182 1  17 VAL MG2  1  71 LEU HG   . . 4.450 3.590 3.447 3.784     .  0 0 "[    .    1    .    2]" 1 
        183 1  18 THR H    1  18 THR HB   . . 3.110 2.571 2.493 2.639     .  0 0 "[    .    1    .    2]" 1 
        184 1  18 THR H    1  18 THR MG   . . 4.050 3.816 3.790 3.846     .  0 0 "[    .    1    .    2]" 1 
        185 1  18 THR H    1  19 ILE H    . . 4.760 4.515 4.456 4.567     .  0 0 "[    .    1    .    2]" 1 
        186 1  18 THR H    1  65 THR HA   . . 4.950 4.370 4.166 4.638     .  0 0 "[    .    1    .    2]" 1 
        187 1  18 THR H    1  66 GLY H    . . 5.500 4.830 4.627 5.093     .  0 0 "[    .    1    .    2]" 1 
        188 1  18 THR H    1  71 LEU MD1  . . 4.680 4.558 4.258 4.679     .  0 0 "[    .    1    .    2]" 1 
        189 1  18 THR HA   1  18 THR MG   . . 3.500 2.313 2.217 2.401     .  0 0 "[    .    1    .    2]" 1 
        190 1  18 THR HA   1  19 ILE H    . . 3.000 2.187 2.145 2.256     .  0 0 "[    .    1    .    2]" 1 
        191 1  18 THR HA   1  19 ILE HA   . . 4.620 4.400 4.390 4.427     .  0 0 "[    .    1    .    2]" 1 
        192 1  18 THR HA   1  19 ILE HG12 . . 4.800 3.916 3.769 4.068     .  0 0 "[    .    1    .    2]" 1 
        193 1  18 THR HA   1  19 ILE HG13 . . 5.250 4.783 4.617 4.972     .  0 0 "[    .    1    .    2]" 1 
        194 1  18 THR HA   1  19 ILE MG   . . 4.880 3.740 3.494 3.916     .  0 0 "[    .    1    .    2]" 1 
        195 1  18 THR HA   1  64 ILE H    . . 4.390 4.228 3.990 4.349     .  0 0 "[    .    1    .    2]" 1 
        196 1  18 THR HA   1  65 THR H    . . 5.440 4.378 4.194 4.635     .  0 0 "[    .    1    .    2]" 1 
        197 1  18 THR HA   1  65 THR HA   . . 3.570 2.178 2.000 2.474     .  0 0 "[    .    1    .    2]" 1 
        198 1  18 THR HA   1  65 THR MG   . . 4.320 3.511 3.243 3.662     .  0 0 "[    .    1    .    2]" 1 
        199 1  18 THR HA   1  66 GLY H    . . 4.010 3.736 3.536 4.001     .  0 0 "[    .    1    .    2]" 1 
        200 1  18 THR HA   1  71 LEU MD1  . . 4.520 4.057 3.798 4.198     .  0 0 "[    .    1    .    2]" 1 
        201 1  18 THR HA   1  71 LEU MD2  . . 4.770 3.380 3.120 3.672     .  0 0 "[    .    1    .    2]" 1 
        202 1  18 THR HB   1  19 ILE H    . . 4.350 4.033 3.796 4.181     .  0 0 "[    .    1    .    2]" 1 
        203 1  18 THR HB   1  19 ILE HA   . . 4.820 4.729 4.568 4.820     .  0 0 "[    .    1    .    2]" 1 
        204 1  18 THR HB   1  63 ALA MB   . . 4.590 4.442 4.176 4.584     .  0 0 "[    .    1    .    2]" 1 
        205 1  18 THR MG   1  19 ILE H    . . 3.320 2.315 2.005 2.746     .  0 0 "[    .    1    .    2]" 1 
        206 1  18 THR MG   1  19 ILE HA   . . 3.890 3.739 3.588 3.874     .  0 0 "[    .    1    .    2]" 1 
        207 1  18 THR MG   1  19 ILE HB   . . 5.500 5.166 5.049 5.398     .  0 0 "[    .    1    .    2]" 1 
        208 1  18 THR MG   1  20 GLU HG2  . . 5.500 4.784 4.648 4.950     .  0 0 "[    .    1    .    2]" 1 
        209 1  18 THR MG   1  20 GLU HG3  . . 4.630 4.064 3.840 4.485     .  0 0 "[    .    1    .    2]" 1 
        210 1  18 THR MG   1  63 ALA HA   . . 4.200 3.286 3.144 3.427     .  0 0 "[    .    1    .    2]" 1 
        211 1  18 THR MG   1  63 ALA MB   . . 3.050 2.083 1.926 2.195     .  0 0 "[    .    1    .    2]" 1 
        212 1  18 THR MG   1  64 ILE H    . . 3.790 2.997 2.764 3.327     .  0 0 "[    .    1    .    2]" 1 
        213 1  19 ILE H    1  19 ILE MD   . . 4.090 3.883 3.766 3.979     .  0 0 "[    .    1    .    2]" 1 
        214 1  19 ILE H    1  19 ILE HG12 . . 3.710 2.338 2.112 2.470     .  0 0 "[    .    1    .    2]" 1 
        215 1  19 ILE H    1  19 ILE HG13 . . 4.140 2.701 2.535 2.861     .  0 0 "[    .    1    .    2]" 1 
        216 1  19 ILE H    1  19 ILE MG   . . 3.890 2.908 2.773 3.064     .  0 0 "[    .    1    .    2]" 1 
        217 1  19 ILE H    1  20 GLU H    . . 4.830 4.432 4.386 4.502     .  0 0 "[    .    1    .    2]" 1 
        218 1  19 ILE H    1  63 ALA HA   . . 4.290 4.070 3.878 4.236     .  0 0 "[    .    1    .    2]" 1 
        219 1  19 ILE H    1  64 ILE H    . . 3.580 2.610 2.470 2.802     .  0 0 "[    .    1    .    2]" 1 
        220 1  19 ILE H    1  64 ILE HA   . . 5.250 4.499 4.398 4.686     .  0 0 "[    .    1    .    2]" 1 
        221 1  19 ILE H    1  64 ILE HB   . . 4.180 3.600 3.476 3.827     .  0 0 "[    .    1    .    2]" 1 
        222 1  19 ILE H    1  65 THR HA   . . 3.960 3.613 3.521 3.786     .  0 0 "[    .    1    .    2]" 1 
        223 1  19 ILE H    1  71 LEU MD2  . . 4.230 3.402 3.155 3.622     .  0 0 "[    .    1    .    2]" 1 
        224 1  19 ILE HA   1  19 ILE MD   . . 4.360 4.151 4.125 4.173     .  0 0 "[    .    1    .    2]" 1 
        225 1  19 ILE HA   1  19 ILE MG   . . 3.280 2.274 2.178 2.401     .  0 0 "[    .    1    .    2]" 1 
        226 1  19 ILE HA   1  20 GLU H    . . 3.050 2.592 2.464 2.649     .  0 0 "[    .    1    .    2]" 1 
        227 1  19 ILE HA   1  64 ILE H    . . 4.890 4.655 4.562 4.751     .  0 0 "[    .    1    .    2]" 1 
        228 1  19 ILE HB   1  19 ILE MD   . . 3.110 2.303 2.164 2.416     .  0 0 "[    .    1    .    2]" 1 
        229 1  19 ILE HB   1  20 GLU H    . . 2.960 2.012 1.901 2.275     .  0 0 "[    .    1    .    2]" 1 
        230 1  19 ILE HB   1  64 ILE H    . . 5.070 4.638 4.484 4.758     .  0 0 "[    .    1    .    2]" 1 
        231 1  19 ILE MD   1  19 ILE MG   . . 2.930 2.225 1.985 2.414     .  0 0 "[    .    1    .    2]" 1 
        232 1  19 ILE MD   1  20 GLU H    . . 4.430 3.574 3.319 3.845     .  0 0 "[    .    1    .    2]" 1 
        233 1  19 ILE MD   1  64 ILE H    . . 4.480 3.799 3.577 4.002     .  0 0 "[    .    1    .    2]" 1 
        234 1  19 ILE MD   1  64 ILE HB   . . 3.380 2.216 1.999 2.413     .  0 0 "[    .    1    .    2]" 1 
        235 1  19 ILE MD   1  64 ILE MD   . . 3.480 2.168 1.937 2.402     .  0 0 "[    .    1    .    2]" 1 
        236 1  19 ILE MD   1  71 LEU HA   . . 4.740 3.228 2.947 3.629     .  0 0 "[    .    1    .    2]" 1 
        237 1  19 ILE MD   1  72 ASP HA   . . 4.710 4.624 4.394 4.707     .  0 0 "[    .    1    .    2]" 1 
        238 1  19 ILE MD   1  75 LYS H    . . 4.020 3.676 3.388 3.851     .  0 0 "[    .    1    .    2]" 1 
        239 1  19 ILE MD   1  75 LYS HA   . . 4.600 3.606 3.316 3.838     .  0 0 "[    .    1    .    2]" 1 
        240 1  19 ILE MD   1  75 LYS HB2  . . 3.310 2.281 2.113 2.398     .  0 0 "[    .    1    .    2]" 1 
        241 1  19 ILE MD   1  75 LYS HB3  . . 3.930 3.550 3.415 3.682     .  0 0 "[    .    1    .    2]" 1 
        242 1  19 ILE MD   1  75 LYS QD   . . 3.320 2.210 1.886 2.467     .  0 0 "[    .    1    .    2]" 1 
        243 1  19 ILE MD   1  75 LYS QE   . . 4.040 3.651 3.016 4.008     .  0 0 "[    .    1    .    2]" 1 
        244 1  19 ILE MD   1  75 LYS QG   . . 3.480 2.658 2.243 3.005     .  0 0 "[    .    1    .    2]" 1 
        245 1  19 ILE HG12 1  19 ILE MG   . . 3.600 2.190 2.080 2.321     .  0 0 "[    .    1    .    2]" 1 
        246 1  19 ILE HG12 1  20 GLU H    . . 4.620 4.462 4.355 4.614     .  0 0 "[    .    1    .    2]" 1 
        247 1  19 ILE HG12 1  64 ILE H    . . 4.950 3.171 2.969 3.435     .  0 0 "[    .    1    .    2]" 1 
        248 1  19 ILE HG12 1  64 ILE HB   . . 3.790 2.184 2.018 2.390     .  0 0 "[    .    1    .    2]" 1 
        249 1  19 ILE HG12 1  64 ILE MD   . . 3.950 3.824 3.651 3.950 0.000  2 0 "[    .    1    .    2]" 1 
        250 1  19 ILE HG12 1  64 ILE MG   . . 3.630 3.384 3.243 3.563     .  0 0 "[    .    1    .    2]" 1 
        251 1  19 ILE HG12 1  71 LEU MD1  . . 3.920 3.501 3.323 3.711     .  0 0 "[    .    1    .    2]" 1 
        252 1  19 ILE HG12 1  71 LEU MD2  . . 3.990 2.251 2.088 2.461     .  0 0 "[    .    1    .    2]" 1 
        253 1  19 ILE HG13 1  19 ILE MG   . . 3.410 3.171 3.148 3.200     .  0 0 "[    .    1    .    2]" 1 
        254 1  19 ILE HG13 1  20 GLU H    . . 4.760 3.351 3.212 3.476     .  0 0 "[    .    1    .    2]" 1 
        255 1  19 ILE HG13 1  21 VAL MG2  . . 4.080 2.954 2.752 3.224     .  0 0 "[    .    1    .    2]" 1 
        256 1  19 ILE HG13 1  64 ILE HB   . . 3.870 2.325 2.176 2.437     .  0 0 "[    .    1    .    2]" 1 
        257 1  19 ILE HG13 1  64 ILE MD   . . 3.580 3.375 3.168 3.545     .  0 0 "[    .    1    .    2]" 1 
        258 1  19 ILE HG13 1  64 ILE MG   . . 4.060 3.982 3.869 4.061 0.001  2 0 "[    .    1    .    2]" 1 
        259 1  19 ILE HG13 1  71 LEU HB3  . . 4.670 4.558 4.381 4.667     .  0 0 "[    .    1    .    2]" 1 
        260 1  19 ILE HG13 1  71 LEU MD2  . . 4.260 3.719 3.529 3.890     .  0 0 "[    .    1    .    2]" 1 
        261 1  19 ILE HG13 1  75 LYS HB2  . . 5.050 4.820 4.562 5.003     .  0 0 "[    .    1    .    2]" 1 
        262 1  19 ILE HG13 1  75 LYS QD   . . 4.790 4.531 4.263 4.755     .  0 0 "[    .    1    .    2]" 1 
        263 1  19 ILE MG   1  20 GLU H    . . 3.760 3.535 3.453 3.703     .  0 0 "[    .    1    .    2]" 1 
        264 1  19 ILE MG   1  64 ILE HB   . . 4.180 4.035 3.878 4.170     .  0 0 "[    .    1    .    2]" 1 
        265 1  19 ILE MG   1  71 LEU HB3  . . 4.330 2.445 2.052 2.749     .  0 0 "[    .    1    .    2]" 1 
        266 1  19 ILE MG   1  71 LEU MD2  . . 3.340 2.446 2.074 2.641     .  0 0 "[    .    1    .    2]" 1 
        267 1  19 ILE MG   1  71 LEU HG   . . 4.230 3.980 3.727 4.206     .  0 0 "[    .    1    .    2]" 1 
        268 1  19 ILE MG   1  75 LYS HB2  . . 5.310 4.655 4.277 4.875     .  0 0 "[    .    1    .    2]" 1 
        269 1  20 GLU H    1  20 GLU HB2  . . 3.830 2.545 2.437 2.640     .  0 0 "[    .    1    .    2]" 1 
        270 1  20 GLU H    1  20 GLU HB3  . . 4.020 3.655 3.603 3.703     .  0 0 "[    .    1    .    2]" 1 
        271 1  20 GLU H    1  20 GLU HG2  . . 4.580 4.428 4.254 4.578     .  0 0 "[    .    1    .    2]" 1 
        272 1  20 GLU H    1  20 GLU HG3  . . 3.870 3.585 3.263 3.757     .  0 0 "[    .    1    .    2]" 1 
        273 1  20 GLU H    1  21 VAL H    . . 4.630 4.301 4.236 4.413     .  0 0 "[    .    1    .    2]" 1 
        274 1  20 GLU H    1  21 VAL MG2  . . 4.850 3.812 3.627 4.047     .  0 0 "[    .    1    .    2]" 1 
        275 1  20 GLU H    1  63 ALA HA   . . 5.090 4.925 4.745 5.030     .  0 0 "[    .    1    .    2]" 1 
        276 1  20 GLU H    1  75 LYS QD   . . 4.950 4.720 4.541 4.885     .  0 0 "[    .    1    .    2]" 1 
        277 1  20 GLU HA   1  20 GLU HG2  . . 4.050 2.411 2.326 2.575     .  0 0 "[    .    1    .    2]" 1 
        278 1  20 GLU HA   1  20 GLU HG3  . . 4.190 2.806 2.609 2.916     .  0 0 "[    .    1    .    2]" 1 
        279 1  20 GLU HA   1  21 VAL H    . . 3.010 2.155 2.141 2.186     .  0 0 "[    .    1    .    2]" 1 
        280 1  20 GLU HA   1  21 VAL HA   . . 4.760 4.398 4.393 4.412     .  0 0 "[    .    1    .    2]" 1 
        281 1  20 GLU HA   1  21 VAL HB   . . 4.950 4.830 4.691 4.944     .  0 0 "[    .    1    .    2]" 1 
        282 1  20 GLU HA   1  21 VAL MG2  . . 4.420 3.433 3.277 3.547     .  0 0 "[    .    1    .    2]" 1 
        283 1  20 GLU HA   1  61 ILE HB   . . 5.500 5.348 5.053 5.499     .  0 0 "[    .    1    .    2]" 1 
        284 1  20 GLU HA   1  61 ILE MG   . . 3.870 3.009 2.887 3.155     .  0 0 "[    .    1    .    2]" 1 
        285 1  20 GLU HA   1  62 ILE H    . . 4.890 4.730 4.571 4.853     .  0 0 "[    .    1    .    2]" 1 
        286 1  20 GLU HA   1  63 ALA HA   . . 3.710 2.783 2.545 2.892     .  0 0 "[    .    1    .    2]" 1 
        287 1  20 GLU HA   1  63 ALA MB   . . 4.330 3.923 3.744 4.074     .  0 0 "[    .    1    .    2]" 1 
        288 1  20 GLU HA   1  64 ILE H    . . 4.150 3.844 3.670 4.019     .  0 0 "[    .    1    .    2]" 1 
        289 1  20 GLU HB2  1  21 VAL H    . . 4.410 4.365 4.206 4.409     .  0 0 "[    .    1    .    2]" 1 
        290 1  20 GLU HB2  1  21 VAL HA   . . 5.500 5.143 4.949 5.203     .  0 0 "[    .    1    .    2]" 1 
        291 1  20 GLU HB2  1  61 ILE MG   . . 3.800 3.606 3.472 3.739     .  0 0 "[    .    1    .    2]" 1 
        292 1  20 GLU HB3  1  21 VAL H    . . 4.810 3.340 3.109 3.446     .  0 0 "[    .    1    .    2]" 1 
        293 1  20 GLU HB3  1  21 VAL HA   . . 4.450 4.379 4.317 4.443     .  0 0 "[    .    1    .    2]" 1 
        294 1  20 GLU HB3  1  61 ILE MG   . . 3.400 2.268 2.130 2.412     .  0 0 "[    .    1    .    2]" 1 
        295 1  20 GLU HG2  1  21 VAL H    . . 4.820 3.871 3.747 4.077     .  0 0 "[    .    1    .    2]" 1 
        296 1  20 GLU HG2  1  61 ILE HB   . . 4.410 3.985 3.740 4.300     .  0 0 "[    .    1    .    2]" 1 
        297 1  20 GLU HG2  1  61 ILE MG   . . 3.590 2.156 1.975 2.291     .  0 0 "[    .    1    .    2]" 1 
        298 1  20 GLU HG2  1  63 ALA HA   . . 4.340 3.920 3.596 4.233     .  0 0 "[    .    1    .    2]" 1 
        299 1  20 GLU HG2  1  63 ALA MB   . . 4.390 3.830 3.456 4.136     .  0 0 "[    .    1    .    2]" 1 
        300 1  20 GLU HG3  1  21 VAL H    . . 5.040 4.800 4.567 4.954     .  0 0 "[    .    1    .    2]" 1 
        301 1  20 GLU HG3  1  61 ILE MG   . . 3.740 3.627 3.470 3.739     .  0 0 "[    .    1    .    2]" 1 
        302 1  20 GLU HG3  1  63 ALA HA   . . 5.090 4.281 3.848 4.672     .  0 0 "[    .    1    .    2]" 1 
        303 1  20 GLU HG3  1  63 ALA MB   . . 4.620 4.120 3.622 4.479     .  0 0 "[    .    1    .    2]" 1 
        304 1  21 VAL H    1  21 VAL HB   . . 3.290 2.833 2.738 2.952     .  0 0 "[    .    1    .    2]" 1 
        305 1  21 VAL H    1  21 VAL MG1  . . 4.380 3.912 3.884 3.936     .  0 0 "[    .    1    .    2]" 1 
        306 1  21 VAL H    1  21 VAL MG2  . . 3.560 2.559 2.431 2.805     .  0 0 "[    .    1    .    2]" 1 
        307 1  21 VAL H    1  22 GLU H    . . 4.690 4.382 4.169 4.483     .  0 0 "[    .    1    .    2]" 1 
        308 1  21 VAL H    1  61 ILE HA   . . 4.610 4.118 3.833 4.269     .  0 0 "[    .    1    .    2]" 1 
        309 1  21 VAL H    1  61 ILE MD   . . 5.020 4.833 4.616 4.931     .  0 0 "[    .    1    .    2]" 1 
        310 1  21 VAL H    1  61 ILE MG   . . 3.650 2.771 2.628 2.925     .  0 0 "[    .    1    .    2]" 1 
        311 1  21 VAL H    1  62 ILE H    . . 3.750 3.055 2.904 3.185     .  0 0 "[    .    1    .    2]" 1 
        312 1  21 VAL H    1  62 ILE HB   . . 4.350 3.681 3.590 3.770     .  0 0 "[    .    1    .    2]" 1 
        313 1  21 VAL H    1  63 ALA HA   . . 3.910 3.729 3.607 3.862     .  0 0 "[    .    1    .    2]" 1 
        314 1  21 VAL H    1  63 ALA MB   . . 5.260 4.896 4.810 5.005     .  0 0 "[    .    1    .    2]" 1 
        315 1  21 VAL H    1  64 ILE H    . . 5.130 4.695 4.473 4.965     .  0 0 "[    .    1    .    2]" 1 
        316 1  21 VAL H    1  64 ILE MD   . . 4.880 4.659 4.484 4.813     .  0 0 "[    .    1    .    2]" 1 
        317 1  21 VAL H    1  64 ILE HG13 . . 5.500 4.404 4.133 4.797     .  0 0 "[    .    1    .    2]" 1 
        318 1  21 VAL HA   1  21 VAL MG1  . . 3.330 2.223 2.102 2.372     .  0 0 "[    .    1    .    2]" 1 
        319 1  21 VAL HA   1  21 VAL MG2  . . 3.390 2.494 2.393 2.581     .  0 0 "[    .    1    .    2]" 1 
        320 1  21 VAL HA   1  22 GLU H    . . 2.780 2.178 2.142 2.272     .  0 0 "[    .    1    .    2]" 1 
        321 1  21 VAL HA   1  22 GLU HA   . . 4.600 4.359 4.346 4.396     .  0 0 "[    .    1    .    2]" 1 
        322 1  21 VAL HA   1  22 GLU QB   . . 5.500 4.289 4.186 4.350     .  0 0 "[    .    1    .    2]" 1 
        323 1  21 VAL HA   1  22 GLU HG3  . . 5.220 4.178 4.003 4.453     .  0 0 "[    .    1    .    2]" 1 
        324 1  21 VAL HA   1  23 VAL MG2  . . 4.750 4.433 4.256 4.594     .  0 0 "[    .    1    .    2]" 1 
        325 1  21 VAL HA   1  61 ILE MD   . . 5.260 5.225 5.094 5.263 0.003 14 0 "[    .    1    .    2]" 1 
        326 1  21 VAL HA   1  61 ILE MG   . . 4.700 4.083 3.825 4.240     .  0 0 "[    .    1    .    2]" 1 
        327 1  21 VAL HA   1  75 LYS QE   . . 4.190 3.340 2.673 4.091     .  0 0 "[    .    1    .    2]" 1 
        328 1  21 VAL HA   1  75 LYS QG   . . 4.800 3.950 3.528 4.134     .  0 0 "[    .    1    .    2]" 1 
        329 1  21 VAL HA   1  79 LEU MD2  . . 4.920 3.783 3.528 4.130     .  0 0 "[    .    1    .    2]" 1 
        330 1  21 VAL HA   1  79 LEU HG   . . 5.400 5.167 4.956 5.400     .  0 0 "[    .    1    .    2]" 1 
        331 1  21 VAL HB   1  22 GLU H    . . 4.490 3.927 3.640 4.232     .  0 0 "[    .    1    .    2]" 1 
        332 1  21 VAL HB   1  23 VAL MG2  . . 3.050 2.842 2.610 3.043     .  0 0 "[    .    1    .    2]" 1 
        333 1  21 VAL HB   1  62 ILE H    . . 4.300 3.339 3.192 3.511     .  0 0 "[    .    1    .    2]" 1 
        334 1  21 VAL HB   1  62 ILE HB   . . 3.950 2.527 2.308 2.706     .  0 0 "[    .    1    .    2]" 1 
        335 1  21 VAL HB   1  62 ILE MD   . . 5.340 3.895 3.640 4.089     .  0 0 "[    .    1    .    2]" 1 
        336 1  21 VAL HB   1  62 ILE HG13 . . 4.920 4.710 4.483 4.835     .  0 0 "[    .    1    .    2]" 1 
        337 1  21 VAL HB   1  62 ILE MG   . . 4.170 3.420 3.186 3.644     .  0 0 "[    .    1    .    2]" 1 
        338 1  21 VAL HB   1  64 ILE MD   . . 3.870 3.446 3.167 3.710     .  0 0 "[    .    1    .    2]" 1 
        339 1  21 VAL HB   1  78 LEU MD2  . . 3.520 2.568 2.224 2.852     .  0 0 "[    .    1    .    2]" 1 
        340 1  21 VAL MG1  1  22 GLU H    . . 3.520 2.503 2.045 2.827     .  0 0 "[    .    1    .    2]" 1 
        341 1  21 VAL MG1  1  22 GLU QB   . . 4.370 3.825 3.580 3.965     .  0 0 "[    .    1    .    2]" 1 
        342 1  21 VAL MG1  1  75 LYS HA   . . 4.550 3.567 3.408 3.926     .  0 0 "[    .    1    .    2]" 1 
        343 1  21 VAL MG1  1  75 LYS HB2  . . 5.500 4.588 4.288 4.960     .  0 0 "[    .    1    .    2]" 1 
        344 1  21 VAL MG1  1  75 LYS HG2  . . 3.810 3.165 2.806 3.537     .  0 0 "[    .    1    .    2]" 1 
        345 1  21 VAL MG1  1  75 LYS HG3  . . 3.810 2.662 2.295 3.008     .  0 0 "[    .    1    .    2]" 1 
        346 1  21 VAL MG1  1  78 LEU HB2  . . 3.930 3.891 3.751 3.931 0.001  2 0 "[    .    1    .    2]" 1 
        347 1  21 VAL MG1  1  78 LEU QB   . . 3.270 2.573 2.446 2.749     .  0 0 "[    .    1    .    2]" 1 
        348 1  21 VAL MG1  1  78 LEU HB3  . . 3.930 2.611 2.478 2.807     .  0 0 "[    .    1    .    2]" 1 
        349 1  21 VAL MG1  1  78 LEU HG   . . 3.950 3.413 3.042 3.796     .  0 0 "[    .    1    .    2]" 1 
        350 1  21 VAL MG1  1  79 LEU H    . . 3.950 3.465 3.284 3.671     .  0 0 "[    .    1    .    2]" 1 
        351 1  21 VAL MG1  1  79 LEU HA   . . 4.020 3.588 3.358 3.868     .  0 0 "[    .    1    .    2]" 1 
        352 1  21 VAL MG1  1  79 LEU HG   . . 3.550 2.621 2.378 2.790     .  0 0 "[    .    1    .    2]" 1 
        353 1  21 VAL MG2  1  22 GLU H    . . 4.220 4.175 4.060 4.221 0.001  4 0 "[    .    1    .    2]" 1 
        354 1  21 VAL MG2  1  62 ILE H    . . 5.060 4.295 4.042 4.484     .  0 0 "[    .    1    .    2]" 1 
        355 1  21 VAL MG2  1  62 ILE MG   . . 3.530 2.985 2.700 3.190     .  0 0 "[    .    1    .    2]" 1 
        356 1  21 VAL MG2  1  63 ALA HA   . . 4.360 3.971 3.833 4.160     .  0 0 "[    .    1    .    2]" 1 
        357 1  21 VAL MG2  1  64 ILE H    . . 4.910 3.653 3.421 3.836     .  0 0 "[    .    1    .    2]" 1 
        358 1  21 VAL MG2  1  64 ILE MD   . . 3.410 1.836 1.746 1.984     .  0 0 "[    .    1    .    2]" 1 
        359 1  21 VAL MG2  1  64 ILE HG13 . . 3.730 2.251 1.974 2.511     .  0 0 "[    .    1    .    2]" 1 
        360 1  21 VAL MG2  1  75 LYS HA   . . 3.810 3.061 2.833 3.238     .  0 0 "[    .    1    .    2]" 1 
        361 1  21 VAL MG2  1  75 LYS HB2  . . 3.860 3.505 3.254 3.720     .  0 0 "[    .    1    .    2]" 1 
        362 1  21 VAL MG2  1  75 LYS QD   . . 4.060 3.280 3.043 3.792     .  0 0 "[    .    1    .    2]" 1 
        363 1  21 VAL MG2  1  75 LYS QE   . . 4.170 3.255 2.407 3.797     .  0 0 "[    .    1    .    2]" 1 
        364 1  21 VAL MG2  1  75 LYS HG2  . . 3.770 3.502 3.236 3.698     .  0 0 "[    .    1    .    2]" 1 
        365 1  21 VAL MG2  1  75 LYS HG3  . . 3.770 2.132 1.949 2.337     .  0 0 "[    .    1    .    2]" 1 
        366 1  22 GLU H    1  22 GLU QB   . . 3.040 2.278 2.177 2.332     .  0 0 "[    .    1    .    2]" 1 
        367 1  22 GLU H    1  22 GLU HG2  . . 4.830 4.060 3.925 4.239     .  0 0 "[    .    1    .    2]" 1 
        368 1  22 GLU H    1  22 GLU HG3  . . 4.360 2.772 2.574 3.101     .  0 0 "[    .    1    .    2]" 1 
        369 1  22 GLU H    1  23 VAL H    . . 4.550 4.361 4.201 4.444     .  0 0 "[    .    1    .    2]" 1 
        370 1  22 GLU H    1  23 VAL MG2  . . 4.910 3.845 3.654 3.967     .  0 0 "[    .    1    .    2]" 1 
        371 1  22 GLU H    1  61 ILE MD   . . 5.020 4.510 4.249 4.731     .  0 0 "[    .    1    .    2]" 1 
        372 1  22 GLU H    1  61 ILE MG   . . 4.860 4.245 3.820 4.570     .  0 0 "[    .    1    .    2]" 1 
        373 1  22 GLU H    1  79 LEU MD2  . . 3.480 3.239 2.956 3.467     .  0 0 "[    .    1    .    2]" 1 
        374 1  22 GLU HA   1  23 VAL H    . . 2.950 2.153 2.139 2.201     .  0 0 "[    .    1    .    2]" 1 
        375 1  22 GLU HA   1  23 VAL HA   . . 4.700 4.378 4.369 4.389     .  0 0 "[    .    1    .    2]" 1 
        376 1  22 GLU HA   1  23 VAL MG2  . . 4.400 3.938 3.770 4.050     .  0 0 "[    .    1    .    2]" 1 
        377 1  22 GLU HA   1  61 ILE HA   . . 4.650 3.000 2.789 3.130     .  0 0 "[    .    1    .    2]" 1 
        378 1  22 GLU HA   1  61 ILE MD   . . 3.850 2.549 2.290 2.690     .  0 0 "[    .    1    .    2]" 1 
        379 1  22 GLU HA   1  61 ILE MG   . . 4.080 3.259 2.859 3.521     .  0 0 "[    .    1    .    2]" 1 
        380 1  22 GLU HA   1  62 ILE H    . . 4.110 4.056 3.946 4.114 0.004 10 0 "[    .    1    .    2]" 1 
        381 1  22 GLU QB   1  23 VAL H    . . 3.910 3.523 3.384 3.702     .  0 0 "[    .    1    .    2]" 1 
        382 1  22 GLU QB   1  23 VAL HA   . . 5.070 4.100 4.062 4.172     .  0 0 "[    .    1    .    2]" 1 
        383 1  22 GLU QB   1  61 ILE MD   . . 4.410 3.794 3.560 4.074     .  0 0 "[    .    1    .    2]" 1 
        384 1  22 GLU HG2  1  23 VAL H    . . 4.650 4.543 4.333 4.633     .  0 0 "[    .    1    .    2]" 1 
        385 1  22 GLU HG2  1  61 ILE MD   . . 3.990 2.872 2.633 3.056     .  0 0 "[    .    1    .    2]" 1 
        386 1  22 GLU HG3  1  23 VAL H    . . 4.780 4.736 4.665 4.782 0.002  2 0 "[    .    1    .    2]" 1 
        387 1  22 GLU HG3  1  61 ILE MD   . . 3.990 3.049 2.765 3.225     .  0 0 "[    .    1    .    2]" 1 
        388 1  22 GLU HG3  1  79 LEU MD2  . . 5.290 5.192 4.898 5.294 0.004  1 0 "[    .    1    .    2]" 1 
        389 1  23 VAL H    1  23 VAL HB   . . 3.770 2.868 2.730 2.952     .  0 0 "[    .    1    .    2]" 1 
        390 1  23 VAL H    1  23 VAL MG1  . . 4.360 3.906 3.873 3.951     .  0 0 "[    .    1    .    2]" 1 
        391 1  23 VAL H    1  23 VAL MG2  . . 3.850 3.149 2.950 3.268     .  0 0 "[    .    1    .    2]" 1 
        392 1  23 VAL H    1  24 PRO HA   . . 4.910 4.786 4.670 4.902     .  0 0 "[    .    1    .    2]" 1 
        393 1  23 VAL H    1  24 PRO HD2  . . 5.150 4.730 4.663 4.783     .  0 0 "[    .    1    .    2]" 1 
        394 1  23 VAL H    1  24 PRO HD3  . . 5.150 4.476 4.314 4.637     .  0 0 "[    .    1    .    2]" 1 
        395 1  23 VAL H    1  60 ASP HA   . . 4.680 4.332 4.132 4.517     .  0 0 "[    .    1    .    2]" 1 
        396 1  23 VAL H    1  60 ASP HB2  . . 4.580 4.248 2.995 4.574     .  0 0 "[    .    1    .    2]" 1 
        397 1  23 VAL H    1  60 ASP QB   . . 3.890 3.499 2.958 3.730     .  0 0 "[    .    1    .    2]" 1 
        398 1  23 VAL H    1  60 ASP HB3  . . 4.580 3.849 3.488 4.589 0.009  2 0 "[    .    1    .    2]" 1 
        399 1  23 VAL H    1  61 ILE H    . . 4.990 4.782 4.625 4.944     .  0 0 "[    .    1    .    2]" 1 
        400 1  23 VAL H    1  61 ILE HA   . . 3.830 2.895 2.662 3.193     .  0 0 "[    .    1    .    2]" 1 
        401 1  23 VAL H    1  61 ILE MD   . . 4.140 3.295 3.075 3.512     .  0 0 "[    .    1    .    2]" 1 
        402 1  23 VAL H    1  61 ILE MG   . . 4.470 4.192 3.858 4.474 0.004  2 0 "[    .    1    .    2]" 1 
        403 1  23 VAL H    1  62 ILE H    . . 4.290 3.589 3.254 3.821     .  0 0 "[    .    1    .    2]" 1 
        404 1  23 VAL H    1  62 ILE HB   . . 5.470 4.987 4.519 5.237     .  0 0 "[    .    1    .    2]" 1 
        405 1  23 VAL H    1  62 ILE MD   . . 4.860 4.737 4.478 4.857     .  0 0 "[    .    1    .    2]" 1 
        406 1  23 VAL HA   1  23 VAL MG1  . . 3.420 2.429 2.356 2.478     .  0 0 "[    .    1    .    2]" 1 
        407 1  23 VAL HA   1  23 VAL MG2  . . 3.440 2.270 2.211 2.338     .  0 0 "[    .    1    .    2]" 1 
        408 1  23 VAL HA   1  24 PRO HA   . . 4.820 4.432 4.412 4.448     .  0 0 "[    .    1    .    2]" 1 
        409 1  23 VAL HA   1  24 PRO HD2  . . 3.360 2.075 2.015 2.176     .  0 0 "[    .    1    .    2]" 1 
        410 1  23 VAL HA   1  24 PRO HD3  . . 3.360 2.270 2.253 2.293     .  0 0 "[    .    1    .    2]" 1 
        411 1  23 VAL HA   1  24 PRO QG   . . 3.850 3.821 3.794 3.871 0.021  2 0 "[    .    1    .    2]" 1 
        412 1  23 VAL HA   1  27 LEU MD1  . . 4.930 3.957 3.672 4.285     .  0 0 "[    .    1    .    2]" 1 
        413 1  23 VAL HA   1  82 VAL MG2  . . 4.360 2.985 2.524 3.532     .  0 0 "[    .    1    .    2]" 1 
        414 1  23 VAL HB   1  24 PRO QD   . . 4.970 3.959 3.790 4.037     .  0 0 "[    .    1    .    2]" 1 
        415 1  23 VAL HB   1  28 HIS HD2  . . 4.040 3.869 3.669 4.040 0.000  8 0 "[    .    1    .    2]" 1 
        416 1  23 VAL HB   1  62 ILE H    . . 4.750 3.612 3.412 3.800     .  0 0 "[    .    1    .    2]" 1 
        417 1  23 VAL HB   1  62 ILE HB   . . 5.150 3.553 3.347 3.751     .  0 0 "[    .    1    .    2]" 1 
        418 1  23 VAL HB   1  62 ILE MD   . . 3.620 2.327 2.101 2.611     .  0 0 "[    .    1    .    2]" 1 
        419 1  23 VAL HB   1  62 ILE HG12 . . 4.670 4.337 4.002 4.534     .  0 0 "[    .    1    .    2]" 1 
        420 1  23 VAL HB   1  62 ILE HG13 . . 4.280 2.778 2.406 3.021     .  0 0 "[    .    1    .    2]" 1 
        421 1  23 VAL HB   1  78 LEU MD2  . . 4.860 3.759 3.615 4.169     .  0 0 "[    .    1    .    2]" 1 
        422 1  23 VAL HB   1  82 VAL MG2  . . 4.490 3.886 3.697 4.123     .  0 0 "[    .    1    .    2]" 1 
        423 1  23 VAL MG1  1  24 PRO HA   . . 4.950 4.026 3.927 4.162     .  0 0 "[    .    1    .    2]" 1 
        424 1  23 VAL MG1  1  24 PRO HB3  . . 5.190 4.677 4.520 4.859     .  0 0 "[    .    1    .    2]" 1 
        425 1  23 VAL MG1  1  24 PRO HD2  . . 3.900 1.946 1.829 2.000     .  0 0 "[    .    1    .    2]" 1 
        426 1  23 VAL MG1  1  24 PRO QD   . . 3.190 1.933 1.818 1.986     .  0 0 "[    .    1    .    2]" 1 
        427 1  23 VAL MG1  1  24 PRO HD3  . . 3.900 3.311 3.165 3.404     .  0 0 "[    .    1    .    2]" 1 
        428 1  23 VAL MG1  1  24 PRO QG   . . 3.920 3.031 2.870 3.196     .  0 0 "[    .    1    .    2]" 1 
        429 1  23 VAL MG1  1  27 LEU HB2  . . 3.010 2.599 2.530 2.704     .  0 0 "[    .    1    .    2]" 1 
        430 1  23 VAL MG1  1  27 LEU HB3  . . 3.770 3.478 3.283 3.643     .  0 0 "[    .    1    .    2]" 1 
        431 1  23 VAL MG1  1  27 LEU HG   . . 4.280 4.180 4.013 4.261     .  0 0 "[    .    1    .    2]" 1 
        432 1  23 VAL MG1  1  28 HIS H    . . 3.740 3.658 3.533 3.743 0.003  2 0 "[    .    1    .    2]" 1 
        433 1  23 VAL MG1  1  28 HIS HA   . . 4.370 3.881 3.678 4.085     .  0 0 "[    .    1    .    2]" 1 
        434 1  23 VAL MG1  1  28 HIS HD2  . . 3.370 2.110 1.968 2.394     .  0 0 "[    .    1    .    2]" 1 
        435 1  23 VAL MG1  1  62 ILE HB   . . 4.690 4.563 4.414 4.691 0.001  1 0 "[    .    1    .    2]" 1 
        436 1  23 VAL MG1  1  62 ILE MD   . . 3.310 2.228 2.048 2.395     .  0 0 "[    .    1    .    2]" 1 
        437 1  23 VAL MG1  1  62 ILE HG13 . . 4.100 3.615 3.310 4.011     .  0 0 "[    .    1    .    2]" 1 
        438 1  23 VAL MG2  1  24 PRO HD2  . . 4.280 3.374 3.215 3.517     .  0 0 "[    .    1    .    2]" 1 
        439 1  23 VAL MG2  1  24 PRO QD   . . 3.710 3.225 3.094 3.348     .  0 0 "[    .    1    .    2]" 1 
        440 1  23 VAL MG2  1  24 PRO HD3  . . 4.280 4.098 4.004 4.203     .  0 0 "[    .    1    .    2]" 1 
        441 1  23 VAL MG2  1  61 ILE HA   . . 4.930 4.666 4.418 4.831     .  0 0 "[    .    1    .    2]" 1 
        442 1  23 VAL MG2  1  62 ILE H    . . 4.090 3.801 3.529 4.043     .  0 0 "[    .    1    .    2]" 1 
        443 1  23 VAL MG2  1  62 ILE HB   . . 3.520 3.322 3.013 3.521 0.001  8 0 "[    .    1    .    2]" 1 
        444 1  23 VAL MG2  1  62 ILE MD   . . 3.010 2.636 2.291 2.901     .  0 0 "[    .    1    .    2]" 1 
        445 1  23 VAL MG2  1  62 ILE HG13 . . 4.000 3.874 3.538 4.005 0.005  5 0 "[    .    1    .    2]" 1 
        446 1  23 VAL MG2  1  82 VAL HB   . . 3.940 3.631 3.357 3.829     .  0 0 "[    .    1    .    2]" 1 
        447 1  24 PRO HA   1  25 PHE H    . . 3.010 2.166 2.151 2.185     .  0 0 "[    .    1    .    2]" 1 
        448 1  24 PRO HA   1  25 PHE HA   . . 5.160 4.361 4.347 4.385     .  0 0 "[    .    1    .    2]" 1 
        449 1  24 PRO HA   1  25 PHE HB2  . . 4.970 4.474 4.404 4.542     .  0 0 "[    .    1    .    2]" 1 
        450 1  24 PRO HA   1  25 PHE QB   . . 4.340 4.101 4.090 4.115     .  0 0 "[    .    1    .    2]" 1 
        451 1  24 PRO HA   1  25 PHE HB3  . . 4.970 4.767 4.667 4.852     .  0 0 "[    .    1    .    2]" 1 
        452 1  24 PRO HA   1  26 ASP H    . . 4.450 3.695 3.555 3.876     .  0 0 "[    .    1    .    2]" 1 
        453 1  24 PRO HA   1  60 ASP HA   . . 4.260 3.546 3.068 4.177     .  0 0 "[    .    1    .    2]" 1 
        454 1  24 PRO HA   1  60 ASP HB2  . . 4.620 3.895 3.039 4.237     .  0 0 "[    .    1    .    2]" 1 
        455 1  24 PRO HA   1  60 ASP QB   . . 3.750 2.311 2.105 2.591     .  0 0 "[    .    1    .    2]" 1 
        456 1  24 PRO HA   1  60 ASP HB3  . . 4.620 2.338 2.116 2.754     .  0 0 "[    .    1    .    2]" 1 
        457 1  24 PRO HB2  1  25 PHE H    . . 4.340 3.431 3.310 3.594     .  0 0 "[    .    1    .    2]" 1 
        458 1  24 PRO HB2  1  26 ASP H    . . 3.490 2.506 2.304 2.926     .  0 0 "[    .    1    .    2]" 1 
        459 1  24 PRO HB2  1  27 LEU H    . . 4.630 3.357 2.963 3.505     .  0 0 "[    .    1    .    2]" 1 
        460 1  24 PRO HB2  1  60 ASP QB   . . 5.150 4.848 4.684 5.138     .  0 0 "[    .    1    .    2]" 1 
        461 1  24 PRO HB3  1  25 PHE H    . . 4.120 3.932 3.853 4.042     .  0 0 "[    .    1    .    2]" 1 
        462 1  24 PRO HB3  1  26 ASP H    . . 4.470 4.019 3.870 4.313     .  0 0 "[    .    1    .    2]" 1 
        463 1  24 PRO HB3  1  27 LEU H    . . 5.130 4.958 4.590 5.088     .  0 0 "[    .    1    .    2]" 1 
        464 1  24 PRO HB3  1  27 LEU MD1  . . 5.450 4.413 4.203 4.973     .  0 0 "[    .    1    .    2]" 1 
        465 1  24 PRO QD   1  27 LEU HB2  . . 4.580 3.370 3.053 3.587     .  0 0 "[    .    1    .    2]" 1 
        466 1  24 PRO QD   1  27 LEU MD1  . . 3.790 2.220 1.992 2.560     .  0 0 "[    .    1    .    2]" 1 
        467 1  24 PRO QD   1  27 LEU HG   . . 4.900 3.869 3.743 4.112     .  0 0 "[    .    1    .    2]" 1 
        468 1  24 PRO QD   1  82 VAL MG1  . . 3.300 2.095 1.931 2.407     .  0 0 "[    .    1    .    2]" 1 
        469 1  24 PRO QD   1  82 VAL MG2  . . 4.440 2.747 2.222 3.243     .  0 0 "[    .    1    .    2]" 1 
        470 1  24 PRO HD2  1  82 VAL MG1  . . 3.760 2.169 1.967 2.519     .  0 0 "[    .    1    .    2]" 1 
        471 1  24 PRO HD3  1  82 VAL MG1  . . 3.760 2.811 2.550 3.112     .  0 0 "[    .    1    .    2]" 1 
        472 1  24 PRO QG   1  25 PHE H    . . 4.840 4.619 4.567 4.680     .  0 0 "[    .    1    .    2]" 1 
        473 1  24 PRO QG   1  26 ASP H    . . 5.040 3.939 3.678 4.418     .  0 0 "[    .    1    .    2]" 1 
        474 1  24 PRO QG   1  26 ASP QB   . . 4.540 3.614 3.350 4.542 0.002 20 0 "[    .    1    .    2]" 1 
        475 1  24 PRO QG   1  27 LEU H    . . 5.250 3.186 2.768 3.320     .  0 0 "[    .    1    .    2]" 1 
        476 1  24 PRO QG   1  27 LEU MD1  . . 3.710 1.972 1.844 2.487     .  0 0 "[    .    1    .    2]" 1 
        477 1  24 PRO QG   1  27 LEU MD2  . . 4.410 3.578 3.445 3.693     .  0 0 "[    .    1    .    2]" 1 
        478 1  24 PRO QG   1  82 VAL MG1  . . 4.120 2.924 2.540 3.185     .  0 0 "[    .    1    .    2]" 1 
        479 1  24 PRO QG   1  86 GLN HE21 . . 5.130 4.082 3.495 4.856     .  0 0 "[    .    1    .    2]" 1 
        480 1  24 PRO QG   1  86 GLN HE22 . . 5.130 4.516 3.724 5.109     .  0 0 "[    .    1    .    2]" 1 
        481 1  24 PRO QG   1  89 GLN QE   . . 5.340 4.335 3.676 4.892     .  0 0 "[    .    1    .    2]" 1 
        482 1  25 PHE H    1  25 PHE HB2  . . 3.440 2.412 2.323 2.496     .  0 0 "[    .    1    .    2]" 1 
        483 1  25 PHE H    1  25 PHE HB3  . . 3.440 2.655 2.563 2.758     .  0 0 "[    .    1    .    2]" 1 
        484 1  25 PHE H    1  25 PHE QD   . . 4.310 4.162 4.115 4.184     .  0 0 "[    .    1    .    2]" 1 
        485 1  25 PHE H    1  26 ASP H    . . 3.790 2.693 2.651 2.767     .  0 0 "[    .    1    .    2]" 1 
        486 1  25 PHE H    1  27 LEU H    . . 4.760 4.254 4.188 4.324     .  0 0 "[    .    1    .    2]" 1 
        487 1  25 PHE H    1  60 ASP H    . . 5.500 5.465 5.194 5.502 0.002 18 0 "[    .    1    .    2]" 1 
        488 1  25 PHE H    1  60 ASP HA   . . 3.540 3.179 3.026 3.382     .  0 0 "[    .    1    .    2]" 1 
        489 1  25 PHE H    1  60 ASP QB   . . 4.830 3.243 2.516 3.546     .  0 0 "[    .    1    .    2]" 1 
        490 1  25 PHE HA   1  25 PHE QD   . . 3.810 3.093 2.899 3.180     .  0 0 "[    .    1    .    2]" 1 
        491 1  25 PHE HA   1  26 ASP HA   . . 5.440 4.808 4.738 4.886     .  0 0 "[    .    1    .    2]" 1 
        492 1  25 PHE HA   1  28 HIS H    . . 4.230 2.912 2.810 3.042     .  0 0 "[    .    1    .    2]" 1 
        493 1  25 PHE HA   1  28 HIS HA   . . 5.500 4.629 4.442 4.728     .  0 0 "[    .    1    .    2]" 1 
        494 1  25 PHE HA   1  28 HIS HD2  . . 4.470 3.275 2.859 3.627     .  0 0 "[    .    1    .    2]" 1 
        495 1  25 PHE HA   1  28 HIS HE1  . . 4.630 3.494 3.085 3.798     .  0 0 "[    .    1    .    2]" 1 
        496 1  25 PHE HA   1  60 ASP HA   . . 4.760 4.099 3.891 4.321     .  0 0 "[    .    1    .    2]" 1 
        497 1  25 PHE QB   1  26 ASP H    . . 3.640 2.958 2.680 3.165     .  0 0 "[    .    1    .    2]" 1 
        498 1  25 PHE QB   1  28 HIS HE1  . . 4.430 3.814 3.251 4.257     .  0 0 "[    .    1    .    2]" 1 
        499 1  25 PHE QB   1  60 ASP HA   . . 4.400 3.386 3.184 3.566     .  0 0 "[    .    1    .    2]" 1 
        500 1  25 PHE HB2  1  26 ASP H    . . 4.170 4.045 3.884 4.165     .  0 0 "[    .    1    .    2]" 1 
        501 1  25 PHE HB2  1  60 ASP HA   . . 5.050 3.451 3.231 3.651     .  0 0 "[    .    1    .    2]" 1 
        502 1  25 PHE HB3  1  26 ASP H    . . 4.170 3.043 2.728 3.282     .  0 0 "[    .    1    .    2]" 1 
        503 1  25 PHE HB3  1  60 ASP HA   . . 5.050 4.914 4.781 5.021     .  0 0 "[    .    1    .    2]" 1 
        504 1  25 PHE QD   1  26 ASP H    . . 4.190 3.913 3.446 4.180     .  0 0 "[    .    1    .    2]" 1 
        505 1  25 PHE QD   1  26 ASP HA   . . 4.440 3.271 2.856 3.536     .  0 0 "[    .    1    .    2]" 1 
        506 1  25 PHE QD   1  28 HIS HE1  . . 4.990 3.104 2.442 3.798     .  0 0 "[    .    1    .    2]" 1 
        507 1  25 PHE QD   1  58 GLN HA   . . 4.430 3.911 3.101 4.264     .  0 0 "[    .    1    .    2]" 1 
        508 1  25 PHE QD   1  59 SER H    . . 4.250 3.534 3.149 4.095     .  0 0 "[    .    1    .    2]" 1 
        509 1  25 PHE QE   1  55 PRO HA   . . 3.780 2.474 1.998 2.791     .  0 0 "[    .    1    .    2]" 1 
        510 1  25 PHE QE   1  55 PRO HB2  . . 4.900 4.322 4.109 4.620     .  0 0 "[    .    1    .    2]" 1 
        511 1  25 PHE QE   1  55 PRO QB   . . 4.170 3.100 2.872 3.310     .  0 0 "[    .    1    .    2]" 1 
        512 1  25 PHE QE   1  55 PRO HB3  . . 4.900 3.178 2.931 3.391     .  0 0 "[    .    1    .    2]" 1 
        513 1  25 PHE QE   1  58 GLN HA   . . 5.310 4.608 3.917 5.210     .  0 0 "[    .    1    .    2]" 1 
        514 1  25 PHE HZ   1  55 PRO HA   . . 4.350 2.716 2.328 3.264     .  0 0 "[    .    1    .    2]" 1 
        515 1  25 PHE HZ   1  55 PRO HB2  . . 4.480 3.753 3.608 4.120     .  0 0 "[    .    1    .    2]" 1 
        516 1  25 PHE HZ   1  55 PRO HB3  . . 4.480 2.080 2.003 2.445     .  0 0 "[    .    1    .    2]" 1 
        517 1  25 PHE HZ   1  55 PRO HD2  . . 5.090 4.742 4.224 5.089     .  0 0 "[    .    1    .    2]" 1 
        518 1  25 PHE HZ   1  55 PRO HD3  . . 5.090 3.282 2.732 3.772     .  0 0 "[    .    1    .    2]" 1 
        519 1  25 PHE HZ   1  55 PRO QG   . . 5.120 3.628 3.389 3.940     .  0 0 "[    .    1    .    2]" 1 
        520 1  26 ASP H    1  26 ASP QB   . . 2.870 2.381 2.181 2.663     .  0 0 "[    .    1    .    2]" 1 
        521 1  26 ASP H    1  27 LEU H    . . 3.460 2.617 2.489 2.764     .  0 0 "[    .    1    .    2]" 1 
        522 1  26 ASP H    1  28 HIS H    . . 4.650 4.085 3.956 4.228     .  0 0 "[    .    1    .    2]" 1 
        523 1  26 ASP QB   1  27 LEU H    . . 3.800 3.135 3.000 3.482     .  0 0 "[    .    1    .    2]" 1 
        524 1  26 ASP QB   1  27 LEU MD2  . . 4.080 3.775 3.293 4.046     .  0 0 "[    .    1    .    2]" 1 
        525 1  26 ASP QB   1  28 HIS H    . . 4.990 4.886 4.772 4.989     .  0 0 "[    .    1    .    2]" 1 
        526 1  27 LEU H    1  27 LEU HB2  . . 3.330 2.392 2.308 2.477     .  0 0 "[    .    1    .    2]" 1 
        527 1  27 LEU H    1  27 LEU HB3  . . 3.750 3.627 3.572 3.679     .  0 0 "[    .    1    .    2]" 1 
        528 1  27 LEU H    1  27 LEU MD1  . . 4.020 3.909 3.787 4.019     .  0 0 "[    .    1    .    2]" 1 
        529 1  27 LEU H    1  27 LEU MD2  . . 4.100 3.839 3.621 4.014     .  0 0 "[    .    1    .    2]" 1 
        530 1  27 LEU H    1  27 LEU HG   . . 3.470 2.947 2.813 3.096     .  0 0 "[    .    1    .    2]" 1 
        531 1  27 LEU H    1  28 HIS HD2  . . 4.340 3.875 3.347 4.298     .  0 0 "[    .    1    .    2]" 1 
        532 1  27 LEU H    1  30 TYR QD   . . 5.500 4.936 4.842 5.122     .  0 0 "[    .    1    .    2]" 1 
        533 1  27 LEU HA   1  27 LEU MD1  . . 4.440 3.847 3.796 3.890     .  0 0 "[    .    1    .    2]" 1 
        534 1  27 LEU HA   1  27 LEU MD2  . . 3.180 2.113 1.967 2.230     .  0 0 "[    .    1    .    2]" 1 
        535 1  27 LEU HA   1  30 TYR QD   . . 3.380 2.089 1.998 2.246     .  0 0 "[    .    1    .    2]" 1 
        536 1  27 LEU HA   1  30 TYR QE   . . 4.020 3.525 3.282 3.870     .  0 0 "[    .    1    .    2]" 1 
        537 1  27 LEU HB2  1  27 LEU MD1  . . 3.330 2.266 2.121 2.426     .  0 0 "[    .    1    .    2]" 1 
        538 1  27 LEU HB2  1  27 LEU MD2  . . 3.460 3.183 3.171 3.191     .  0 0 "[    .    1    .    2]" 1 
        539 1  27 LEU HB2  1  28 HIS H    . . 4.230 2.897 2.795 3.031     .  0 0 "[    .    1    .    2]" 1 
        540 1  27 LEU HB2  1  28 HIS HA   . . 4.970 4.360 4.278 4.445     .  0 0 "[    .    1    .    2]" 1 
        541 1  27 LEU HB2  1  28 HIS HD2  . . 4.150 3.413 3.025 3.745     .  0 0 "[    .    1    .    2]" 1 
        542 1  27 LEU HB2  1  31 VAL MG2  . . 4.210 3.380 3.138 3.574     .  0 0 "[    .    1    .    2]" 1 
        543 1  27 LEU HB2  1  82 VAL MG2  . . 4.300 3.928 3.486 4.187     .  0 0 "[    .    1    .    2]" 1 
        544 1  27 LEU HB3  1  27 LEU MD1  . . 3.310 2.402 2.256 2.529     .  0 0 "[    .    1    .    2]" 1 
        545 1  27 LEU HB3  1  27 LEU MD2  . . 3.280 2.290 2.230 2.385     .  0 0 "[    .    1    .    2]" 1 
        546 1  27 LEU HB3  1  28 HIS H    . . 4.550 3.746 3.608 3.903     .  0 0 "[    .    1    .    2]" 1 
        547 1  27 LEU HB3  1  28 HIS HA   . . 5.280 4.448 4.337 4.583     .  0 0 "[    .    1    .    2]" 1 
        548 1  27 LEU HB3  1  28 HIS HD2  . . 4.930 4.382 4.145 4.721     .  0 0 "[    .    1    .    2]" 1 
        549 1  27 LEU HB3  1  30 TYR QD   . . 4.170 3.714 3.365 4.024     .  0 0 "[    .    1    .    2]" 1 
        550 1  27 LEU HB3  1  31 VAL MG2  . . 3.410 2.560 2.361 2.725     .  0 0 "[    .    1    .    2]" 1 
        551 1  27 LEU HB3  1  82 VAL HA   . . 5.330 4.429 4.211 4.659     .  0 0 "[    .    1    .    2]" 1 
        552 1  27 LEU HB3  1  82 VAL MG2  . . 4.380 3.956 3.555 4.268     .  0 0 "[    .    1    .    2]" 1 
        553 1  27 LEU MD1  1  30 TYR QD   . . 5.080 4.572 4.299 4.866     .  0 0 "[    .    1    .    2]" 1 
        554 1  27 LEU MD1  1  82 VAL HA   . . 4.160 2.297 2.081 2.604     .  0 0 "[    .    1    .    2]" 1 
        555 1  27 LEU MD1  1  85 LEU HB2  . . 4.530 2.757 2.494 3.066     .  0 0 "[    .    1    .    2]" 1 
        556 1  27 LEU MD1  1  85 LEU HB3  . . 4.330 3.288 2.866 3.813     .  0 0 "[    .    1    .    2]" 1 
        557 1  27 LEU MD1  1  86 GLN H    . . 4.400 3.154 2.701 3.578     .  0 0 "[    .    1    .    2]" 1 
        558 1  27 LEU MD1  1  86 GLN HA   . . 4.320 3.804 3.259 4.302     .  0 0 "[    .    1    .    2]" 1 
        559 1  27 LEU MD1  1  86 GLN HB2  . . 4.560 3.963 3.596 4.319     .  0 0 "[    .    1    .    2]" 1 
        560 1  27 LEU MD1  1  86 GLN HB3  . . 4.560 2.654 2.278 2.869     .  0 0 "[    .    1    .    2]" 1 
        561 1  27 LEU MD1  1  86 GLN HE21 . . 5.130 3.324 2.793 4.094     .  0 0 "[    .    1    .    2]" 1 
        562 1  27 LEU MD1  1  86 GLN QE   . . 4.430 3.224 2.740 3.646     .  0 0 "[    .    1    .    2]" 1 
        563 1  27 LEU MD1  1  86 GLN HE22 . . 5.130 4.466 3.978 5.113     .  0 0 "[    .    1    .    2]" 1 
        564 1  27 LEU MD1  1  89 GLN QE   . . 4.780 3.887 3.096 4.374     .  0 0 "[    .    1    .    2]" 1 
        565 1  27 LEU MD2  1  30 TYR HB2  . . 4.650 3.206 2.932 3.456     .  0 0 "[    .    1    .    2]" 1 
        566 1  27 LEU MD2  1  30 TYR QB   . . 3.950 3.115 2.851 3.355     .  0 0 "[    .    1    .    2]" 1 
        567 1  27 LEU MD2  1  30 TYR HB3  . . 4.650 4.233 3.896 4.544     .  0 0 "[    .    1    .    2]" 1 
        568 1  27 LEU MD2  1  30 TYR QD   . . 3.350 2.109 1.895 2.362     .  0 0 "[    .    1    .    2]" 1 
        569 1  27 LEU MD2  1  30 TYR QE   . . 3.600 3.093 2.689 3.575     .  0 0 "[    .    1    .    2]" 1 
        570 1  27 LEU MD2  1  85 LEU HB3  . . 3.810 2.252 1.956 2.683     .  0 0 "[    .    1    .    2]" 1 
        571 1  27 LEU MD2  1  86 GLN H    . . 4.260 3.313 3.006 3.792     .  0 0 "[    .    1    .    2]" 1 
        572 1  27 LEU MD2  1  86 GLN HA   . . 4.370 3.017 2.475 3.393     .  0 0 "[    .    1    .    2]" 1 
        573 1  27 LEU MD2  1  89 GLN HE21 . . 4.710 3.393 2.217 4.135     .  0 0 "[    .    1    .    2]" 1 
        574 1  27 LEU MD2  1  89 GLN QE   . . 4.080 2.805 1.774 3.475     .  0 0 "[    .    1    .    2]" 1 
        575 1  27 LEU MD2  1  89 GLN HE22 . . 4.710 3.228 1.800 4.698     .  0 0 "[    .    1    .    2]" 1 
        576 1  27 LEU MD2  1  89 GLN QG   . . 4.320 3.076 2.091 4.318     .  0 0 "[    .    1    .    2]" 1 
        577 1  27 LEU HG   1  28 HIS H    . . 4.720 4.589 4.486 4.699     .  0 0 "[    .    1    .    2]" 1 
        578 1  28 HIS H    1  28 HIS HB2  . . 3.440 2.540 2.483 2.609     .  0 0 "[    .    1    .    2]" 1 
        579 1  28 HIS H    1  28 HIS HB3  . . 3.650 3.609 3.594 3.625     .  0 0 "[    .    1    .    2]" 1 
        580 1  28 HIS H    1  28 HIS HD2  . . 3.370 2.465 2.011 2.761     .  0 0 "[    .    1    .    2]" 1 
        581 1  28 HIS H    1  29 ARG H    . . 3.830 3.115 2.933 3.218     .  0 0 "[    .    1    .    2]" 1 
        582 1  28 HIS H    1  30 TYR QD   . . 5.500 5.329 5.254 5.431     .  0 0 "[    .    1    .    2]" 1 
        583 1  28 HIS H    1  31 VAL MG2  . . 4.130 3.784 3.589 4.008     .  0 0 "[    .    1    .    2]" 1 
        584 1  28 HIS H    1  62 ILE MD   . . 5.070 4.919 4.656 5.067     .  0 0 "[    .    1    .    2]" 1 
        585 1  28 HIS HA   1  28 HIS HD2  . . 3.670 2.518 2.352 2.797     .  0 0 "[    .    1    .    2]" 1 
        586 1  28 HIS HA   1  30 TYR H    . . 4.540 4.068 3.894 4.300     .  0 0 "[    .    1    .    2]" 1 
        587 1  28 HIS HA   1  31 VAL H    . . 3.900 3.114 3.038 3.234     .  0 0 "[    .    1    .    2]" 1 
        588 1  28 HIS HA   1  31 VAL HB   . . 3.790 2.325 2.183 2.503     .  0 0 "[    .    1    .    2]" 1 
        589 1  28 HIS HA   1  31 VAL MG1  . . 4.320 3.783 3.651 3.963     .  0 0 "[    .    1    .    2]" 1 
        590 1  28 HIS HA   1  31 VAL MG2  . . 3.030 2.693 2.553 2.933     .  0 0 "[    .    1    .    2]" 1 
        591 1  28 HIS HA   1  32 ILE H    . . 4.040 3.464 3.243 3.652     .  0 0 "[    .    1    .    2]" 1 
        592 1  28 HIS HA   1  32 ILE HG12 . . 5.110 5.076 5.004 5.111 0.001 11 0 "[    .    1    .    2]" 1 
        593 1  28 HIS HA   1  32 ILE HG13 . . 3.850 3.498 3.366 3.588     .  0 0 "[    .    1    .    2]" 1 
        594 1  28 HIS HA   1  52 VAL MG1  . . 4.690 3.831 3.575 3.997     .  0 0 "[    .    1    .    2]" 1 
        595 1  28 HIS HA   1  52 VAL MG2  . . 4.780 3.994 3.817 4.170     .  0 0 "[    .    1    .    2]" 1 
        596 1  28 HIS HA   1  62 ILE MD   . . 4.300 3.769 3.619 3.886     .  0 0 "[    .    1    .    2]" 1 
        597 1  28 HIS HB2  1  29 ARG H    . . 3.940 2.302 2.159 2.535     .  0 0 "[    .    1    .    2]" 1 
        598 1  28 HIS HB2  1  32 ILE MD   . . 4.870 3.811 3.417 4.144     .  0 0 "[    .    1    .    2]" 1 
        599 1  28 HIS HB2  1  52 VAL MG1  . . 3.830 3.691 3.515 3.819     .  0 0 "[    .    1    .    2]" 1 
        600 1  28 HIS HB2  1  52 VAL MG2  . . 5.380 5.154 4.955 5.354     .  0 0 "[    .    1    .    2]" 1 
        601 1  28 HIS HB3  1  29 ARG H    . . 3.950 3.202 3.065 3.449     .  0 0 "[    .    1    .    2]" 1 
        602 1  28 HIS HB3  1  29 ARG HA   . . 4.270 4.182 4.110 4.269     .  0 0 "[    .    1    .    2]" 1 
        603 1  28 HIS HB3  1  32 ILE MD   . . 4.350 2.496 2.066 2.887     .  0 0 "[    .    1    .    2]" 1 
        604 1  28 HIS HB3  1  32 ILE HG13 . . 4.390 3.434 3.198 3.691     .  0 0 "[    .    1    .    2]" 1 
        605 1  28 HIS HB3  1  52 VAL MG1  . . 3.550 2.494 2.246 2.655     .  0 0 "[    .    1    .    2]" 1 
        606 1  28 HIS HB3  1  52 VAL MG2  . . 4.340 3.795 3.531 4.064     .  0 0 "[    .    1    .    2]" 1 
        607 1  28 HIS HB3  1  62 ILE MD   . . 5.000 4.625 4.355 4.838     .  0 0 "[    .    1    .    2]" 1 
        608 1  28 HIS HD2  1  31 VAL MG1  . . 5.280 4.722 4.297 5.148     .  0 0 "[    .    1    .    2]" 1 
        609 1  28 HIS HD2  1  31 VAL MG2  . . 4.120 3.316 3.026 3.625     .  0 0 "[    .    1    .    2]" 1 
        610 1  28 HIS HD2  1  52 VAL MG2  . . 5.500 4.441 3.969 4.914     .  0 0 "[    .    1    .    2]" 1 
        611 1  28 HIS HD2  1  62 ILE MD   . . 4.190 2.855 2.246 3.488     .  0 0 "[    .    1    .    2]" 1 
        612 1  28 HIS HE1  1  52 VAL HA   . . 5.260 4.558 3.997 4.942     .  0 0 "[    .    1    .    2]" 1 
        613 1  28 HIS HE1  1  52 VAL MG1  . . 4.580 2.874 2.457 3.218     .  0 0 "[    .    1    .    2]" 1 
        614 1  28 HIS HE1  1  52 VAL MG2  . . 5.500 4.633 4.341 4.948     .  0 0 "[    .    1    .    2]" 1 
        615 1  28 HIS HE1  1  53 PRO QB   . . 4.430 4.111 3.967 4.301     .  0 0 "[    .    1    .    2]" 1 
        616 1  28 HIS HE1  1  53 PRO HD2  . . 4.570 2.493 2.005 2.867     .  0 0 "[    .    1    .    2]" 1 
        617 1  28 HIS HE1  1  53 PRO HD3  . . 4.310 3.712 3.402 4.075     .  0 0 "[    .    1    .    2]" 1 
        618 1  28 HIS HE1  1  53 PRO HG2  . . 4.260 2.141 1.999 2.371     .  0 0 "[    .    1    .    2]" 1 
        619 1  28 HIS HE1  1  53 PRO HG3  . . 4.230 2.912 2.675 3.255     .  0 0 "[    .    1    .    2]" 1 
        620 1  28 HIS HE1  1  60 ASP HA   . . 4.400 3.316 2.671 3.641     .  0 0 "[    .    1    .    2]" 1 
        621 1  28 HIS HE1  1  62 ILE MD   . . 5.020 4.159 3.855 4.465     .  0 0 "[    .    1    .    2]" 1 
        622 1  28 HIS HE1  1  62 ILE HG12 . . 5.500 3.874 3.449 4.369     .  0 0 "[    .    1    .    2]" 1 
        623 1  28 HIS HE1  1  62 ILE HG13 . . 4.980 3.508 3.051 3.937     .  0 0 "[    .    1    .    2]" 1 
        624 1  29 ARG H    1  29 ARG HB2  . . 3.810 3.588 3.515 3.611     .  0 0 "[    .    1    .    2]" 1 
        625 1  29 ARG H    1  29 ARG QB   . . 3.340 2.445 2.195 2.660     .  0 0 "[    .    1    .    2]" 1 
        626 1  29 ARG H    1  29 ARG HB3  . . 3.810 2.490 2.217 2.743     .  0 0 "[    .    1    .    2]" 1 
        627 1  29 ARG H    1  29 ARG QD   . . 4.500 3.763 3.228 4.214     .  0 0 "[    .    1    .    2]" 1 
        628 1  29 ARG H    1  29 ARG HG2  . . 4.100 2.291 1.940 2.907     .  0 0 "[    .    1    .    2]" 1 
        629 1  29 ARG H    1  29 ARG QG   . . 3.490 2.261 1.908 2.850     .  0 0 "[    .    1    .    2]" 1 
        630 1  29 ARG H    1  29 ARG HG3  . . 4.100 3.502 2.830 4.097     .  0 0 "[    .    1    .    2]" 1 
        631 1  29 ARG H    1  30 TYR H    . . 3.830 2.862 2.699 2.947     .  0 0 "[    .    1    .    2]" 1 
        632 1  29 ARG H    1  31 VAL H    . . 4.970 4.194 4.045 4.345     .  0 0 "[    .    1    .    2]" 1 
        633 1  29 ARG H    1  32 ILE MD   . . 5.100 4.136 3.616 4.440     .  0 0 "[    .    1    .    2]" 1 
        634 1  29 ARG HA   1  29 ARG QD   . . 4.490 4.363 4.211 4.493 0.003 14 0 "[    .    1    .    2]" 1 
        635 1  29 ARG HA   1  31 VAL H    . . 4.750 4.540 4.242 4.726     .  0 0 "[    .    1    .    2]" 1 
        636 1  29 ARG HA   1  32 ILE H    . . 4.390 4.131 3.953 4.319     .  0 0 "[    .    1    .    2]" 1 
        637 1  29 ARG HA   1  32 ILE HB   . . 3.940 3.534 3.317 3.768     .  0 0 "[    .    1    .    2]" 1 
        638 1  29 ARG HA   1  32 ILE MD   . . 3.580 3.202 2.762 3.558     .  0 0 "[    .    1    .    2]" 1 
        639 1  29 ARG QB   1  30 TYR H    . . 3.820 3.454 3.352 3.574     .  0 0 "[    .    1    .    2]" 1 
        640 1  29 ARG QB   1  30 TYR QE   . . 4.970 4.461 3.963 4.946     .  0 0 "[    .    1    .    2]" 1 
        641 1  29 ARG HB2  1  29 ARG QD   . . 3.500 2.624 2.199 3.108     .  0 0 "[    .    1    .    2]" 1 
        642 1  29 ARG HB2  1  30 TYR H    . . 4.410 3.804 3.647 3.987     .  0 0 "[    .    1    .    2]" 1 
        643 1  29 ARG HB3  1  29 ARG QD   . . 3.500 2.438 2.075 2.931     .  0 0 "[    .    1    .    2]" 1 
        644 1  29 ARG HB3  1  30 TYR H    . . 4.410 3.977 3.698 4.165     .  0 0 "[    .    1    .    2]" 1 
        645 1  29 ARG QD   1  30 TYR H    . . 5.150 4.070 3.810 4.521     .  0 0 "[    .    1    .    2]" 1 
        646 1  29 ARG QD   1  30 TYR QD   . . 5.190 3.922 3.597 4.280     .  0 0 "[    .    1    .    2]" 1 
        647 1  29 ARG QD   1  30 TYR QE   . . 3.960 3.143 2.561 3.651     .  0 0 "[    .    1    .    2]" 1 
        648 1  29 ARG QG   1  30 TYR QE   . . 4.280 3.174 2.777 3.466     .  0 0 "[    .    1    .    2]" 1 
        649 1  29 ARG QG   1  31 VAL H    . . 4.560 4.225 4.063 4.379     .  0 0 "[    .    1    .    2]" 1 
        650 1  29 ARG HG2  1  30 TYR H    . . 3.960 2.526 1.955 3.269     .  0 0 "[    .    1    .    2]" 1 
        651 1  29 ARG HG2  1  30 TYR QD   . . 4.650 3.876 3.247 4.629     .  0 0 "[    .    1    .    2]" 1 
        652 1  29 ARG HG2  1  30 TYR QE   . . 4.890 4.161 3.622 4.695     .  0 0 "[    .    1    .    2]" 1 
        653 1  29 ARG HG3  1  30 TYR H    . . 3.960 2.528 2.149 2.913     .  0 0 "[    .    1    .    2]" 1 
        654 1  29 ARG HG3  1  30 TYR QD   . . 4.650 3.004 2.527 3.298     .  0 0 "[    .    1    .    2]" 1 
        655 1  29 ARG HG3  1  30 TYR QE   . . 4.890 3.300 2.823 3.570     .  0 0 "[    .    1    .    2]" 1 
        656 1  30 TYR H    1  30 TYR HB2  . . 3.760 2.520 2.416 2.591     .  0 0 "[    .    1    .    2]" 1 
        657 1  30 TYR H    1  30 TYR QB   . . 3.160 2.475 2.381 2.540     .  0 0 "[    .    1    .    2]" 1 
        658 1  30 TYR H    1  30 TYR HB3  . . 3.760 3.627 3.603 3.657     .  0 0 "[    .    1    .    2]" 1 
        659 1  30 TYR H    1  30 TYR QE   . . 4.770 4.600 4.475 4.738     .  0 0 "[    .    1    .    2]" 1 
        660 1  30 TYR H    1  31 VAL H    . . 3.080 2.370 2.236 2.481     .  0 0 "[    .    1    .    2]" 1 
        661 1  30 TYR H    1  31 VAL HA   . . 5.330 5.025 4.918 5.114     .  0 0 "[    .    1    .    2]" 1 
        662 1  30 TYR H    1  31 VAL HB   . . 4.710 4.598 4.423 4.712 0.002  2 0 "[    .    1    .    2]" 1 
        663 1  30 TYR H    1  31 VAL MG2  . . 3.970 3.745 3.666 3.941     .  0 0 "[    .    1    .    2]" 1 
        664 1  30 TYR H    1  32 ILE H    . . 4.520 4.285 4.111 4.516     .  0 0 "[    .    1    .    2]" 1 
        665 1  30 TYR HA   1  30 TYR QD   . . 3.290 2.136 2.001 2.344     .  0 0 "[    .    1    .    2]" 1 
        666 1  30 TYR HA   1  30 TYR QE   . . 4.580 4.412 4.311 4.502     .  0 0 "[    .    1    .    2]" 1 
        667 1  30 TYR HA   1  33 GLY H    . . 4.270 3.942 3.293 4.221     .  0 0 "[    .    1    .    2]" 1 
        668 1  30 TYR QB   1  31 VAL H    . . 3.610 2.679 2.539 2.914     .  0 0 "[    .    1    .    2]" 1 
        669 1  30 TYR QB   1  31 VAL MG2  . . 3.740 3.151 3.024 3.379     .  0 0 "[    .    1    .    2]" 1 
        670 1  30 TYR QB   1  85 LEU MD2  . . 3.320 2.999 2.512 3.225     .  0 0 "[    .    1    .    2]" 1 
        671 1  30 TYR HB2  1  31 VAL H    . . 4.210 2.737 2.590 2.991     .  0 0 "[    .    1    .    2]" 1 
        672 1  30 TYR HB2  1  31 VAL MG2  . . 4.540 3.233 3.101 3.489     .  0 0 "[    .    1    .    2]" 1 
        673 1  30 TYR HB2  1  85 LEU MD1  . . 4.030 3.465 3.147 3.988     .  0 0 "[    .    1    .    2]" 1 
        674 1  30 TYR HB2  1  85 LEU MD2  . . 4.010 3.599 3.026 3.991     .  0 0 "[    .    1    .    2]" 1 
        675 1  30 TYR HB3  1  31 VAL H    . . 4.210 3.819 3.587 4.023     .  0 0 "[    .    1    .    2]" 1 
        676 1  30 TYR HB3  1  31 VAL MG2  . . 4.540 4.370 4.194 4.523     .  0 0 "[    .    1    .    2]" 1 
        677 1  30 TYR HB3  1  85 LEU MD1  . . 4.030 3.898 3.620 4.032 0.002  1 0 "[    .    1    .    2]" 1 
        678 1  30 TYR HB3  1  85 LEU MD2  . . 4.010 3.216 2.684 3.485     .  0 0 "[    .    1    .    2]" 1 
        679 1  30 TYR QD   1  31 VAL H    . . 4.560 4.356 4.159 4.493     .  0 0 "[    .    1    .    2]" 1 
        680 1  30 TYR QE   1  89 GLN HB2  . . 5.070 4.188 2.940 5.071 0.001 10 0 "[    .    1    .    2]" 1 
        681 1  30 TYR QE   1  89 GLN HB3  . . 5.070 4.110 3.199 5.025     .  0 0 "[    .    1    .    2]" 1 
        682 1  30 TYR QE   1  89 GLN QG   . . 5.110 4.420 3.452 4.985     .  0 0 "[    .    1    .    2]" 1 
        683 1  31 VAL H    1  31 VAL HB   . . 3.240 2.527 2.384 2.607     .  0 0 "[    .    1    .    2]" 1 
        684 1  31 VAL H    1  31 VAL MG1  . . 3.810 3.762 3.734 3.773     .  0 0 "[    .    1    .    2]" 1 
        685 1  31 VAL H    1  31 VAL MG2  . . 3.240 2.092 1.905 2.531     .  0 0 "[    .    1    .    2]" 1 
        686 1  31 VAL H    1  33 GLY H    . . 5.150 4.271 3.827 4.568     .  0 0 "[    .    1    .    2]" 1 
        687 1  31 VAL HA   1  31 VAL MG1  . . 3.280 2.370 2.258 2.443     .  0 0 "[    .    1    .    2]" 1 
        688 1  31 VAL HA   1  31 VAL MG2  . . 3.140 2.390 2.192 2.458     .  0 0 "[    .    1    .    2]" 1 
        689 1  31 VAL HA   1  39 ILE MD   . . 4.750 4.647 4.537 4.748     .  0 0 "[    .    1    .    2]" 1 
        690 1  31 VAL HA   1  39 ILE HG12 . . 4.790 4.639 4.377 4.788     .  0 0 "[    .    1    .    2]" 1 
        691 1  31 VAL HA   1  81 ARG HG2  . . 5.220 4.730 3.982 5.217     .  0 0 "[    .    1    .    2]" 1 
        692 1  31 VAL HA   1  85 LEU MD1  . . 3.930 3.744 3.150 3.930 0.000  4 0 "[    .    1    .    2]" 1 
        693 1  31 VAL HB   1  32 ILE H    . . 3.480 2.290 2.126 2.462     .  0 0 "[    .    1    .    2]" 1 
        694 1  31 VAL HB   1  32 ILE HB   . . 5.090 4.804 4.634 4.953     .  0 0 "[    .    1    .    2]" 1 
        695 1  31 VAL HB   1  32 ILE MD   . . 4.640 4.309 3.959 4.581     .  0 0 "[    .    1    .    2]" 1 
        696 1  31 VAL HB   1  32 ILE HG12 . . 5.130 4.435 4.239 4.631     .  0 0 "[    .    1    .    2]" 1 
        697 1  31 VAL HB   1  32 ILE HG13 . . 4.170 3.004 2.801 3.208     .  0 0 "[    .    1    .    2]" 1 
        698 1  31 VAL HB   1  39 ILE MD   . . 3.810 3.374 3.248 3.540     .  0 0 "[    .    1    .    2]" 1 
        699 1  31 VAL HB   1  39 ILE HG13 . . 4.490 4.405 4.237 4.490 0.000  1 0 "[    .    1    .    2]" 1 
        700 1  31 VAL HB   1  62 ILE MD   . . 4.690 3.989 3.841 4.118     .  0 0 "[    .    1    .    2]" 1 
        701 1  31 VAL MG1  1  32 ILE H    . . 3.860 3.170 2.995 3.355     .  0 0 "[    .    1    .    2]" 1 
        702 1  31 VAL MG1  1  32 ILE HA   . . 4.080 3.360 3.202 3.518     .  0 0 "[    .    1    .    2]" 1 
        703 1  31 VAL MG1  1  39 ILE HG12 . . 3.720 2.101 1.965 2.264     .  0 0 "[    .    1    .    2]" 1 
        704 1  31 VAL MG1  1  39 ILE HG13 . . 4.090 2.518 2.180 2.831     .  0 0 "[    .    1    .    2]" 1 
        705 1  31 VAL MG2  1  62 ILE MD   . . 3.600 3.342 3.159 3.531     .  0 0 "[    .    1    .    2]" 1 
        706 1  32 ILE H    1  32 ILE HB   . . 3.470 2.622 2.566 2.644     .  0 0 "[    .    1    .    2]" 1 
        707 1  32 ILE H    1  32 ILE MD   . . 4.070 3.302 3.133 3.446     .  0 0 "[    .    1    .    2]" 1 
        708 1  32 ILE H    1  32 ILE HG12 . . 3.510 3.369 3.222 3.494     .  0 0 "[    .    1    .    2]" 1 
        709 1  32 ILE H    1  32 ILE HG13 . . 3.420 1.932 1.900 2.022     .  0 0 "[    .    1    .    2]" 1 
        710 1  32 ILE H    1  32 ILE MG   . . 3.900 3.765 3.761 3.771     .  0 0 "[    .    1    .    2]" 1 
        711 1  32 ILE H    1  33 GLY H    . . 3.660 2.856 2.519 3.018     .  0 0 "[    .    1    .    2]" 1 
        712 1  32 ILE H    1  39 ILE MD   . . 3.910 3.201 2.998 3.464     .  0 0 "[    .    1    .    2]" 1 
        713 1  32 ILE HA   1  32 ILE MD   . . 4.200 3.893 3.852 3.937     .  0 0 "[    .    1    .    2]" 1 
        714 1  32 ILE HA   1  32 ILE HG12 . . 3.710 2.707 2.583 2.858     .  0 0 "[    .    1    .    2]" 1 
        715 1  32 ILE HA   1  32 ILE HG13 . . 4.200 2.904 2.788 3.041     .  0 0 "[    .    1    .    2]" 1 
        716 1  32 ILE HA   1  32 ILE MG   . . 3.520 2.314 2.215 2.442     .  0 0 "[    .    1    .    2]" 1 
        717 1  32 ILE HA   1  39 ILE H    . . 4.170 3.490 2.922 3.843     .  0 0 "[    .    1    .    2]" 1 
        718 1  32 ILE HA   1  39 ILE HB   . . 3.820 3.453 3.221 3.660     .  0 0 "[    .    1    .    2]" 1 
        719 1  32 ILE HA   1  39 ILE MD   . . 4.060 2.048 1.931 2.257     .  0 0 "[    .    1    .    2]" 1 
        720 1  32 ILE HA   1  39 ILE HG13 . . 4.220 2.084 1.999 2.262     .  0 0 "[    .    1    .    2]" 1 
        721 1  32 ILE HA   1  39 ILE MG   . . 4.380 4.307 4.110 4.379     .  0 0 "[    .    1    .    2]" 1 
        722 1  32 ILE HB   1  32 ILE MD   . . 3.410 2.309 2.159 2.442     .  0 0 "[    .    1    .    2]" 1 
        723 1  32 ILE HB   1  33 GLY H    . . 3.670 2.334 2.042 2.860     .  0 0 "[    .    1    .    2]" 1 
        724 1  32 ILE MD   1  32 ILE MG   . . 2.860 2.153 1.953 2.385     .  0 0 "[    .    1    .    2]" 1 
        725 1  32 ILE MD   1  33 GLY H    . . 4.500 4.173 3.927 4.477     .  0 0 "[    .    1    .    2]" 1 
        726 1  32 ILE MD   1  52 VAL H    . . 5.500 4.820 4.325 5.288     .  0 0 "[    .    1    .    2]" 1 
        727 1  32 ILE MD   1  52 VAL HB   . . 3.810 2.739 2.273 3.219     .  0 0 "[    .    1    .    2]" 1 
        728 1  32 ILE MD   1  52 VAL MG2  . . 3.310 2.751 2.052 3.088     .  0 0 "[    .    1    .    2]" 1 
        729 1  32 ILE HG12 1  52 VAL HB   . . 4.630 3.607 3.285 3.884     .  0 0 "[    .    1    .    2]" 1 
        730 1  32 ILE HG12 1  52 VAL MG1  . . 4.050 3.780 3.399 4.024     .  0 0 "[    .    1    .    2]" 1 
        731 1  32 ILE HG12 1  52 VAL MG2  . . 3.390 2.520 2.174 2.906     .  0 0 "[    .    1    .    2]" 1 
        732 1  32 ILE HG13 1  32 ILE MG   . . 3.630 3.176 3.146 3.195     .  0 0 "[    .    1    .    2]" 1 
        733 1  32 ILE HG13 1  33 GLY H    . . 4.420 4.093 3.972 4.214     .  0 0 "[    .    1    .    2]" 1 
        734 1  32 ILE HG13 1  39 ILE MD   . . 3.620 2.616 2.092 2.949     .  0 0 "[    .    1    .    2]" 1 
        735 1  32 ILE HG13 1  52 VAL HB   . . 4.670 4.420 4.080 4.601     .  0 0 "[    .    1    .    2]" 1 
        736 1  32 ILE HG13 1  52 VAL MG1  . . 4.130 3.641 3.316 3.895     .  0 0 "[    .    1    .    2]" 1 
        737 1  32 ILE MG   1  33 GLY H    . . 3.930 3.312 3.081 3.840     .  0 0 "[    .    1    .    2]" 1 
        738 1  32 ILE MG   1  36 GLY H    . . 4.920 3.423 2.534 4.817     .  0 0 "[    .    1    .    2]" 1 
        739 1  32 ILE MG   1  36 GLY HA2  . . 3.920 2.386 1.968 3.181     .  0 0 "[    .    1    .    2]" 1 
        740 1  32 ILE MG   1  36 GLY HA3  . . 3.920 3.355 2.938 3.921 0.001  6 0 "[    .    1    .    2]" 1 
        741 1  32 ILE MG   1  39 ILE MD   . . 3.140 2.875 2.564 3.135     .  0 0 "[    .    1    .    2]" 1 
        742 1  32 ILE MG   1  52 VAL HB   . . 5.020 4.698 4.475 4.997     .  0 0 "[    .    1    .    2]" 1 
        743 1  34 GLN HA   1  34 GLN HG2  . . 4.040 3.486 2.633 3.869     .  0 0 "[    .    1    .    2]" 1 
        744 1  34 GLN HA   1  34 GLN HG3  . . 4.040 3.001 2.270 3.808     .  0 0 "[    .    1    .    2]" 1 
        745 1  34 GLN QG   1  35 LYS QD   . . 5.260 4.369 2.677 5.259     .  0 0 "[    .    1    .    2]" 1 
        746 1  34 GLN QG   1  35 LYS QG   . . 4.240 3.543 2.085 4.238     .  0 0 "[    .    1    .    2]" 1 
        747 1  35 LYS HA   1  35 LYS HG2  . . 3.850 2.820 2.269 3.679     .  0 0 "[    .    1    .    2]" 1 
        748 1  35 LYS HA   1  35 LYS QG   . . 3.350 2.479 2.194 3.322     .  0 0 "[    .    1    .    2]" 1 
        749 1  35 LYS HA   1  35 LYS HG3  . . 3.850 3.060 2.252 3.853 0.003 19 0 "[    .    1    .    2]" 1 
        750 1  35 LYS QB   1  37 SER H    . . 4.650 3.780 2.819 4.564     .  0 0 "[    .    1    .    2]" 1 
        751 1  35 LYS HB2  1  35 LYS QD   . . 3.480 2.665 2.137 3.302     .  0 0 "[    .    1    .    2]" 1 
        752 1  35 LYS HB2  1  37 SER H    . . 5.380 4.370 2.950 5.357     .  0 0 "[    .    1    .    2]" 1 
        753 1  35 LYS HB3  1  35 LYS QD   . . 3.480 2.580 2.065 3.424     .  0 0 "[    .    1    .    2]" 1 
        754 1  35 LYS HB3  1  37 SER H    . . 5.380 4.457 2.923 5.331     .  0 0 "[    .    1    .    2]" 1 
        755 1  35 LYS QE   1  35 LYS HG2  . . 3.640 2.528 2.091 3.326     .  0 0 "[    .    1    .    2]" 1 
        756 1  35 LYS QE   1  35 LYS QG   . . 3.180 2.250 2.054 2.564     .  0 0 "[    .    1    .    2]" 1 
        757 1  35 LYS QE   1  35 LYS HG3  . . 3.640 2.888 2.169 3.508     .  0 0 "[    .    1    .    2]" 1 
        758 1  35 LYS QG   1  36 GLY H    . . 5.060 4.307 3.707 4.764     .  0 0 "[    .    1    .    2]" 1 
        759 1  36 GLY H    1  37 SER H    . . 4.890 2.724 1.816 3.326     .  0 0 "[    .    1    .    2]" 1 
        760 1  37 SER H    1  37 SER QB   . . 3.680 2.527 2.239 2.928     .  0 0 "[    .    1    .    2]" 1 
        761 1  37 SER H    1  40 ARG QB   . . 5.450 4.504 4.287 4.884     .  0 0 "[    .    1    .    2]" 1 
        762 1  37 SER HA   1  40 ARG H    . . 3.610 3.430 3.079 3.597     .  0 0 "[    .    1    .    2]" 1 
        763 1  37 SER HA   1  40 ARG QB   . . 3.540 2.283 2.053 2.616     .  0 0 "[    .    1    .    2]" 1 
        764 1  37 SER HA   1  40 ARG QG   . . 4.440 3.698 2.814 4.446 0.006 18 0 "[    .    1    .    2]" 1 
        765 1  37 SER HA   1  41 LYS H    . . 5.020 4.159 3.830 4.804     .  0 0 "[    .    1    .    2]" 1 
        766 1  37 SER QB   1  38 GLY H    . . 4.240 2.835 2.209 3.653     .  0 0 "[    .    1    .    2]" 1 
        767 1  38 GLY H    1  39 ILE H    . . 4.380 2.999 2.598 3.394     .  0 0 "[    .    1    .    2]" 1 
        768 1  38 GLY QA   1  40 ARG H    . . 4.450 4.206 3.967 4.440     .  0 0 "[    .    1    .    2]" 1 
        769 1  38 GLY QA   1  41 LYS H    . . 4.350 3.969 3.774 4.106     .  0 0 "[    .    1    .    2]" 1 
        770 1  38 GLY QA   1  41 LYS QB   . . 3.940 3.604 3.159 3.955 0.015 18 0 "[    .    1    .    2]" 1 
        771 1  39 ILE H    1  39 ILE HB   . . 3.560 2.437 2.342 2.581     .  0 0 "[    .    1    .    2]" 1 
        772 1  39 ILE H    1  39 ILE MD   . . 4.510 3.732 3.523 3.959     .  0 0 "[    .    1    .    2]" 1 
        773 1  39 ILE H    1  39 ILE HG12 . . 4.180 3.566 3.133 3.841     .  0 0 "[    .    1    .    2]" 1 
        774 1  39 ILE H    1  39 ILE HG13 . . 3.980 2.393 2.022 2.741     .  0 0 "[    .    1    .    2]" 1 
        775 1  39 ILE H    1  39 ILE MG   . . 3.920 3.745 3.700 3.780     .  0 0 "[    .    1    .    2]" 1 
        776 1  39 ILE H    1  40 ARG H    . . 3.230 2.572 2.298 2.837     .  0 0 "[    .    1    .    2]" 1 
        777 1  39 ILE HA   1  39 ILE MD   . . 3.960 3.778 3.695 3.833     .  0 0 "[    .    1    .    2]" 1 
        778 1  39 ILE HA   1  39 ILE HG12 . . 3.420 2.445 2.335 2.544     .  0 0 "[    .    1    .    2]" 1 
        779 1  39 ILE HA   1  39 ILE HG13 . . 4.120 2.965 2.813 3.188     .  0 0 "[    .    1    .    2]" 1 
        780 1  39 ILE HA   1  39 ILE MG   . . 3.400 2.432 2.333 2.519     .  0 0 "[    .    1    .    2]" 1 
        781 1  39 ILE HA   1  42 MET H    . . 4.220 3.502 3.248 3.712     .  0 0 "[    .    1    .    2]" 1 
        782 1  39 ILE HA   1  42 MET HB2  . . 4.090 3.538 3.078 4.050     .  0 0 "[    .    1    .    2]" 1 
        783 1  39 ILE HA   1  42 MET QG   . . 3.980 3.397 2.692 3.883     .  0 0 "[    .    1    .    2]" 1 
        784 1  39 ILE HA   1  43 MET H    . . 4.870 4.413 4.044 4.779     .  0 0 "[    .    1    .    2]" 1 
        785 1  39 ILE HA   1  43 MET QG   . . 5.430 4.425 3.942 4.731     .  0 0 "[    .    1    .    2]" 1 
        786 1  39 ILE HA   1  50 ILE MD   . . 3.890 3.644 3.162 3.862     .  0 0 "[    .    1    .    2]" 1 
        787 1  39 ILE HA   1  50 ILE MG   . . 5.430 5.161 4.799 5.430 0.000  3 0 "[    .    1    .    2]" 1 
        788 1  39 ILE HB   1  39 ILE MD   . . 3.360 2.387 2.271 2.558     .  0 0 "[    .    1    .    2]" 1 
        789 1  39 ILE HB   1  40 ARG H    . . 4.400 2.619 2.412 2.869     .  0 0 "[    .    1    .    2]" 1 
        790 1  39 ILE HB   1  43 MET ME   . . 4.500 3.296 2.917 3.701     .  0 0 "[    .    1    .    2]" 1 
        791 1  39 ILE HB   1  50 ILE HB   . . 5.090 4.784 4.443 5.070     .  0 0 "[    .    1    .    2]" 1 
        792 1  39 ILE MD   1  39 ILE MG   . . 3.000 1.984 1.886 2.179     .  0 0 "[    .    1    .    2]" 1 
        793 1  39 ILE MD   1  40 ARG H    . . 4.870 4.623 4.411 4.882 0.012 18 0 "[    .    1    .    2]" 1 
        794 1  39 ILE MD   1  43 MET ME   . . 4.340 4.033 3.560 4.275     .  0 0 "[    .    1    .    2]" 1 
        795 1  39 ILE MD   1  43 MET QG   . . 4.770 4.687 4.536 4.772 0.002 14 0 "[    .    1    .    2]" 1 
        796 1  39 ILE MD   1  50 ILE HB   . . 3.470 3.309 3.140 3.467     .  0 0 "[    .    1    .    2]" 1 
        797 1  39 ILE HG12 1  39 ILE MG   . . 3.580 2.411 2.297 2.520     .  0 0 "[    .    1    .    2]" 1 
        798 1  39 ILE HG12 1  40 ARG H    . . 5.090 4.980 4.842 5.090 0.000  7 0 "[    .    1    .    2]" 1 
        799 1  39 ILE HG12 1  50 ILE MD   . . 3.740 3.377 2.763 3.725     .  0 0 "[    .    1    .    2]" 1 
        800 1  39 ILE HG13 1  39 ILE MG   . . 3.590 3.192 3.184 3.203     .  0 0 "[    .    1    .    2]" 1 
        801 1  39 ILE HG13 1  40 ARG H    . . 4.780 4.350 4.111 4.562     .  0 0 "[    .    1    .    2]" 1 
        802 1  39 ILE MG   1  40 ARG H    . . 3.960 3.298 2.994 3.531     .  0 0 "[    .    1    .    2]" 1 
        803 1  39 ILE MG   1  40 ARG HA   . . 4.650 3.363 3.053 3.637     .  0 0 "[    .    1    .    2]" 1 
        804 1  39 ILE MG   1  42 MET ME   . . 4.130 3.734 2.616 4.128     .  0 0 "[    .    1    .    2]" 1 
        805 1  39 ILE MG   1  43 MET ME   . . 3.450 2.098 1.769 2.364     .  0 0 "[    .    1    .    2]" 1 
        806 1  39 ILE MG   1  43 MET QG   . . 3.920 2.125 1.946 2.316     .  0 0 "[    .    1    .    2]" 1 
        807 1  39 ILE MG   1  50 ILE HB   . . 3.800 2.158 1.918 2.368     .  0 0 "[    .    1    .    2]" 1 
        808 1  39 ILE MG   1  50 ILE MD   . . 3.200 2.003 1.718 2.251     .  0 0 "[    .    1    .    2]" 1 
        809 1  39 ILE MG   1  50 ILE HG13 . . 4.620 3.509 3.115 3.734     .  0 0 "[    .    1    .    2]" 1 
        810 1  39 ILE MG   1  50 ILE MG   . . 3.410 2.723 2.312 3.017     .  0 0 "[    .    1    .    2]" 1 
        811 1  40 ARG H    1  40 ARG QB   . . 3.000 2.215 2.120 2.313     .  0 0 "[    .    1    .    2]" 1 
        812 1  40 ARG H    1  40 ARG HD2  . . 5.120 4.405 2.345 5.132 0.012 12 0 "[    .    1    .    2]" 1 
        813 1  40 ARG H    1  40 ARG QD   . . 4.510 3.918 2.071 4.467     .  0 0 "[    .    1    .    2]" 1 
        814 1  40 ARG H    1  40 ARG HD3  . . 5.120 4.560 2.305 5.129 0.009  3 0 "[    .    1    .    2]" 1 
        815 1  40 ARG H    1  40 ARG QG   . . 4.090 3.559 2.597 4.065     .  0 0 "[    .    1    .    2]" 1 
        816 1  40 ARG H    1  41 LYS H    . . 3.540 2.938 2.771 3.139     .  0 0 "[    .    1    .    2]" 1 
        817 1  40 ARG H    1  42 MET H    . . 4.880 4.518 4.192 4.764     .  0 0 "[    .    1    .    2]" 1 
        818 1  40 ARG H    1  43 MET ME   . . 4.560 3.375 3.017 3.965     .  0 0 "[    .    1    .    2]" 1 
        819 1  40 ARG HA   1  40 ARG HD2  . . 4.630 3.538 2.072 4.657 0.027  9 0 "[    .    1    .    2]" 1 
        820 1  40 ARG HA   1  40 ARG HD3  . . 4.630 3.899 2.536 4.640 0.010 15 0 "[    .    1    .    2]" 1 
        821 1  40 ARG HA   1  40 ARG QG   . . 3.630 2.423 2.169 2.648     .  0 0 "[    .    1    .    2]" 1 
        822 1  40 ARG HA   1  42 MET H    . . 4.570 4.386 3.986 4.572 0.002 20 0 "[    .    1    .    2]" 1 
        823 1  40 ARG HA   1  43 MET H    . . 3.880 3.485 3.024 3.783     .  0 0 "[    .    1    .    2]" 1 
        824 1  40 ARG HA   1  43 MET QB   . . 3.270 2.432 2.109 2.726     .  0 0 "[    .    1    .    2]" 1 
        825 1  40 ARG HA   1  43 MET ME   . . 3.210 2.144 1.802 2.663     .  0 0 "[    .    1    .    2]" 1 
        826 1  40 ARG HA   1  43 MET QG   . . 3.750 3.180 2.478 3.749     .  0 0 "[    .    1    .    2]" 1 
        827 1  40 ARG HA   1  44 ASP H    . . 4.290 4.020 3.711 4.291 0.001 20 0 "[    .    1    .    2]" 1 
        828 1  40 ARG QB   1  40 ARG HD2  . . 3.870 2.608 2.144 3.383     .  0 0 "[    .    1    .    2]" 1 
        829 1  40 ARG QB   1  40 ARG QD   . . 3.400 2.210 2.081 2.580     .  0 0 "[    .    1    .    2]" 1 
        830 1  40 ARG QB   1  40 ARG HD3  . . 3.870 2.540 2.206 3.401     .  0 0 "[    .    1    .    2]" 1 
        831 1  40 ARG QB   1  41 LYS H    . . 3.050 2.498 2.143 2.934     .  0 0 "[    .    1    .    2]" 1 
        832 1  40 ARG QG   1  41 LYS H    . . 4.770 4.017 3.400 4.478     .  0 0 "[    .    1    .    2]" 1 
        833 1  41 LYS H    1  41 LYS QB   . . 3.240 2.282 2.227 2.541     .  0 0 "[    .    1    .    2]" 1 
        834 1  41 LYS H    1  41 LYS QD   . . 5.070 4.264 3.523 4.611     .  0 0 "[    .    1    .    2]" 1 
        835 1  41 LYS H    1  41 LYS HG2  . . 4.900 4.185 2.238 4.638     .  0 0 "[    .    1    .    2]" 1 
        836 1  41 LYS H    1  41 LYS QG   . . 4.210 3.729 2.192 4.072     .  0 0 "[    .    1    .    2]" 1 
        837 1  41 LYS H    1  41 LYS HG3  . . 4.900 4.265 2.813 4.643     .  0 0 "[    .    1    .    2]" 1 
        838 1  41 LYS H    1  42 MET H    . . 3.540 2.931 2.655 3.118     .  0 0 "[    .    1    .    2]" 1 
        839 1  41 LYS H    1  43 MET H    . . 4.730 4.494 4.087 4.729     .  0 0 "[    .    1    .    2]" 1 
        840 1  41 LYS H    1  44 ASP H    . . 4.930 4.830 4.726 4.938 0.008 16 0 "[    .    1    .    2]" 1 
        841 1  41 LYS HA   1  41 LYS QD   . . 4.320 3.509 2.070 4.356 0.036  4 0 "[    .    1    .    2]" 1 
        842 1  41 LYS HA   1  41 LYS QE   . . 5.500 4.535 3.479 5.507 0.007 18 0 "[    .    1    .    2]" 1 
        843 1  41 LYS HA   1  41 LYS HG2  . . 3.890 3.483 2.673 3.891 0.001  9 0 "[    .    1    .    2]" 1 
        844 1  41 LYS HA   1  41 LYS HG3  . . 3.890 2.959 2.393 3.775     .  0 0 "[    .    1    .    2]" 1 
        845 1  41 LYS HA   1  43 MET H    . . 5.500 4.950 4.373 5.206     .  0 0 "[    .    1    .    2]" 1 
        846 1  41 LYS HA   1  44 ASP H    . . 4.010 3.859 3.612 4.016 0.006  2 0 "[    .    1    .    2]" 1 
        847 1  41 LYS HA   1  44 ASP HB2  . . 3.710 3.037 2.903 3.169     .  0 0 "[    .    1    .    2]" 1 
        848 1  41 LYS HA   1  44 ASP HB3  . . 4.510 4.444 4.331 4.523 0.013 20 0 "[    .    1    .    2]" 1 
        849 1  41 LYS HA   1  45 GLU H    . . 5.110 4.262 3.869 4.759     .  0 0 "[    .    1    .    2]" 1 
        850 1  41 LYS QB   1  41 LYS QD   . . 3.280 2.166 2.042 2.509     .  0 0 "[    .    1    .    2]" 1 
        851 1  41 LYS QB   1  41 LYS QE   . . 3.850 3.287 2.138 3.823     .  0 0 "[    .    1    .    2]" 1 
        852 1  41 LYS QB   1  42 MET H    . . 3.330 2.577 2.200 3.400 0.070 18 0 "[    .    1    .    2]" 1 
        853 1  41 LYS QB   1  44 ASP HB2  . . 5.060 4.927 4.631 5.046     .  0 0 "[    .    1    .    2]" 1 
        854 1  41 LYS QD   1  42 MET H    . . 4.890 4.356 2.540 4.874     .  0 0 "[    .    1    .    2]" 1 
        855 1  41 LYS QE   1  41 LYS HG2  . . 3.920 2.575 2.118 3.285     .  0 0 "[    .    1    .    2]" 1 
        856 1  41 LYS QE   1  41 LYS QG   . . 3.370 2.150 2.018 2.290     .  0 0 "[    .    1    .    2]" 1 
        857 1  41 LYS QE   1  41 LYS HG3  . . 3.920 2.622 2.074 3.352     .  0 0 "[    .    1    .    2]" 1 
        858 1  41 LYS QG   1  42 MET H    . . 4.260 3.122 1.844 3.783     .  0 0 "[    .    1    .    2]" 1 
        859 1  41 LYS QG   1  42 MET HA   . . 3.910 3.452 3.161 3.908     .  0 0 "[    .    1    .    2]" 1 
        860 1  41 LYS HG2  1  42 MET H    . . 4.950 3.599 1.900 4.312     .  0 0 "[    .    1    .    2]" 1 
        861 1  41 LYS HG3  1  42 MET H    . . 4.950 3.797 1.880 4.890     .  0 0 "[    .    1    .    2]" 1 
        862 1  42 MET H    1  42 MET HB2  . . 3.420 2.545 2.473 2.698     .  0 0 "[    .    1    .    2]" 1 
        863 1  42 MET H    1  42 MET HB3  . . 3.710 3.595 3.580 3.623     .  0 0 "[    .    1    .    2]" 1 
        864 1  42 MET H    1  42 MET HG2  . . 4.070 3.352 2.554 3.772     .  0 0 "[    .    1    .    2]" 1 
        865 1  42 MET H    1  42 MET QG   . . 3.350 2.175 1.957 2.314     .  0 0 "[    .    1    .    2]" 1 
        866 1  42 MET H    1  42 MET HG3  . . 4.070 2.222 1.970 2.420     .  0 0 "[    .    1    .    2]" 1 
        867 1  42 MET H    1  43 MET H    . . 3.440 2.733 2.430 2.919     .  0 0 "[    .    1    .    2]" 1 
        868 1  42 MET H    1  44 ASP H    . . 4.600 3.974 3.763 4.201     .  0 0 "[    .    1    .    2]" 1 
        869 1  42 MET H    1  50 ILE MD   . . 5.020 4.632 4.215 4.993     .  0 0 "[    .    1    .    2]" 1 
        870 1  42 MET HA   1  42 MET HG2  . . 3.700 2.700 2.407 2.899     .  0 0 "[    .    1    .    2]" 1 
        871 1  42 MET HA   1  42 MET QG   . . 3.240 2.488 2.363 2.602     .  0 0 "[    .    1    .    2]" 1 
        872 1  42 MET HA   1  42 MET HG3  . . 3.700 3.057 2.720 3.583     .  0 0 "[    .    1    .    2]" 1 
        873 1  42 MET HA   1  44 ASP H    . . 4.540 4.051 3.805 4.482     .  0 0 "[    .    1    .    2]" 1 
        874 1  42 MET HA   1  45 GLU H    . . 3.520 3.137 2.906 3.400     .  0 0 "[    .    1    .    2]" 1 
        875 1  42 MET HA   1  45 GLU HB2  . . 3.960 3.614 3.276 3.984 0.024 20 0 "[    .    1    .    2]" 1 
        876 1  42 MET HA   1  45 GLU QB   . . 3.480 2.358 2.193 2.579     .  0 0 "[    .    1    .    2]" 1 
        877 1  42 MET HA   1  45 GLU HB3  . . 3.960 2.392 2.215 2.612     .  0 0 "[    .    1    .    2]" 1 
        878 1  42 MET HA   1  45 GLU HG2  . . 4.270 3.818 1.993 4.269     .  0 0 "[    .    1    .    2]" 1 
        879 1  42 MET HA   1  45 GLU HG3  . . 5.070 4.749 3.621 5.065     .  0 0 "[    .    1    .    2]" 1 
        880 1  42 MET HA   1  46 PHE H    . . 3.720 3.267 2.855 3.722 0.002 14 0 "[    .    1    .    2]" 1 
        881 1  42 MET HA   1  46 PHE QD   . . 4.130 2.942 2.337 3.419     .  0 0 "[    .    1    .    2]" 1 
        882 1  42 MET HA   1  46 PHE QE   . . 4.170 3.504 3.031 3.850     .  0 0 "[    .    1    .    2]" 1 
        883 1  42 MET HB2  1  43 MET H    . . 3.700 2.325 2.095 2.751     .  0 0 "[    .    1    .    2]" 1 
        884 1  42 MET HB2  1  43 MET HA   . . 4.200 4.143 3.954 4.214 0.014 14 0 "[    .    1    .    2]" 1 
        885 1  42 MET HB2  1  43 MET QG   . . 4.760 3.469 3.236 3.752     .  0 0 "[    .    1    .    2]" 1 
        886 1  42 MET HB2  1  44 ASP H    . . 5.310 4.737 4.513 5.075     .  0 0 "[    .    1    .    2]" 1 
        887 1  42 MET HB2  1  45 GLU H    . . 5.500 5.222 4.990 5.495     .  0 0 "[    .    1    .    2]" 1 
        888 1  42 MET HB2  1  46 PHE H    . . 5.500 5.165 4.899 5.478     .  0 0 "[    .    1    .    2]" 1 
        889 1  42 MET HB2  1  46 PHE QD   . . 4.860 3.813 3.441 4.260     .  0 0 "[    .    1    .    2]" 1 
        890 1  42 MET HB2  1  48 VAL MG2  . . 4.450 4.333 4.058 4.457 0.007 20 0 "[    .    1    .    2]" 1 
        891 1  42 MET HB2  1  50 ILE MD   . . 3.690 2.633 2.260 2.938     .  0 0 "[    .    1    .    2]" 1 
        892 1  42 MET HB2  1  50 ILE HG13 . . 5.290 4.527 4.162 4.837     .  0 0 "[    .    1    .    2]" 1 
        893 1  42 MET HB2  1  50 ILE MG   . . 5.500 5.427 5.216 5.500 0.000 20 0 "[    .    1    .    2]" 1 
        894 1  42 MET HB2  1  74 ALA MB   . . 5.020 4.940 4.623 5.025 0.005 13 0 "[    .    1    .    2]" 1 
        895 1  42 MET HB3  1  43 MET H    . . 3.870 3.457 3.211 3.872 0.002 12 0 "[    .    1    .    2]" 1 
        896 1  42 MET HB3  1  46 PHE QD   . . 4.270 2.248 2.018 2.703     .  0 0 "[    .    1    .    2]" 1 
        897 1  42 MET HB3  1  48 VAL MG2  . . 5.130 3.897 3.407 4.349     .  0 0 "[    .    1    .    2]" 1 
        898 1  42 MET HB3  1  50 ILE MD   . . 4.190 3.150 2.801 3.546     .  0 0 "[    .    1    .    2]" 1 
        899 1  42 MET ME   1  42 MET HG2  . . 3.880 2.651 2.176 3.379     .  0 0 "[    .    1    .    2]" 1 
        900 1  42 MET ME   1  42 MET QG   . . 3.320 2.360 2.148 2.603     .  0 0 "[    .    1    .    2]" 1 
        901 1  42 MET ME   1  42 MET HG3  . . 3.880 3.128 2.411 3.400     .  0 0 "[    .    1    .    2]" 1 
        902 1  42 MET ME   1  50 ILE MD   . . 3.480 1.987 1.777 2.298     .  0 0 "[    .    1    .    2]" 1 
        903 1  42 MET ME   1  50 ILE HG12 . . 5.240 4.001 3.585 4.275     .  0 0 "[    .    1    .    2]" 1 
        904 1  42 MET ME   1  50 ILE HG13 . . 4.950 4.199 3.721 4.655     .  0 0 "[    .    1    .    2]" 1 
        905 1  42 MET ME   1  50 ILE MG   . . 4.370 3.963 3.619 4.278     .  0 0 "[    .    1    .    2]" 1 
        906 1  42 MET ME   1  74 ALA HA   . . 4.060 3.784 3.269 4.060     .  0 0 "[    .    1    .    2]" 1 
        907 1  42 MET ME   1  74 ALA MB   . . 4.440 3.476 2.961 3.757     .  0 0 "[    .    1    .    2]" 1 
        908 1  42 MET ME   1  77 GLY HA2  . . 5.050 4.886 4.646 5.053 0.003 13 0 "[    .    1    .    2]" 1 
        909 1  42 MET ME   1  78 LEU H    . . 4.380 3.121 2.733 3.453     .  0 0 "[    .    1    .    2]" 1 
        910 1  42 MET ME   1  78 LEU HA   . . 3.170 2.930 2.571 3.169     .  0 0 "[    .    1    .    2]" 1 
        911 1  42 MET ME   1  78 LEU QB   . . 4.540 2.544 2.130 2.862     .  0 0 "[    .    1    .    2]" 1 
        912 1  42 MET ME   1  78 LEU MD1  . . 3.020 2.068 1.789 2.497     .  0 0 "[    .    1    .    2]" 1 
        913 1  42 MET ME   1  78 LEU MD2  . . 3.690 3.518 3.049 3.691 0.001  5 0 "[    .    1    .    2]" 1 
        914 1  42 MET ME   1  78 LEU HG   . . 4.770 4.334 4.004 4.511     .  0 0 "[    .    1    .    2]" 1 
        915 1  42 MET QG   1  43 MET H    . . 4.480 3.920 3.604 4.046     .  0 0 "[    .    1    .    2]" 1 
        916 1  42 MET QG   1  46 PHE QD   . . 4.900 3.633 2.875 4.222     .  0 0 "[    .    1    .    2]" 1 
        917 1  42 MET QG   1  46 PHE QE   . . 3.840 2.892 2.452 3.375     .  0 0 "[    .    1    .    2]" 1 
        918 1  42 MET QG   1  50 ILE MD   . . 4.550 3.857 3.591 4.120     .  0 0 "[    .    1    .    2]" 1 
        919 1  42 MET HG2  1  46 PHE QE   . . 4.510 2.938 2.472 3.484     .  0 0 "[    .    1    .    2]" 1 
        920 1  42 MET HG3  1  46 PHE QE   . . 4.510 4.395 4.071 4.519 0.009 20 0 "[    .    1    .    2]" 1 
        921 1  43 MET H    1  43 MET QB   . . 3.400 2.445 2.236 2.681     .  0 0 "[    .    1    .    2]" 1 
        922 1  43 MET H    1  43 MET ME   . . 4.320 3.794 3.500 3.990     .  0 0 "[    .    1    .    2]" 1 
        923 1  43 MET H    1  43 MET QG   . . 3.420 2.305 2.040 2.678     .  0 0 "[    .    1    .    2]" 1 
        924 1  43 MET H    1  44 ASP H    . . 3.560 2.802 2.595 2.992     .  0 0 "[    .    1    .    2]" 1 
        925 1  43 MET H    1  45 GLU H    . . 4.740 4.157 3.914 4.432     .  0 0 "[    .    1    .    2]" 1 
        926 1  43 MET H    1  48 VAL MG2  . . 4.620 4.181 3.964 4.485     .  0 0 "[    .    1    .    2]" 1 
        927 1  43 MET H    1  50 ILE MD   . . 4.170 3.638 2.973 4.057     .  0 0 "[    .    1    .    2]" 1 
        928 1  43 MET HA   1  43 MET QG   . . 3.590 2.309 2.159 2.472     .  0 0 "[    .    1    .    2]" 1 
        929 1  43 MET HA   1  46 PHE HB2  . . 4.850 3.925 3.790 4.142     .  0 0 "[    .    1    .    2]" 1 
        930 1  43 MET HA   1  46 PHE HB3  . . 5.500 5.488 5.438 5.515 0.015 20 0 "[    .    1    .    2]" 1 
        931 1  43 MET HA   1  48 VAL H    . . 3.840 2.402 2.114 2.807     .  0 0 "[    .    1    .    2]" 1 
        932 1  43 MET HA   1  48 VAL MG2  . . 3.640 2.387 2.161 2.584     .  0 0 "[    .    1    .    2]" 1 
        933 1  43 MET QB   1  43 MET ME   . . 3.150 2.367 1.943 2.691     .  0 0 "[    .    1    .    2]" 1 
        934 1  43 MET QB   1  44 ASP H    . . 3.770 2.750 2.430 2.932     .  0 0 "[    .    1    .    2]" 1 
        935 1  43 MET QB   1  44 ASP HB2  . . 5.190 4.316 4.196 4.453     .  0 0 "[    .    1    .    2]" 1 
        936 1  43 MET QB   1  44 ASP HB3  . . 5.500 5.414 5.322 5.479     .  0 0 "[    .    1    .    2]" 1 
        937 1  43 MET QB   1  48 VAL H    . . 4.640 3.833 3.488 4.298     .  0 0 "[    .    1    .    2]" 1 
        938 1  43 MET ME   1  43 MET QG   . . 3.430 2.254 2.083 2.491     .  0 0 "[    .    1    .    2]" 1 
        939 1  43 MET ME   1  44 ASP H    . . 5.500 4.758 4.171 5.171     .  0 0 "[    .    1    .    2]" 1 
        940 1  43 MET ME   1  49 ASN HA   . . 4.410 4.167 3.986 4.377     .  0 0 "[    .    1    .    2]" 1 
        941 1  43 MET ME   1  50 ILE H    . . 4.250 3.691 3.229 3.890     .  0 0 "[    .    1    .    2]" 1 
        942 1  43 MET ME   1  50 ILE HB   . . 4.230 3.968 3.468 4.226     .  0 0 "[    .    1    .    2]" 1 
        943 1  43 MET ME   1  50 ILE HG13 . . 5.500 4.947 4.468 5.192     .  0 0 "[    .    1    .    2]" 1 
        944 1  43 MET ME   1  50 ILE MG   . . 5.500 4.878 4.440 5.142     .  0 0 "[    .    1    .    2]" 1 
        945 1  43 MET QG   1  48 VAL H    . . 4.920 4.135 3.845 4.412     .  0 0 "[    .    1    .    2]" 1 
        946 1  43 MET QG   1  48 VAL MG2  . . 4.060 3.015 2.654 3.391     .  0 0 "[    .    1    .    2]" 1 
        947 1  43 MET QG   1  49 ASN HA   . . 4.800 2.695 2.180 3.252     .  0 0 "[    .    1    .    2]" 1 
        948 1  43 MET QG   1  50 ILE H    . . 4.200 2.458 2.061 2.900     .  0 0 "[    .    1    .    2]" 1 
        949 1  43 MET QG   1  50 ILE HB   . . 4.300 3.168 2.970 3.334     .  0 0 "[    .    1    .    2]" 1 
        950 1  43 MET QG   1  50 ILE MD   . . 3.600 2.872 2.359 3.300     .  0 0 "[    .    1    .    2]" 1 
        951 1  43 MET QG   1  50 ILE HG12 . . 4.980 4.228 3.928 4.468     .  0 0 "[    .    1    .    2]" 1 
        952 1  43 MET QG   1  50 ILE HG13 . . 4.450 2.666 2.356 2.917     .  0 0 "[    .    1    .    2]" 1 
        953 1  43 MET QG   1  50 ILE MG   . . 4.530 4.365 4.228 4.531 0.001 18 0 "[    .    1    .    2]" 1 
        954 1  44 ASP H    1  44 ASP HB2  . . 3.470 2.218 2.182 2.269     .  0 0 "[    .    1    .    2]" 1 
        955 1  44 ASP H    1  44 ASP HB3  . . 3.570 3.505 3.485 3.550     .  0 0 "[    .    1    .    2]" 1 
        956 1  44 ASP H    1  45 GLU HA   . . 5.240 5.029 4.903 5.230     .  0 0 "[    .    1    .    2]" 1 
        957 1  44 ASP HA   1  46 PHE H    . . 5.460 5.039 4.703 5.282     .  0 0 "[    .    1    .    2]" 1 
        958 1  44 ASP HA   1  47 GLU H    . . 4.560 3.670 3.413 3.912     .  0 0 "[    .    1    .    2]" 1 
        959 1  44 ASP HA   1  47 GLU HA   . . 4.980 3.344 3.109 3.634     .  0 0 "[    .    1    .    2]" 1 
        960 1  44 ASP HA   1  47 GLU QB   . . 5.500 5.136 4.946 5.322     .  0 0 "[    .    1    .    2]" 1 
        961 1  44 ASP HA   1  47 GLU QG   . . 5.340 3.858 3.542 4.123     .  0 0 "[    .    1    .    2]" 1 
        962 1  44 ASP HA   1  48 VAL H    . . 5.270 4.772 4.518 5.164     .  0 0 "[    .    1    .    2]" 1 
        963 1  44 ASP HB2  1  45 GLU H    . . 3.730 2.943 2.686 3.184     .  0 0 "[    .    1    .    2]" 1 
        964 1  44 ASP HB2  1  45 GLU HA   . . 4.890 4.740 4.590 4.859     .  0 0 "[    .    1    .    2]" 1 
        965 1  44 ASP HB3  1  45 GLU H    . . 3.680 3.465 3.129 3.662     .  0 0 "[    .    1    .    2]" 1 
        966 1  44 ASP HB3  1  45 GLU HA   . . 5.010 4.141 3.996 4.242     .  0 0 "[    .    1    .    2]" 1 
        967 1  45 GLU H    1  45 GLU HB2  . . 3.490 2.805 2.483 3.541 0.051 20 0 "[    .    1    .    2]" 1 
        968 1  45 GLU H    1  45 GLU QB   . . 2.950 2.237 2.150 2.284     .  0 0 "[    .    1    .    2]" 1 
        969 1  45 GLU H    1  45 GLU HB3  . . 3.490 2.382 2.220 2.566     .  0 0 "[    .    1    .    2]" 1 
        970 1  45 GLU H    1  45 GLU HG2  . . 4.820 4.326 2.746 4.617     .  0 0 "[    .    1    .    2]" 1 
        971 1  45 GLU H    1  45 GLU HG3  . . 4.450 4.334 3.836 4.436     .  0 0 "[    .    1    .    2]" 1 
        972 1  45 GLU H    1  46 PHE H    . . 3.440 2.700 2.577 2.927     .  0 0 "[    .    1    .    2]" 1 
        973 1  45 GLU H    1  47 GLU H    . . 4.470 3.470 3.272 3.692     .  0 0 "[    .    1    .    2]" 1 
        974 1  45 GLU HA   1  45 GLU HG2  . . 4.000 3.799 3.659 3.875     .  0 0 "[    .    1    .    2]" 1 
        975 1  45 GLU HA   1  45 GLU HG3  . . 3.700 2.945 2.683 3.539     .  0 0 "[    .    1    .    2]" 1 
        976 1  45 GLU HA   1  47 GLU H    . . 4.930 3.907 3.694 4.227     .  0 0 "[    .    1    .    2]" 1 
        977 1  45 GLU QB   1  46 PHE H    . . 3.430 2.358 2.110 3.236     .  0 0 "[    .    1    .    2]" 1 
        978 1  45 GLU QB   1  46 PHE QD   . . 4.610 3.518 3.122 4.203     .  0 0 "[    .    1    .    2]" 1 
        979 1  45 GLU QB   1  46 PHE QE   . . 4.670 4.045 3.757 4.413     .  0 0 "[    .    1    .    2]" 1 
        980 1  45 GLU HB2  1  46 PHE H    . . 3.950 3.741 3.612 3.941     .  0 0 "[    .    1    .    2]" 1 
        981 1  45 GLU HB2  1  46 PHE QD   . . 5.470 5.045 4.766 5.330     .  0 0 "[    .    1    .    2]" 1 
        982 1  45 GLU HB2  1  46 PHE QE   . . 5.470 5.343 4.939 5.469     .  0 0 "[    .    1    .    2]" 1 
        983 1  45 GLU HB3  1  46 PHE H    . . 3.950 2.400 2.125 3.474     .  0 0 "[    .    1    .    2]" 1 
        984 1  45 GLU HB3  1  46 PHE QD   . . 5.470 3.612 3.161 4.584     .  0 0 "[    .    1    .    2]" 1 
        985 1  45 GLU HB3  1  46 PHE QE   . . 5.470 4.211 3.867 4.969     .  0 0 "[    .    1    .    2]" 1 
        986 1  45 GLU HG2  1  46 PHE H    . . 4.680 3.511 1.902 4.142     .  0 0 "[    .    1    .    2]" 1 
        987 1  45 GLU HG2  1  46 PHE QD   . . 4.410 3.803 2.169 4.342     .  0 0 "[    .    1    .    2]" 1 
        988 1  45 GLU HG2  1  46 PHE QE   . . 4.520 3.716 3.126 4.079     .  0 0 "[    .    1    .    2]" 1 
        989 1  45 GLU HG3  1  46 PHE H    . . 4.530 3.296 2.458 3.883     .  0 0 "[    .    1    .    2]" 1 
        990 1  45 GLU HG3  1  46 PHE QE   . . 4.760 4.249 3.385 4.745     .  0 0 "[    .    1    .    2]" 1 
        991 1  46 PHE H    1  46 PHE HB2  . . 3.560 2.487 2.384 2.580     .  0 0 "[    .    1    .    2]" 1 
        992 1  46 PHE H    1  46 PHE HB3  . . 3.860 3.620 3.591 3.653     .  0 0 "[    .    1    .    2]" 1 
        993 1  46 PHE H    1  46 PHE QD   . . 3.880 2.768 2.505 3.064     .  0 0 "[    .    1    .    2]" 1 
        994 1  46 PHE H    1  46 PHE QE   . . 4.990 4.453 4.260 4.605     .  0 0 "[    .    1    .    2]" 1 
        995 1  46 PHE H    1  47 GLU QB   . . 5.500 5.209 4.983 5.365     .  0 0 "[    .    1    .    2]" 1 
        996 1  46 PHE H    1  48 VAL H    . . 4.730 4.006 3.627 4.334     .  0 0 "[    .    1    .    2]" 1 
        997 1  46 PHE H    1  48 VAL MG2  . . 4.600 3.680 3.471 4.194     .  0 0 "[    .    1    .    2]" 1 
        998 1  46 PHE HA   1  46 PHE QD   . . 3.700 2.574 2.372 2.740     .  0 0 "[    .    1    .    2]" 1 
        999 1  46 PHE HA   1  73 ARG QB   . . 4.610 4.330 3.810 4.607     .  0 0 "[    .    1    .    2]" 1 
       1000 1  46 PHE HB2  1  47 GLU H    . . 4.710 3.530 3.228 3.792     .  0 0 "[    .    1    .    2]" 1 
       1001 1  46 PHE HB2  1  48 VAL H    . . 4.790 3.320 2.859 3.641     .  0 0 "[    .    1    .    2]" 1 
       1002 1  46 PHE HB2  1  48 VAL MG1  . . 4.210 3.049 2.236 3.793     .  0 0 "[    .    1    .    2]" 1 
       1003 1  46 PHE HB2  1  48 VAL MG2  . . 3.830 2.033 1.921 2.391     .  0 0 "[    .    1    .    2]" 1 
       1004 1  46 PHE HB2  1  74 ALA MB   . . 4.040 2.692 2.464 2.963     .  0 0 "[    .    1    .    2]" 1 
       1005 1  46 PHE HB3  1  47 GLU H    . . 4.800 4.278 4.122 4.443     .  0 0 "[    .    1    .    2]" 1 
       1006 1  46 PHE HB3  1  48 VAL H    . . 5.110 4.297 3.819 4.634     .  0 0 "[    .    1    .    2]" 1 
       1007 1  46 PHE HB3  1  48 VAL MG1  . . 4.090 2.617 2.095 3.224     .  0 0 "[    .    1    .    2]" 1 
       1008 1  46 PHE HB3  1  48 VAL MG2  . . 4.020 2.802 2.354 3.219     .  0 0 "[    .    1    .    2]" 1 
       1009 1  46 PHE HB3  1  70 ASN HB2  . . 4.970 4.791 4.376 4.971 0.001  1 0 "[    .    1    .    2]" 1 
       1010 1  46 PHE HB3  1  74 ALA H    . . 5.040 3.489 3.224 3.699     .  0 0 "[    .    1    .    2]" 1 
       1011 1  46 PHE HB3  1  74 ALA MB   . . 3.800 2.556 1.994 3.040     .  0 0 "[    .    1    .    2]" 1 
       1012 1  46 PHE QD   1  48 VAL MG1  . . 4.990 4.278 3.845 4.709     .  0 0 "[    .    1    .    2]" 1 
       1013 1  46 PHE QD   1  48 VAL MG2  . . 4.550 3.271 2.965 3.624     .  0 0 "[    .    1    .    2]" 1 
       1014 1  46 PHE QD   1  50 ILE MD   . . 4.940 4.395 4.025 4.811     .  0 0 "[    .    1    .    2]" 1 
       1015 1  46 PHE QD   1  73 ARG QB   . . 4.230 2.131 1.966 2.634     .  0 0 "[    .    1    .    2]" 1 
       1016 1  46 PHE QD   1  73 ARG QD   . . 4.180 2.657 1.962 3.779     .  0 0 "[    .    1    .    2]" 1 
       1017 1  46 PHE QD   1  73 ARG HG2  . . 4.860 4.236 3.501 4.859     .  0 0 "[    .    1    .    2]" 1 
       1018 1  46 PHE QD   1  73 ARG QG   . . 4.280 3.004 2.026 3.701     .  0 0 "[    .    1    .    2]" 1 
       1019 1  46 PHE QD   1  73 ARG HG3  . . 4.860 3.097 2.039 3.856     .  0 0 "[    .    1    .    2]" 1 
       1020 1  46 PHE QD   1  74 ALA H    . . 4.740 3.570 3.154 4.116     .  0 0 "[    .    1    .    2]" 1 
       1021 1  46 PHE QD   1  74 ALA HA   . . 4.360 2.957 2.673 3.243     .  0 0 "[    .    1    .    2]" 1 
       1022 1  46 PHE QD   1  74 ALA MB   . . 4.040 2.855 2.415 3.266     .  0 0 "[    .    1    .    2]" 1 
       1023 1  46 PHE QE   1  73 ARG HA   . . 5.080 3.855 3.463 4.286     .  0 0 "[    .    1    .    2]" 1 
       1024 1  46 PHE QE   1  73 ARG QB   . . 4.210 2.215 1.970 2.633     .  0 0 "[    .    1    .    2]" 1 
       1025 1  46 PHE QE   1  73 ARG QD   . . 4.020 3.579 3.168 3.974     .  0 0 "[    .    1    .    2]" 1 
       1026 1  46 PHE QE   1  73 ARG HG2  . . 5.170 4.902 4.638 5.163     .  0 0 "[    .    1    .    2]" 1 
       1027 1  46 PHE QE   1  73 ARG QG   . . 4.450 4.056 3.643 4.442     .  0 0 "[    .    1    .    2]" 1 
       1028 1  46 PHE QE   1  73 ARG HG3  . . 5.170 4.397 3.763 5.024     .  0 0 "[    .    1    .    2]" 1 
       1029 1  46 PHE QE   1  74 ALA HA   . . 4.430 3.085 2.652 3.450     .  0 0 "[    .    1    .    2]" 1 
       1030 1  46 PHE QE   1  74 ALA MB   . . 5.060 3.968 3.623 4.289     .  0 0 "[    .    1    .    2]" 1 
       1031 1  46 PHE QE   1  77 GLY H    . . 4.550 4.307 4.076 4.547     .  0 0 "[    .    1    .    2]" 1 
       1032 1  46 PHE QE   1  77 GLY HA2  . . 5.010 4.785 4.276 4.993     .  0 0 "[    .    1    .    2]" 1 
       1033 1  46 PHE QE   1  77 GLY HA3  . . 4.270 3.428 2.896 3.715     .  0 0 "[    .    1    .    2]" 1 
       1034 1  47 GLU H    1  47 GLU QB   . . 3.800 3.259 3.113 3.390     .  0 0 "[    .    1    .    2]" 1 
       1035 1  47 GLU H    1  47 GLU HG2  . . 3.970 3.422 2.547 3.826     .  0 0 "[    .    1    .    2]" 1 
       1036 1  47 GLU H    1  47 GLU QG   . . 3.420 2.739 2.516 3.036     .  0 0 "[    .    1    .    2]" 1 
       1037 1  47 GLU H    1  47 GLU HG3  . . 3.970 2.978 2.556 3.988 0.018  2 0 "[    .    1    .    2]" 1 
       1038 1  47 GLU H    1  48 VAL H    . . 3.480 2.840 2.627 3.113     .  0 0 "[    .    1    .    2]" 1 
       1039 1  47 GLU H    1  48 VAL MG2  . . 4.790 3.754 3.327 4.262     .  0 0 "[    .    1    .    2]" 1 
       1040 1  47 GLU HA   1  47 GLU HG2  . . 3.700 2.494 2.257 2.843     .  0 0 "[    .    1    .    2]" 1 
       1041 1  47 GLU HA   1  47 GLU QG   . . 2.910 2.378 2.211 2.546     .  0 0 "[    .    1    .    2]" 1 
       1042 1  47 GLU HA   1  47 GLU HG3  . . 3.700 3.103 2.733 3.718 0.018  2 0 "[    .    1    .    2]" 1 
       1043 1  47 GLU HA   1  48 VAL H    . . 3.150 2.745 2.629 2.954     .  0 0 "[    .    1    .    2]" 1 
       1044 1  47 GLU QB   1  48 VAL H    . . 4.000 3.864 3.755 3.903     .  0 0 "[    .    1    .    2]" 1 
       1045 1  47 GLU QB   1  70 ASN HD21 . . 4.110 3.707 3.159 3.994     .  0 0 "[    .    1    .    2]" 1 
       1046 1  47 GLU QB   1  70 ASN QD   . . 3.520 3.330 2.966 3.520 0.000  2 0 "[    .    1    .    2]" 1 
       1047 1  47 GLU QB   1  70 ASN HD22 . . 4.110 3.791 3.435 3.995     .  0 0 "[    .    1    .    2]" 1 
       1048 1  47 GLU QG   1  48 VAL H    . . 5.180 4.533 4.498 4.611     .  0 0 "[    .    1    .    2]" 1 
       1049 1  48 VAL H    1  48 VAL MG1  . . 3.910 3.071 2.694 3.422     .  0 0 "[    .    1    .    2]" 1 
       1050 1  48 VAL H    1  48 VAL MG2  . . 3.400 2.025 1.876 2.310     .  0 0 "[    .    1    .    2]" 1 
       1051 1  48 VAL H    1  49 ASN H    . . 4.660 4.419 4.389 4.466     .  0 0 "[    .    1    .    2]" 1 
       1052 1  48 VAL HA   1  48 VAL MG1  . . 3.400 2.228 2.015 2.406     .  0 0 "[    .    1    .    2]" 1 
       1053 1  48 VAL HA   1  49 ASN H    . . 3.050 2.597 2.540 2.650     .  0 0 "[    .    1    .    2]" 1 
       1054 1  48 VAL HA   1  49 ASN QB   . . 4.480 4.293 3.967 4.480     .  0 0 "[    .    1    .    2]" 1 
       1055 1  48 VAL HA   1  66 GLY HA2  . . 4.750 4.033 3.825 4.181     .  0 0 "[    .    1    .    2]" 1 
       1056 1  48 VAL HA   1  66 GLY HA3  . . 4.750 3.674 3.465 3.933     .  0 0 "[    .    1    .    2]" 1 
       1057 1  48 VAL HA   1  67 LEU H    . . 5.440 5.067 4.882 5.278     .  0 0 "[    .    1    .    2]" 1 
       1058 1  48 VAL HB   1  49 ASN H    . . 3.210 2.004 1.900 2.151     .  0 0 "[    .    1    .    2]" 1 
       1059 1  48 VAL HB   1  49 ASN QB   . . 4.620 4.387 4.237 4.514     .  0 0 "[    .    1    .    2]" 1 
       1060 1  48 VAL HB   1  50 ILE HG13 . . 5.350 4.349 3.914 5.018     .  0 0 "[    .    1    .    2]" 1 
       1061 1  48 VAL HB   1  64 ILE MG   . . 3.410 2.748 2.580 2.938     .  0 0 "[    .    1    .    2]" 1 
       1062 1  48 VAL HB   1  65 THR H    . . 4.450 4.204 3.744 4.433     .  0 0 "[    .    1    .    2]" 1 
       1063 1  48 VAL HB   1  66 GLY QA   . . 4.420 3.304 2.890 3.711     .  0 0 "[    .    1    .    2]" 1 
       1064 1  48 VAL HB   1  71 LEU HA   . . 5.150 4.800 4.536 5.107     .  0 0 "[    .    1    .    2]" 1 
       1065 1  48 VAL HB   1  71 LEU MD2  . . 4.110 3.692 3.426 4.001     .  0 0 "[    .    1    .    2]" 1 
       1066 1  48 VAL HB   1  74 ALA MB   . . 4.660 3.767 3.533 3.979     .  0 0 "[    .    1    .    2]" 1 
       1067 1  48 VAL MG1  1  49 ASN H    . . 3.800 3.427 3.057 3.713     .  0 0 "[    .    1    .    2]" 1 
       1068 1  48 VAL MG1  1  66 GLY HA2  . . 3.760 3.486 2.932 3.748     .  0 0 "[    .    1    .    2]" 1 
       1069 1  48 VAL MG1  1  66 GLY QA   . . 3.290 2.229 1.942 2.578     .  0 0 "[    .    1    .    2]" 1 
       1070 1  48 VAL MG1  1  66 GLY HA3  . . 3.760 2.257 1.966 2.629     .  0 0 "[    .    1    .    2]" 1 
       1071 1  48 VAL MG1  1  70 ASN HA   . . 4.580 3.683 3.389 4.027     .  0 0 "[    .    1    .    2]" 1 
       1072 1  48 VAL MG1  1  70 ASN HB2  . . 3.760 2.264 1.969 2.559     .  0 0 "[    .    1    .    2]" 1 
       1073 1  48 VAL MG1  1  70 ASN HB3  . . 3.670 1.941 1.843 2.086     .  0 0 "[    .    1    .    2]" 1 
       1074 1  48 VAL MG1  1  70 ASN HD21 . . 4.500 2.574 2.332 2.937     .  0 0 "[    .    1    .    2]" 1 
       1075 1  48 VAL MG1  1  70 ASN QD   . . 3.920 2.542 2.311 2.888     .  0 0 "[    .    1    .    2]" 1 
       1076 1  48 VAL MG1  1  70 ASN HD22 . . 4.500 3.962 3.772 4.259     .  0 0 "[    .    1    .    2]" 1 
       1077 1  48 VAL MG1  1  71 LEU H    . . 4.670 3.586 3.433 3.768     .  0 0 "[    .    1    .    2]" 1 
       1078 1  48 VAL MG1  1  71 LEU HA   . . 3.800 3.286 2.989 3.648     .  0 0 "[    .    1    .    2]" 1 
       1079 1  48 VAL MG1  1  74 ALA H    . . 4.330 4.056 3.750 4.328     .  0 0 "[    .    1    .    2]" 1 
       1080 1  48 VAL MG1  1  74 ALA MB   . . 3.020 2.579 2.159 2.909     .  0 0 "[    .    1    .    2]" 1 
       1081 1  48 VAL MG2  1  49 ASN H    . . 3.610 3.164 2.771 3.558     .  0 0 "[    .    1    .    2]" 1 
       1082 1  48 VAL MG2  1  50 ILE HG13 . . 3.620 2.845 2.517 3.336     .  0 0 "[    .    1    .    2]" 1 
       1083 1  48 VAL MG2  1  70 ASN HB3  . . 4.990 3.861 3.496 4.210     .  0 0 "[    .    1    .    2]" 1 
       1084 1  48 VAL MG2  1  74 ALA HA   . . 4.980 3.947 3.609 4.113     .  0 0 "[    .    1    .    2]" 1 
       1085 1  48 VAL MG2  1  74 ALA MB   . . 3.040 1.941 1.761 2.103     .  0 0 "[    .    1    .    2]" 1 
       1086 1  49 ASN H    1  49 ASN QB   . . 3.220 2.557 2.426 2.684     .  0 0 "[    .    1    .    2]" 1 
       1087 1  49 ASN H    1  50 ILE H    . . 4.810 4.203 4.101 4.325     .  0 0 "[    .    1    .    2]" 1 
       1088 1  49 ASN H    1  50 ILE HA   . . 4.920 4.753 4.664 4.850     .  0 0 "[    .    1    .    2]" 1 
       1089 1  49 ASN H    1  50 ILE HG13 . . 5.010 4.449 4.260 4.819     .  0 0 "[    .    1    .    2]" 1 
       1090 1  49 ASN H    1  64 ILE MG   . . 4.310 3.252 3.050 3.408     .  0 0 "[    .    1    .    2]" 1 
       1091 1  49 ASN H    1  65 THR H    . . 3.870 3.308 2.872 3.489     .  0 0 "[    .    1    .    2]" 1 
       1092 1  49 ASN H    1  65 THR HB   . . 4.260 3.532 3.117 3.800     .  0 0 "[    .    1    .    2]" 1 
       1093 1  49 ASN H    1  65 THR MG   . . 4.660 4.424 4.242 4.617     .  0 0 "[    .    1    .    2]" 1 
       1094 1  49 ASN H    1  66 GLY HA2  . . 4.670 4.512 4.395 4.667     .  0 0 "[    .    1    .    2]" 1 
       1095 1  49 ASN H    1  66 GLY QA   . . 4.060 3.754 3.582 3.913     .  0 0 "[    .    1    .    2]" 1 
       1096 1  49 ASN H    1  66 GLY HA3  . . 4.670 4.017 3.781 4.201     .  0 0 "[    .    1    .    2]" 1 
       1097 1  49 ASN HA   1  49 ASN QD   . . 4.540 3.367 2.207 4.130     .  0 0 "[    .    1    .    2]" 1 
       1098 1  49 ASN HA   1  49 ASN HD22 . . 5.240 4.209 3.518 4.804     .  0 0 "[    .    1    .    2]" 1 
       1099 1  49 ASN HA   1  50 ILE H    . . 3.120 2.142 2.140 2.148     .  0 0 "[    .    1    .    2]" 1 
       1100 1  49 ASN HA   1  50 ILE HB   . . 4.670 4.599 4.540 4.670 0.000 15 0 "[    .    1    .    2]" 1 
       1101 1  49 ASN HA   1  50 ILE HG13 . . 4.990 3.877 3.758 4.090     .  0 0 "[    .    1    .    2]" 1 
       1102 1  49 ASN HA   1  65 THR H    . . 4.910 4.815 4.657 4.913 0.003 16 0 "[    .    1    .    2]" 1 
       1103 1  49 ASN QB   1  50 ILE H    . . 3.980 3.448 3.256 3.849     .  0 0 "[    .    1    .    2]" 1 
       1104 1  49 ASN QB   1  50 ILE HA   . . 5.230 4.395 4.238 4.845     .  0 0 "[    .    1    .    2]" 1 
       1105 1  49 ASN QB   1  64 ILE MG   . . 4.660 4.420 4.111 4.591     .  0 0 "[    .    1    .    2]" 1 
       1106 1  49 ASN QB   1  65 THR H    . . 4.070 3.310 2.964 3.544     .  0 0 "[    .    1    .    2]" 1 
       1107 1  49 ASN QB   1  65 THR HB   . . 3.290 2.226 2.070 2.489     .  0 0 "[    .    1    .    2]" 1 
       1108 1  49 ASN QB   1  65 THR MG   . . 3.900 3.470 3.338 3.601     .  0 0 "[    .    1    .    2]" 1 
       1109 1  50 ILE H    1  50 ILE HB   . . 3.730 2.521 2.429 2.582     .  0 0 "[    .    1    .    2]" 1 
       1110 1  50 ILE H    1  50 ILE MD   . . 4.230 3.801 3.565 3.954     .  0 0 "[    .    1    .    2]" 1 
       1111 1  50 ILE H    1  50 ILE HG12 . . 4.500 3.874 3.701 4.003     .  0 0 "[    .    1    .    2]" 1 
       1112 1  50 ILE H    1  50 ILE HG13 . . 4.000 2.639 2.390 2.786     .  0 0 "[    .    1    .    2]" 1 
       1113 1  50 ILE H    1  50 ILE MG   . . 3.920 3.796 3.750 3.824     .  0 0 "[    .    1    .    2]" 1 
       1114 1  50 ILE H    1  51 HIS H    . . 4.910 4.477 4.415 4.604     .  0 0 "[    .    1    .    2]" 1 
       1115 1  50 ILE HA   1  50 ILE MD   . . 4.350 3.840 3.789 3.878     .  0 0 "[    .    1    .    2]" 1 
       1116 1  50 ILE HA   1  50 ILE MG   . . 3.420 2.390 2.342 2.460     .  0 0 "[    .    1    .    2]" 1 
       1117 1  50 ILE HA   1  51 HIS H    . . 3.070 2.172 2.156 2.263     .  0 0 "[    .    1    .    2]" 1 
       1118 1  50 ILE HA   1  51 HIS HB2  . . 4.980 4.245 4.204 4.389     .  0 0 "[    .    1    .    2]" 1 
       1119 1  50 ILE HA   1  62 ILE MG   . . 4.630 3.815 3.621 3.975     .  0 0 "[    .    1    .    2]" 1 
       1120 1  50 ILE HA   1  64 ILE HG12 . . 4.960 2.889 2.633 3.132     .  0 0 "[    .    1    .    2]" 1 
       1121 1  50 ILE HA   1  64 ILE MG   . . 4.250 2.938 2.566 3.367     .  0 0 "[    .    1    .    2]" 1 
       1122 1  50 ILE HA   1  65 THR H    . . 4.100 3.424 3.230 3.569     .  0 0 "[    .    1    .    2]" 1 
       1123 1  50 ILE HB   1  50 ILE MD   . . 3.340 2.345 2.259 2.408     .  0 0 "[    .    1    .    2]" 1 
       1124 1  50 ILE HB   1  51 HIS H    . . 4.170 4.125 3.898 4.170     .  0 0 "[    .    1    .    2]" 1 
       1125 1  50 ILE MD   1  51 HIS H    . . 5.120 5.027 4.769 5.119     .  0 0 "[    .    1    .    2]" 1 
       1126 1  50 ILE MD   1  74 ALA MB   . . 4.220 3.553 2.877 4.211     .  0 0 "[    .    1    .    2]" 1 
       1127 1  50 ILE HG12 1  51 HIS H    . . 4.570 4.288 4.093 4.427     .  0 0 "[    .    1    .    2]" 1 
       1128 1  50 ILE HG12 1  64 ILE HA   . . 4.990 3.643 3.438 3.965     .  0 0 "[    .    1    .    2]" 1 
       1129 1  50 ILE HG12 1  64 ILE MD   . . 4.110 2.731 2.525 2.895     .  0 0 "[    .    1    .    2]" 1 
       1130 1  50 ILE HG12 1  64 ILE MG   . . 3.230 2.303 1.949 2.696     .  0 0 "[    .    1    .    2]" 1 
       1131 1  50 ILE HG12 1  65 THR H    . . 5.270 4.901 4.569 5.210     .  0 0 "[    .    1    .    2]" 1 
       1132 1  50 ILE HG13 1  51 HIS H    . . 5.220 4.942 4.801 5.070     .  0 0 "[    .    1    .    2]" 1 
       1133 1  50 ILE HG13 1  64 ILE MD   . . 4.180 4.056 3.893 4.181 0.001  2 0 "[    .    1    .    2]" 1 
       1134 1  50 ILE HG13 1  64 ILE MG   . . 3.280 2.922 2.615 3.198     .  0 0 "[    .    1    .    2]" 1 
       1135 1  50 ILE HG13 1  65 THR H    . . 5.190 5.049 4.867 5.183     .  0 0 "[    .    1    .    2]" 1 
       1136 1  50 ILE HG13 1  74 ALA MB   . . 4.970 4.368 3.840 4.730     .  0 0 "[    .    1    .    2]" 1 
       1137 1  50 ILE MG   1  51 HIS H    . . 3.380 2.354 1.919 2.610     .  0 0 "[    .    1    .    2]" 1 
       1138 1  50 ILE MG   1  51 HIS HA   . . 4.620 3.556 3.365 3.679     .  0 0 "[    .    1    .    2]" 1 
       1139 1  50 ILE MG   1  51 HIS HB3  . . 5.500 4.993 4.251 5.109     .  0 0 "[    .    1    .    2]" 1 
       1140 1  50 ILE MG   1  52 VAL H    . . 5.090 4.008 3.565 4.418     .  0 0 "[    .    1    .    2]" 1 
       1141 1  50 ILE MG   1  62 ILE MD   . . 4.240 3.159 2.908 3.395     .  0 0 "[    .    1    .    2]" 1 
       1142 1  50 ILE MG   1  63 ALA H    . . 5.210 4.234 3.925 4.434     .  0 0 "[    .    1    .    2]" 1 
       1143 1  50 ILE MG   1  64 ILE HA   . . 4.560 3.715 3.409 3.875     .  0 0 "[    .    1    .    2]" 1 
       1144 1  51 HIS H    1  51 HIS HB2  . . 3.650 2.501 2.396 3.169     .  0 0 "[    .    1    .    2]" 1 
       1145 1  51 HIS H    1  51 HIS HB3  . . 3.660 3.562 2.723 3.648     .  0 0 "[    .    1    .    2]" 1 
       1146 1  51 HIS H    1  51 HIS HD2  . . 4.750 3.880 3.495 4.772 0.022 12 0 "[    .    1    .    2]" 1 
       1147 1  51 HIS H    1  52 VAL H    . . 4.750 4.310 4.085 4.438     .  0 0 "[    .    1    .    2]" 1 
       1148 1  51 HIS H    1  52 VAL MG2  . . 4.980 4.234 3.842 4.353     .  0 0 "[    .    1    .    2]" 1 
       1149 1  51 HIS H    1  62 ILE MG   . . 4.000 2.965 2.440 3.164     .  0 0 "[    .    1    .    2]" 1 
       1150 1  51 HIS H    1  63 ALA H    . . 4.130 3.660 3.214 3.941     .  0 0 "[    .    1    .    2]" 1 
       1151 1  51 HIS H    1  63 ALA MB   . . 3.860 3.758 3.606 3.854     .  0 0 "[    .    1    .    2]" 1 
       1152 1  51 HIS H    1  64 ILE H    . . 5.350 4.848 4.650 4.948     .  0 0 "[    .    1    .    2]" 1 
       1153 1  51 HIS H    1  64 ILE HA   . . 4.130 3.119 2.763 3.295     .  0 0 "[    .    1    .    2]" 1 
       1154 1  51 HIS H    1  64 ILE HG12 . . 4.110 3.798 3.492 3.982     .  0 0 "[    .    1    .    2]" 1 
       1155 1  51 HIS H    1  64 ILE HG13 . . 5.500 4.516 4.228 4.878     .  0 0 "[    .    1    .    2]" 1 
       1156 1  51 HIS H    1  65 THR H    . . 4.890 4.450 4.147 4.797     .  0 0 "[    .    1    .    2]" 1 
       1157 1  51 HIS HA   1  51 HIS HD2  . . 4.170 3.040 2.100 4.121     .  0 0 "[    .    1    .    2]" 1 
       1158 1  51 HIS HA   1  52 VAL H    . . 2.900 2.155 2.141 2.221     .  0 0 "[    .    1    .    2]" 1 
       1159 1  51 HIS HA   1  52 VAL HA   . . 4.730 4.391 4.385 4.416     .  0 0 "[    .    1    .    2]" 1 
       1160 1  51 HIS HA   1  52 VAL MG2  . . 3.910 3.638 3.490 3.785     .  0 0 "[    .    1    .    2]" 1 
       1161 1  51 HIS HB2  1  52 VAL H    . . 4.600 4.401 4.220 4.554     .  0 0 "[    .    1    .    2]" 1 
       1162 1  51 HIS HB2  1  52 VAL MG2  . . 5.500 5.395 5.200 5.500     .  0 0 "[    .    1    .    2]" 1 
       1163 1  51 HIS HB2  1  63 ALA H    . . 4.390 3.951 3.762 4.409 0.019 12 0 "[    .    1    .    2]" 1 
       1164 1  51 HIS HB2  1  63 ALA MB   . . 3.550 2.790 2.474 3.176     .  0 0 "[    .    1    .    2]" 1 
       1165 1  51 HIS HB3  1  52 VAL H    . . 4.350 3.449 3.041 4.364 0.014 12 0 "[    .    1    .    2]" 1 
       1166 1  51 HIS HB3  1  52 VAL MG2  . . 5.500 5.049 4.788 5.253     .  0 0 "[    .    1    .    2]" 1 
       1167 1  51 HIS HB3  1  63 ALA H    . . 4.340 4.203 2.731 4.338     .  0 0 "[    .    1    .    2]" 1 
       1168 1  51 HIS HB3  1  63 ALA MB   . . 3.670 3.391 1.963 3.625     .  0 0 "[    .    1    .    2]" 1 
       1169 1  52 VAL H    1  52 VAL HB   . . 3.270 2.552 2.488 2.649     .  0 0 "[    .    1    .    2]" 1 
       1170 1  52 VAL H    1  52 VAL MG1  . . 4.120 3.810 3.781 3.845     .  0 0 "[    .    1    .    2]" 1 
       1171 1  52 VAL H    1  52 VAL MG2  . . 3.440 2.604 2.404 2.795     .  0 0 "[    .    1    .    2]" 1 
       1172 1  52 VAL H    1  53 PRO HD2  . . 5.290 4.840 4.829 4.843     .  0 0 "[    .    1    .    2]" 1 
       1173 1  52 VAL H    1  53 PRO HD3  . . 5.200 4.862 4.761 4.915     .  0 0 "[    .    1    .    2]" 1 
       1174 1  52 VAL HA   1  52 VAL MG1  . . 3.370 2.461 2.401 2.476     .  0 0 "[    .    1    .    2]" 1 
       1175 1  52 VAL HA   1  52 VAL MG2  . . 3.480 2.396 2.317 2.487     .  0 0 "[    .    1    .    2]" 1 
       1176 1  52 VAL HA   1  53 PRO QB   . . 5.230 4.536 4.534 4.537     .  0 0 "[    .    1    .    2]" 1 
       1177 1  52 VAL HA   1  53 PRO HD2  . . 3.550 2.167 2.078 2.182     .  0 0 "[    .    1    .    2]" 1 
       1178 1  52 VAL HA   1  53 PRO HD3  . . 3.570 2.254 2.251 2.266     .  0 0 "[    .    1    .    2]" 1 
       1179 1  52 VAL HA   1  53 PRO HG2  . . 5.500 4.325 4.255 4.338     .  0 0 "[    .    1    .    2]" 1 
       1180 1  52 VAL HA   1  53 PRO HG3  . . 5.130 4.355 4.326 4.361     .  0 0 "[    .    1    .    2]" 1 
       1181 1  52 VAL HA   1  62 ILE MD   . . 4.230 3.832 3.589 4.009     .  0 0 "[    .    1    .    2]" 1 
       1182 1  52 VAL HA   1  62 ILE HG12 . . 4.050 2.535 2.210 2.682     .  0 0 "[    .    1    .    2]" 1 
       1183 1  52 VAL HA   1  62 ILE HG13 . . 4.460 4.103 3.586 4.293     .  0 0 "[    .    1    .    2]" 1 
       1184 1  52 VAL HA   1  62 ILE MG   . . 3.880 3.195 2.954 3.383     .  0 0 "[    .    1    .    2]" 1 
       1185 1  52 VAL HA   1  63 ALA H    . . 4.130 3.755 3.549 3.951     .  0 0 "[    .    1    .    2]" 1 
       1186 1  52 VAL HB   1  53 PRO HD2  . . 4.280 3.955 3.917 4.153     .  0 0 "[    .    1    .    2]" 1 
       1187 1  52 VAL HB   1  53 PRO HD3  . . 5.220 4.888 4.863 4.992     .  0 0 "[    .    1    .    2]" 1 
       1188 1  52 VAL MG1  1  53 PRO HD2  . . 3.330 1.833 1.813 1.950     .  0 0 "[    .    1    .    2]" 1 
       1189 1  52 VAL MG1  1  53 PRO HD3  . . 3.610 3.165 3.140 3.290     .  0 0 "[    .    1    .    2]" 1 
       1190 1  52 VAL MG1  1  53 PRO HG2  . . 4.960 2.953 2.917 3.081     .  0 0 "[    .    1    .    2]" 1 
       1191 1  52 VAL MG1  1  53 PRO HG3  . . 4.880 3.910 3.878 4.088     .  0 0 "[    .    1    .    2]" 1 
       1192 1  52 VAL MG1  1  62 ILE HG13 . . 4.470 3.681 3.264 4.228     .  0 0 "[    .    1    .    2]" 1 
       1193 1  52 VAL MG1  1  62 ILE MG   . . 4.460 4.110 3.923 4.303     .  0 0 "[    .    1    .    2]" 1 
       1194 1  52 VAL MG2  1  53 PRO HD2  . . 4.600 3.331 3.270 3.507     .  0 0 "[    .    1    .    2]" 1 
       1195 1  52 VAL MG2  1  62 ILE MD   . . 3.250 2.153 1.940 2.427     .  0 0 "[    .    1    .    2]" 1 
       1196 1  52 VAL MG2  1  62 ILE HG13 . . 4.020 3.776 3.550 3.994     .  0 0 "[    .    1    .    2]" 1 
       1197 1  52 VAL MG2  1  62 ILE MG   . . 3.150 2.736 2.404 2.914     .  0 0 "[    .    1    .    2]" 1 
       1198 1  53 PRO HA   1  54 ALA H    . . 2.860 2.177 2.159 2.246     .  0 0 "[    .    1    .    2]" 1 
       1199 1  53 PRO HA   1  54 ALA MB   . . 4.080 3.960 3.930 3.995     .  0 0 "[    .    1    .    2]" 1 
       1200 1  53 PRO HA   1  57 LEU MD1  . . 4.310 2.768 2.397 3.165     .  0 0 "[    .    1    .    2]" 1 
       1201 1  53 PRO QB   1  54 ALA H    . . 3.410 3.175 2.922 3.262     .  0 0 "[    .    1    .    2]" 1 
       1202 1  53 PRO QB   1  54 ALA MB   . . 5.150 4.321 4.178 4.412     .  0 0 "[    .    1    .    2]" 1 
       1203 1  53 PRO QB   1  57 LEU HB2  . . 4.390 2.698 2.523 2.925     .  0 0 "[    .    1    .    2]" 1 
       1204 1  53 PRO QB   1  57 LEU MD1  . . 3.370 2.488 2.191 2.735     .  0 0 "[    .    1    .    2]" 1 
       1205 1  53 PRO QB   1  59 SER QB   . . 3.510 2.230 1.965 2.511     .  0 0 "[    .    1    .    2]" 1 
       1206 1  53 PRO HB2  1  54 ALA H    . . 3.960 3.367 3.061 3.473     .  0 0 "[    .    1    .    2]" 1 
       1207 1  53 PRO HB2  1  57 LEU HB3  . . 4.890 3.742 3.466 4.122     .  0 0 "[    .    1    .    2]" 1 
       1208 1  53 PRO HB2  1  57 LEU MD1  . . 3.850 2.707 2.305 3.041     .  0 0 "[    .    1    .    2]" 1 
       1209 1  53 PRO HB2  1  59 SER HB2  . . 4.790 3.144 2.864 3.399     .  0 0 "[    .    1    .    2]" 1 
       1210 1  53 PRO HB2  1  59 SER HB3  . . 4.790 2.504 2.113 2.865     .  0 0 "[    .    1    .    2]" 1 
       1211 1  53 PRO HB3  1  54 ALA H    . . 3.960 3.892 3.701 3.961 0.001  9 0 "[    .    1    .    2]" 1 
       1212 1  53 PRO HB3  1  57 LEU HB3  . . 4.890 4.441 4.101 4.844     .  0 0 "[    .    1    .    2]" 1 
       1213 1  53 PRO HB3  1  57 LEU MD1  . . 3.850 2.920 2.650 3.226     .  0 0 "[    .    1    .    2]" 1 
       1214 1  53 PRO HB3  1  59 SER HB2  . . 4.790 3.579 3.290 3.900     .  0 0 "[    .    1    .    2]" 1 
       1215 1  53 PRO HB3  1  59 SER HB3  . . 4.790 2.724 2.332 3.128     .  0 0 "[    .    1    .    2]" 1 
       1216 1  53 PRO HD2  1  62 ILE H    . . 5.500 5.419 5.250 5.501 0.001 14 0 "[    .    1    .    2]" 1 
       1217 1  53 PRO HD2  1  62 ILE HA   . . 3.990 3.465 3.326 3.543     .  0 0 "[    .    1    .    2]" 1 
       1218 1  53 PRO HD2  1  62 ILE MD   . . 4.620 3.940 3.744 4.079     .  0 0 "[    .    1    .    2]" 1 
       1219 1  53 PRO HD2  1  62 ILE HG12 . . 4.400 2.704 2.514 2.817     .  0 0 "[    .    1    .    2]" 1 
       1220 1  53 PRO HD2  1  62 ILE HG13 . . 4.870 3.480 3.159 3.675     .  0 0 "[    .    1    .    2]" 1 
       1221 1  53 PRO HD2  1  62 ILE MG   . . 4.630 4.303 4.141 4.466     .  0 0 "[    .    1    .    2]" 1 
       1222 1  53 PRO HD2  1  63 ALA H    . . 5.020 4.910 4.609 5.042 0.022 12 0 "[    .    1    .    2]" 1 
       1223 1  53 PRO HD3  1  62 ILE HA   . . 4.140 2.485 2.364 2.630     .  0 0 "[    .    1    .    2]" 1 
       1224 1  53 PRO HD3  1  62 ILE MD   . . 4.750 4.631 4.457 4.751 0.001 11 0 "[    .    1    .    2]" 1 
       1225 1  53 PRO HD3  1  62 ILE HG12 . . 4.290 3.135 2.918 3.276     .  0 0 "[    .    1    .    2]" 1 
       1226 1  53 PRO HD3  1  62 ILE HG13 . . 5.140 3.873 3.593 4.083     .  0 0 "[    .    1    .    2]" 1 
       1227 1  53 PRO HD3  1  62 ILE MG   . . 4.780 3.946 3.745 4.165     .  0 0 "[    .    1    .    2]" 1 
       1228 1  53 PRO HD3  1  63 ALA H    . . 4.950 3.600 3.242 3.808     .  0 0 "[    .    1    .    2]" 1 
       1229 1  53 PRO HG2  1  57 LEU MD1  . . 4.980 4.720 4.325 4.959     .  0 0 "[    .    1    .    2]" 1 
       1230 1  53 PRO HG2  1  59 SER H    . . 4.330 3.694 3.422 3.910     .  0 0 "[    .    1    .    2]" 1 
       1231 1  53 PRO HG2  1  59 SER HB2  . . 4.880 4.386 4.193 4.606     .  0 0 "[    .    1    .    2]" 1 
       1232 1  53 PRO HG2  1  59 SER QB   . . 4.260 2.894 2.646 3.084     .  0 0 "[    .    1    .    2]" 1 
       1233 1  53 PRO HG2  1  59 SER HB3  . . 4.880 2.936 2.671 3.137     .  0 0 "[    .    1    .    2]" 1 
       1234 1  53 PRO HG3  1  57 LEU MD1  . . 5.140 4.746 4.485 5.046     .  0 0 "[    .    1    .    2]" 1 
       1235 1  53 PRO HG3  1  59 SER HA   . . 5.500 4.841 4.697 5.066     .  0 0 "[    .    1    .    2]" 1 
       1236 1  53 PRO HG3  1  59 SER HB2  . . 4.020 3.842 3.679 4.005     .  0 0 "[    .    1    .    2]" 1 
       1237 1  53 PRO HG3  1  59 SER HB3  . . 4.020 2.153 2.011 2.298     .  0 0 "[    .    1    .    2]" 1 
       1238 1  53 PRO HG3  1  60 ASP HA   . . 5.420 4.427 4.106 4.980     .  0 0 "[    .    1    .    2]" 1 
       1239 1  53 PRO HG3  1  61 ILE H    . . 4.380 3.086 2.766 3.608     .  0 0 "[    .    1    .    2]" 1 
       1240 1  53 PRO HG3  1  62 ILE HA   . . 4.990 3.872 3.632 4.088     .  0 0 "[    .    1    .    2]" 1 
       1241 1  53 PRO HG3  1  62 ILE HG12 . . 4.870 4.555 4.295 4.867     .  0 0 "[    .    1    .    2]" 1 
       1242 1  54 ALA H    1  54 ALA MB   . . 2.940 2.058 2.023 2.141     .  0 0 "[    .    1    .    2]" 1 
       1243 1  54 ALA H    1  55 PRO HD2  . . 5.090 4.687 4.655 4.744     .  0 0 "[    .    1    .    2]" 1 
       1244 1  54 ALA H    1  55 PRO QD   . . 4.470 4.323 4.308 4.345     .  0 0 "[    .    1    .    2]" 1 
       1245 1  54 ALA H    1  55 PRO HD3  . . 5.090 5.072 4.996 5.096 0.006 19 0 "[    .    1    .    2]" 1 
       1246 1  54 ALA H    1  56 GLU QG   . . 4.770 4.553 4.338 4.702     .  0 0 "[    .    1    .    2]" 1 
       1247 1  54 ALA H    1  57 LEU HB2  . . 5.220 3.685 3.519 3.939     .  0 0 "[    .    1    .    2]" 1 
       1248 1  54 ALA H    1  57 LEU MD1  . . 3.690 2.175 1.878 2.693     .  0 0 "[    .    1    .    2]" 1 
       1249 1  54 ALA H    1  57 LEU HG   . . 4.910 3.774 3.462 4.128     .  0 0 "[    .    1    .    2]" 1 
       1250 1  54 ALA HA   1  55 PRO HD2  . . 3.410 2.568 2.392 2.635     .  0 0 "[    .    1    .    2]" 1 
       1251 1  54 ALA HA   1  55 PRO QD   . . 2.940 2.194 2.085 2.237     .  0 0 "[    .    1    .    2]" 1 
       1252 1  54 ALA HA   1  55 PRO HD3  . . 3.410 2.381 2.295 2.420     .  0 0 "[    .    1    .    2]" 1 
       1253 1  54 ALA HA   1  55 PRO QG   . . 4.200 4.113 3.997 4.159     .  0 0 "[    .    1    .    2]" 1 
       1254 1  54 ALA HA   1  56 GLU H    . . 4.310 4.173 3.908 4.306     .  0 0 "[    .    1    .    2]" 1 
       1255 1  54 ALA MB   1  55 PRO HD2  . . 3.390 1.951 1.900 2.055     .  0 0 "[    .    1    .    2]" 1 
       1256 1  54 ALA MB   1  55 PRO HD3  . . 3.390 3.063 2.955 3.226     .  0 0 "[    .    1    .    2]" 1 
       1257 1  54 ALA MB   1  55 PRO QG   . . 3.740 3.374 3.308 3.559     .  0 0 "[    .    1    .    2]" 1 
       1258 1  54 ALA MB   1  56 GLU H    . . 3.470 2.286 2.146 2.458     .  0 0 "[    .    1    .    2]" 1 
       1259 1  54 ALA MB   1  56 GLU QB   . . 3.950 3.610 3.307 3.824     .  0 0 "[    .    1    .    2]" 1 
       1260 1  54 ALA MB   1  56 GLU QG   . . 3.800 2.093 1.922 2.531     .  0 0 "[    .    1    .    2]" 1 
       1261 1  54 ALA MB   1  57 LEU H    . . 4.150 3.049 2.793 3.252     .  0 0 "[    .    1    .    2]" 1 
       1262 1  54 ALA MB   1  57 LEU MD1  . . 3.260 2.497 2.064 2.906     .  0 0 "[    .    1    .    2]" 1 
       1263 1  54 ALA MB   1  57 LEU MD2  . . 4.350 3.992 3.702 4.263     .  0 0 "[    .    1    .    2]" 1 
       1264 1  54 ALA MB   1  57 LEU HG   . . 3.180 2.833 2.409 3.120     .  0 0 "[    .    1    .    2]" 1 
       1265 1  55 PRO HA   1  57 LEU H    . . 4.500 3.909 3.640 4.292     .  0 0 "[    .    1    .    2]" 1 
       1266 1  55 PRO HA   1  58 GLN H    . . 4.540 3.356 3.212 3.507     .  0 0 "[    .    1    .    2]" 1 
       1267 1  55 PRO HA   1  58 GLN HA   . . 4.870 3.895 3.658 4.138     .  0 0 "[    .    1    .    2]" 1 
       1268 1  55 PRO QB   1  56 GLU H    . . 3.760 3.343 3.210 3.536     .  0 0 "[    .    1    .    2]" 1 
       1269 1  55 PRO HB2  1  56 GLU H    . . 4.420 3.501 3.342 3.735     .  0 0 "[    .    1    .    2]" 1 
       1270 1  55 PRO HB3  1  56 GLU H    . . 4.420 4.239 4.146 4.374     .  0 0 "[    .    1    .    2]" 1 
       1271 1  55 PRO HD2  1  56 GLU H    . . 3.960 2.686 2.647 2.789     .  0 0 "[    .    1    .    2]" 1 
       1272 1  55 PRO HD3  1  56 GLU H    . . 3.960 3.862 3.838 3.918     .  0 0 "[    .    1    .    2]" 1 
       1273 1  55 PRO QG   1  56 GLU H    . . 3.530 2.567 2.358 2.892     .  0 0 "[    .    1    .    2]" 1 
       1274 1  56 GLU H    1  56 GLU QB   . . 3.140 2.526 2.299 2.761     .  0 0 "[    .    1    .    2]" 1 
       1275 1  56 GLU H    1  56 GLU QG   . . 3.510 2.203 2.009 2.599     .  0 0 "[    .    1    .    2]" 1 
       1276 1  56 GLU H    1  57 LEU H    . . 3.520 2.490 2.331 2.614     .  0 0 "[    .    1    .    2]" 1 
       1277 1  56 GLU H    1  57 LEU HG   . . 4.640 4.089 3.746 4.481     .  0 0 "[    .    1    .    2]" 1 
       1278 1  56 GLU H    1  58 GLN H    . . 5.020 3.997 3.847 4.213     .  0 0 "[    .    1    .    2]" 1 
       1279 1  56 GLU HA   1  56 GLU QG   . . 3.390 3.343 3.294 3.433 0.043  9 0 "[    .    1    .    2]" 1 
       1280 1  56 GLU HA   1  58 GLN H    . . 4.400 4.066 3.835 4.266     .  0 0 "[    .    1    .    2]" 1 
       1281 1  56 GLU HA   1  58 GLN QG   . . 3.820 3.543 3.143 3.814     .  0 0 "[    .    1    .    2]" 1 
       1282 1  56 GLU QB   1  57 LEU H    . . 3.960 3.638 3.456 3.807     .  0 0 "[    .    1    .    2]" 1 
       1283 1  56 GLU QG   1  57 LEU H    . . 3.650 2.440 2.046 2.873     .  0 0 "[    .    1    .    2]" 1 
       1284 1  56 GLU QG   1  57 LEU HA   . . 3.970 3.503 3.121 3.971 0.001  9 0 "[    .    1    .    2]" 1 
       1285 1  56 GLU QG   1  57 LEU MD1  . . 5.040 3.565 3.397 3.713     .  0 0 "[    .    1    .    2]" 1 
       1286 1  56 GLU QG   1  57 LEU MD2  . . 3.790 2.977 2.552 3.486     .  0 0 "[    .    1    .    2]" 1 
       1287 1  56 GLU QG   1  57 LEU HG   . . 4.170 2.233 2.047 2.417     .  0 0 "[    .    1    .    2]" 1 
       1288 1  57 LEU H    1  57 LEU HB2  . . 3.200 2.455 2.385 2.545     .  0 0 "[    .    1    .    2]" 1 
       1289 1  57 LEU H    1  57 LEU HB3  . . 4.060 3.622 3.585 3.664     .  0 0 "[    .    1    .    2]" 1 
       1290 1  57 LEU H    1  57 LEU MD1  . . 3.710 3.599 3.424 3.696     .  0 0 "[    .    1    .    2]" 1 
       1291 1  57 LEU H    1  57 LEU MD2  . . 3.840 3.684 3.454 3.829     .  0 0 "[    .    1    .    2]" 1 
       1292 1  57 LEU H    1  57 LEU HG   . . 3.110 2.520 2.305 2.673     .  0 0 "[    .    1    .    2]" 1 
       1293 1  57 LEU H    1  58 GLN H    . . 3.250 2.304 2.122 2.554     .  0 0 "[    .    1    .    2]" 1 
       1294 1  57 LEU H    1  58 GLN HA   . . 4.980 4.563 4.374 4.821     .  0 0 "[    .    1    .    2]" 1 
       1295 1  57 LEU H    1  59 SER H    . . 4.750 4.406 3.981 4.704     .  0 0 "[    .    1    .    2]" 1 
       1296 1  57 LEU HA   1  57 LEU MD1  . . 4.060 3.908 3.873 3.934     .  0 0 "[    .    1    .    2]" 1 
       1297 1  57 LEU HA   1  57 LEU MD2  . . 2.840 2.209 2.047 2.387     .  0 0 "[    .    1    .    2]" 1 
       1298 1  57 LEU HA   1  57 LEU HG   . . 3.740 3.007 2.928 3.119     .  0 0 "[    .    1    .    2]" 1 
       1299 1  57 LEU HA   1  58 GLN QG   . . 5.340 4.008 3.222 4.633     .  0 0 "[    .    1    .    2]" 1 
       1300 1  57 LEU HA   1  59 SER H    . . 5.080 4.839 4.555 5.069     .  0 0 "[    .    1    .    2]" 1 
       1301 1  57 LEU HB2  1  57 LEU MD1  . . 3.290 2.167 2.054 2.272     .  0 0 "[    .    1    .    2]" 1 
       1302 1  57 LEU HB2  1  57 LEU MD2  . . 3.670 3.176 3.159 3.189     .  0 0 "[    .    1    .    2]" 1 
       1303 1  57 LEU HB2  1  58 GLN H    . . 3.370 3.011 2.850 3.212     .  0 0 "[    .    1    .    2]" 1 
       1304 1  57 LEU HB2  1  59 SER H    . . 4.040 3.142 2.829 3.334     .  0 0 "[    .    1    .    2]" 1 
       1305 1  57 LEU HB2  1  59 SER HB2  . . 4.750 3.345 3.123 3.582     .  0 0 "[    .    1    .    2]" 1 
       1306 1  57 LEU HB2  1  59 SER QB   . . 4.060 3.198 2.991 3.423     .  0 0 "[    .    1    .    2]" 1 
       1307 1  57 LEU HB2  1  59 SER HB3  . . 4.750 4.080 3.827 4.345     .  0 0 "[    .    1    .    2]" 1 
       1308 1  57 LEU HB3  1  57 LEU MD1  . . 3.530 2.485 2.357 2.607     .  0 0 "[    .    1    .    2]" 1 
       1309 1  57 LEU HB3  1  57 LEU MD2  . . 3.280 2.244 2.140 2.328     .  0 0 "[    .    1    .    2]" 1 
       1310 1  57 LEU HB3  1  58 GLN H    . . 4.050 3.956 3.836 4.051 0.001 19 0 "[    .    1    .    2]" 1 
       1311 1  57 LEU HB3  1  59 SER H    . . 4.530 3.766 3.397 3.983     .  0 0 "[    .    1    .    2]" 1 
       1312 1  57 LEU HB3  1  59 SER HB2  . . 4.650 2.859 2.711 2.993     .  0 0 "[    .    1    .    2]" 1 
       1313 1  57 LEU HB3  1  59 SER QB   . . 4.020 2.813 2.670 2.942     .  0 0 "[    .    1    .    2]" 1 
       1314 1  57 LEU HB3  1  59 SER HB3  . . 4.650 4.196 4.005 4.410     .  0 0 "[    .    1    .    2]" 1 
       1315 1  57 LEU MD1  1  58 GLN H    . . 4.880 4.708 4.614 4.881 0.001 19 0 "[    .    1    .    2]" 1 
       1316 1  57 LEU MD1  1  59 SER HB2  . . 4.630 3.826 3.564 4.114     .  0 0 "[    .    1    .    2]" 1 
       1317 1  57 LEU MD1  1  59 SER QB   . . 3.950 3.549 3.333 3.729     .  0 0 "[    .    1    .    2]" 1 
       1318 1  57 LEU MD1  1  59 SER HB3  . . 4.630 4.212 3.947 4.443     .  0 0 "[    .    1    .    2]" 1 
       1319 1  57 LEU MD2  1  58 GLN H    . . 4.920 4.816 4.761 4.886     .  0 0 "[    .    1    .    2]" 1 
       1320 1  57 LEU HG   1  58 GLN H    . . 4.990 4.465 4.311 4.594     .  0 0 "[    .    1    .    2]" 1 
       1321 1  58 GLN H    1  58 GLN HB2  . . 4.180 3.564 3.329 3.989     .  0 0 "[    .    1    .    2]" 1 
       1322 1  58 GLN H    1  58 GLN QB   . . 3.670 3.296 3.070 3.401     .  0 0 "[    .    1    .    2]" 1 
       1323 1  58 GLN H    1  58 GLN HB3  . . 4.180 3.943 3.192 4.058     .  0 0 "[    .    1    .    2]" 1 
       1324 1  58 GLN H    1  58 GLN HG2  . . 3.880 3.164 2.252 3.521     .  0 0 "[    .    1    .    2]" 1 
       1325 1  58 GLN H    1  58 GLN QG   . . 3.310 2.619 2.238 2.883     .  0 0 "[    .    1    .    2]" 1 
       1326 1  58 GLN H    1  58 GLN HG3  . . 3.880 2.987 2.420 3.885 0.005 19 0 "[    .    1    .    2]" 1 
       1327 1  58 GLN H    1  59 SER H    . . 3.630 2.891 2.704 3.080     .  0 0 "[    .    1    .    2]" 1 
       1328 1  58 GLN HA   1  58 GLN QE   . . 5.100 4.402 1.962 4.968     .  0 0 "[    .    1    .    2]" 1 
       1329 1  58 GLN HA   1  58 GLN HG2  . . 4.010 2.663 2.303 3.528     .  0 0 "[    .    1    .    2]" 1 
       1330 1  58 GLN HA   1  58 GLN QG   . . 3.430 2.538 2.254 3.252     .  0 0 "[    .    1    .    2]" 1 
       1331 1  58 GLN HA   1  58 GLN HG3  . . 4.010 3.282 2.979 3.891     .  0 0 "[    .    1    .    2]" 1 
       1332 1  58 GLN HA   1  59 SER H    . . 3.240 2.712 2.623 2.879     .  0 0 "[    .    1    .    2]" 1 
       1333 1  58 GLN HA   1  59 SER HA   . . 5.500 4.515 4.431 4.634     .  0 0 "[    .    1    .    2]" 1 
       1334 1  58 GLN QB   1  59 SER H    . . 4.110 3.888 3.812 3.982     .  0 0 "[    .    1    .    2]" 1 
       1335 1  58 GLN HB2  1  59 SER H    . . 4.790 4.288 4.144 4.409     .  0 0 "[    .    1    .    2]" 1 
       1336 1  58 GLN HB3  1  59 SER H    . . 4.790 4.455 4.356 4.643     .  0 0 "[    .    1    .    2]" 1 
       1337 1  59 SER H    1  59 SER HB2  . . 3.280 2.617 2.510 2.770     .  0 0 "[    .    1    .    2]" 1 
       1338 1  59 SER H    1  59 SER HB3  . . 3.280 2.806 2.676 2.929     .  0 0 "[    .    1    .    2]" 1 
       1339 1  59 SER H    1  60 ASP H    . . 4.730 4.528 4.456 4.568     .  0 0 "[    .    1    .    2]" 1 
       1340 1  59 SER HA   1  60 ASP H    . . 2.990 2.245 2.184 2.360     .  0 0 "[    .    1    .    2]" 1 
       1341 1  59 SER HA   1  61 ILE H    . . 4.080 3.848 3.730 4.009     .  0 0 "[    .    1    .    2]" 1 
       1342 1  59 SER QB   1  60 ASP H    . . 4.140 3.440 3.208 3.614     .  0 0 "[    .    1    .    2]" 1 
       1343 1  59 SER QB   1  61 ILE H    . . 3.810 2.997 2.843 3.200     .  0 0 "[    .    1    .    2]" 1 
       1344 1  59 SER QB   1  61 ILE HB   . . 5.160 4.434 4.241 4.726     .  0 0 "[    .    1    .    2]" 1 
       1345 1  59 SER HB2  1  60 ASP H    . . 4.980 4.178 4.014 4.260     .  0 0 "[    .    1    .    2]" 1 
       1346 1  59 SER HB2  1  61 ILE H    . . 4.380 4.350 4.251 4.392 0.012 12 0 "[    .    1    .    2]" 1 
       1347 1  59 SER HB3  1  60 ASP H    . . 4.980 3.665 3.373 3.919     .  0 0 "[    .    1    .    2]" 1 
       1348 1  59 SER HB3  1  61 ILE H    . . 4.380 3.056 2.885 3.290     .  0 0 "[    .    1    .    2]" 1 
       1349 1  59 SER HG   1  60 ASP H    . . 5.050 2.955 2.075 3.888     .  0 0 "[    .    1    .    2]" 1 
       1350 1  59 SER HG   1  61 ILE H    . . 4.630 2.722 1.959 3.931     .  0 0 "[    .    1    .    2]" 1 
       1351 1  59 SER HG   1  61 ILE HB   . . 5.270 3.466 2.838 4.355     .  0 0 "[    .    1    .    2]" 1 
       1352 1  60 ASP H    1  60 ASP HB2  . . 3.790 2.762 2.598 3.547     .  0 0 "[    .    1    .    2]" 1 
       1353 1  60 ASP H    1  60 ASP QB   . . 3.220 2.663 2.550 3.052     .  0 0 "[    .    1    .    2]" 1 
       1354 1  60 ASP H    1  60 ASP HB3  . . 3.790 3.708 3.326 3.785     .  0 0 "[    .    1    .    2]" 1 
       1355 1  60 ASP H    1  61 ILE H    . . 3.250 2.454 2.332 2.592     .  0 0 "[    .    1    .    2]" 1 
       1356 1  60 ASP H    1  61 ILE HA   . . 4.860 4.759 4.663 4.849     .  0 0 "[    .    1    .    2]" 1 
       1357 1  60 ASP H    1  61 ILE HB   . . 4.710 4.619 4.440 4.711 0.001 18 0 "[    .    1    .    2]" 1 
       1358 1  60 ASP H    1  61 ILE MD   . . 4.550 3.712 3.450 3.864     .  0 0 "[    .    1    .    2]" 1 
       1359 1  60 ASP H    1  61 ILE HG12 . . 4.560 2.742 2.651 2.835     .  0 0 "[    .    1    .    2]" 1 
       1360 1  60 ASP H    1  61 ILE HG13 . . 4.560 4.394 4.299 4.517     .  0 0 "[    .    1    .    2]" 1 
       1361 1  60 ASP QB   1  61 ILE H    . . 3.990 3.727 3.650 3.907     .  0 0 "[    .    1    .    2]" 1 
       1362 1  60 ASP QB   1  61 ILE MD   . . 4.150 2.978 2.667 3.364     .  0 0 "[    .    1    .    2]" 1 
       1363 1  60 ASP QB   1  61 ILE QG   . . 5.010 3.523 3.313 4.313     .  0 0 "[    .    1    .    2]" 1 
       1364 1  60 ASP HB2  1  61 ILE H    . . 4.630 3.975 3.877 4.214     .  0 0 "[    .    1    .    2]" 1 
       1365 1  60 ASP HB2  1  61 ILE MD   . . 4.780 3.074 2.720 3.451     .  0 0 "[    .    1    .    2]" 1 
       1366 1  60 ASP HB3  1  61 ILE H    . . 4.630 4.505 4.450 4.622     .  0 0 "[    .    1    .    2]" 1 
       1367 1  60 ASP HB3  1  61 ILE MD   . . 4.780 4.004 3.610 4.658     .  0 0 "[    .    1    .    2]" 1 
       1368 1  61 ILE H    1  61 ILE HB   . . 2.990 2.844 2.775 2.919     .  0 0 "[    .    1    .    2]" 1 
       1369 1  61 ILE H    1  61 ILE MD   . . 3.510 3.430 3.172 3.510     .  0 0 "[    .    1    .    2]" 1 
       1370 1  61 ILE H    1  61 ILE HG12 . . 3.880 2.364 2.138 2.434     .  0 0 "[    .    1    .    2]" 1 
       1371 1  61 ILE H    1  61 ILE QG   . . 3.320 2.343 2.124 2.410     .  0 0 "[    .    1    .    2]" 1 
       1372 1  61 ILE H    1  61 ILE HG13 . . 3.880 3.841 3.678 3.880 0.000 14 0 "[    .    1    .    2]" 1 
       1373 1  61 ILE H    1  61 ILE MG   . . 4.080 3.908 3.848 3.931     .  0 0 "[    .    1    .    2]" 1 
       1374 1  61 ILE H    1  62 ILE H    . . 4.500 4.231 4.099 4.305     .  0 0 "[    .    1    .    2]" 1 
       1375 1  61 ILE HA   1  61 ILE MD   . . 3.610 2.366 2.186 2.487     .  0 0 "[    .    1    .    2]" 1 
       1376 1  61 ILE HA   1  61 ILE MG   . . 3.380 2.116 2.073 2.147     .  0 0 "[    .    1    .    2]" 1 
       1377 1  61 ILE HA   1  62 ILE H    . . 2.950 2.145 2.139 2.163     .  0 0 "[    .    1    .    2]" 1 
       1378 1  61 ILE HA   1  62 ILE HA   . . 4.970 4.400 4.386 4.426     .  0 0 "[    .    1    .    2]" 1 
       1379 1  61 ILE HA   1  62 ILE HB   . . 4.890 4.474 4.449 4.499     .  0 0 "[    .    1    .    2]" 1 
       1380 1  61 ILE HB   1  61 ILE MD   . . 3.490 3.219 3.212 3.228     .  0 0 "[    .    1    .    2]" 1 
       1381 1  61 ILE HB   1  62 ILE H    . . 4.250 4.149 4.048 4.240     .  0 0 "[    .    1    .    2]" 1 
       1382 1  61 ILE HB   1  62 ILE HA   . . 5.500 4.781 4.728 4.838     .  0 0 "[    .    1    .    2]" 1 
       1383 1  61 ILE MD   1  62 ILE H    . . 4.380 4.116 3.990 4.204     .  0 0 "[    .    1    .    2]" 1 
       1384 1  61 ILE QG   1  61 ILE MG   . . 3.050 2.305 2.258 2.343     .  0 0 "[    .    1    .    2]" 1 
       1385 1  61 ILE HG12 1  61 ILE MG   . . 3.520 3.190 3.187 3.195     .  0 0 "[    .    1    .    2]" 1 
       1386 1  61 ILE HG13 1  61 ILE MG   . . 3.520 2.365 2.310 2.411     .  0 0 "[    .    1    .    2]" 1 
       1387 1  61 ILE MG   1  62 ILE H    . . 3.230 2.909 2.740 3.164     .  0 0 "[    .    1    .    2]" 1 
       1388 1  61 ILE MG   1  62 ILE HA   . . 5.080 4.350 4.228 4.493     .  0 0 "[    .    1    .    2]" 1 
       1389 1  62 ILE H    1  62 ILE HB   . . 3.440 2.369 2.335 2.403     .  0 0 "[    .    1    .    2]" 1 
       1390 1  62 ILE H    1  62 ILE MD   . . 4.440 3.819 3.664 3.946     .  0 0 "[    .    1    .    2]" 1 
       1391 1  62 ILE H    1  62 ILE HG12 . . 4.980 3.979 3.897 4.094     .  0 0 "[    .    1    .    2]" 1 
       1392 1  62 ILE H    1  62 ILE HG13 . . 3.890 2.784 2.650 2.887     .  0 0 "[    .    1    .    2]" 1 
       1393 1  62 ILE H    1  62 ILE MG   . . 4.180 3.713 3.692 3.731     .  0 0 "[    .    1    .    2]" 1 
       1394 1  62 ILE H    1  63 ALA H    . . 4.720 4.554 4.523 4.600     .  0 0 "[    .    1    .    2]" 1 
       1395 1  62 ILE HA   1  62 ILE MD   . . 4.040 3.793 3.766 3.810     .  0 0 "[    .    1    .    2]" 1 
       1396 1  62 ILE HA   1  62 ILE HG12 . . 3.410 2.483 2.402 2.560     .  0 0 "[    .    1    .    2]" 1 
       1397 1  62 ILE HA   1  62 ILE HG13 . . 3.670 2.783 2.687 2.896     .  0 0 "[    .    1    .    2]" 1 
       1398 1  62 ILE HA   1  62 ILE MG   . . 3.530 2.470 2.434 2.533     .  0 0 "[    .    1    .    2]" 1 
       1399 1  62 ILE HA   1  63 ALA H    . . 3.010 2.206 2.182 2.262     .  0 0 "[    .    1    .    2]" 1 
       1400 1  62 ILE HA   1  63 ALA HA   . . 4.920 4.379 4.374 4.389     .  0 0 "[    .    1    .    2]" 1 
       1401 1  62 ILE HA   1  63 ALA MB   . . 4.020 3.914 3.848 3.957     .  0 0 "[    .    1    .    2]" 1 
       1402 1  62 ILE HB   1  62 ILE MD   . . 3.440 2.360 2.256 2.460     .  0 0 "[    .    1    .    2]" 1 
       1403 1  62 ILE HB   1  63 ALA H    . . 4.180 4.122 3.986 4.181 0.001 15 0 "[    .    1    .    2]" 1 
       1404 1  62 ILE HB   1  63 ALA HA   . . 5.500 5.056 4.980 5.111     .  0 0 "[    .    1    .    2]" 1 
       1405 1  62 ILE HB   1  78 LEU MD2  . . 3.340 2.888 2.468 3.185     .  0 0 "[    .    1    .    2]" 1 
       1406 1  62 ILE MD   1  62 ILE MG   . . 2.990 2.018 1.907 2.172     .  0 0 "[    .    1    .    2]" 1 
       1407 1  62 ILE MD   1  63 ALA H    . . 4.890 4.828 4.726 4.890 0.000 16 0 "[    .    1    .    2]" 1 
       1408 1  62 ILE MD   1  78 LEU MD1  . . 3.910 3.026 2.547 3.391     .  0 0 "[    .    1    .    2]" 1 
       1409 1  62 ILE MD   1  78 LEU MD2  . . 3.650 2.146 1.869 2.551     .  0 0 "[    .    1    .    2]" 1 
       1410 1  62 ILE HG12 1  63 ALA H    . . 3.990 3.956 3.888 3.995 0.005 15 0 "[    .    1    .    2]" 1 
       1411 1  62 ILE HG13 1  63 ALA H    . . 5.190 4.767 4.671 4.871     .  0 0 "[    .    1    .    2]" 1 
       1412 1  62 ILE MG   1  63 ALA H    . . 3.490 2.081 1.913 2.284     .  0 0 "[    .    1    .    2]" 1 
       1413 1  62 ILE MG   1  63 ALA HA   . . 4.810 3.594 3.458 3.642     .  0 0 "[    .    1    .    2]" 1 
       1414 1  62 ILE MG   1  63 ALA MB   . . 4.240 3.671 3.621 3.749     .  0 0 "[    .    1    .    2]" 1 
       1415 1  62 ILE MG   1  64 ILE H    . . 5.380 4.005 3.803 4.152     .  0 0 "[    .    1    .    2]" 1 
       1416 1  62 ILE MG   1  64 ILE HA   . . 5.050 3.998 3.898 4.084     .  0 0 "[    .    1    .    2]" 1 
       1417 1  62 ILE MG   1  64 ILE HG12 . . 3.490 2.733 2.491 2.917     .  0 0 "[    .    1    .    2]" 1 
       1418 1  62 ILE MG   1  64 ILE HG13 . . 3.640 2.522 2.276 2.840     .  0 0 "[    .    1    .    2]" 1 
       1419 1  63 ALA H    1  63 ALA MB   . . 3.170 2.339 2.266 2.416     .  0 0 "[    .    1    .    2]" 1 
       1420 1  63 ALA H    1  64 ILE H    . . 4.770 4.418 4.360 4.470     .  0 0 "[    .    1    .    2]" 1 
       1421 1  63 ALA HA   1  64 ILE H    . . 3.010 2.150 2.141 2.166     .  0 0 "[    .    1    .    2]" 1 
       1422 1  63 ALA HA   1  64 ILE HA   . . 5.290 4.395 4.392 4.401     .  0 0 "[    .    1    .    2]" 1 
       1423 1  63 ALA HA   1  64 ILE HB   . . 5.500 4.704 4.629 4.818     .  0 0 "[    .    1    .    2]" 1 
       1424 1  63 ALA HA   1  64 ILE HG13 . . 4.420 3.616 3.490 3.807     .  0 0 "[    .    1    .    2]" 1 
       1425 1  63 ALA MB   1  64 ILE H    . . 3.450 3.138 3.023 3.233     .  0 0 "[    .    1    .    2]" 1 
       1426 1  64 ILE H    1  64 ILE HB   . . 3.610 2.703 2.597 2.812     .  0 0 "[    .    1    .    2]" 1 
       1427 1  64 ILE H    1  64 ILE MD   . . 3.950 3.937 3.874 3.952 0.002  2 0 "[    .    1    .    2]" 1 
       1428 1  64 ILE H    1  64 ILE HG12 . . 4.710 3.789 3.573 3.970     .  0 0 "[    .    1    .    2]" 1 
       1429 1  64 ILE H    1  64 ILE HG13 . . 3.910 2.622 2.480 2.757     .  0 0 "[    .    1    .    2]" 1 
       1430 1  64 ILE H    1  64 ILE MG   . . 4.050 3.876 3.832 3.909     .  0 0 "[    .    1    .    2]" 1 
       1431 1  64 ILE H    1  65 THR H    . . 4.650 4.349 4.259 4.440     .  0 0 "[    .    1    .    2]" 1 
       1432 1  64 ILE HA   1  64 ILE MD   . . 4.310 3.865 3.841 3.884     .  0 0 "[    .    1    .    2]" 1 
       1433 1  64 ILE HA   1  64 ILE MG   . . 3.440 2.286 2.173 2.409     .  0 0 "[    .    1    .    2]" 1 
       1434 1  64 ILE HA   1  65 THR H    . . 3.040 2.149 2.138 2.176     .  0 0 "[    .    1    .    2]" 1 
       1435 1  64 ILE HA   1  65 THR HA   . . 4.970 4.387 4.381 4.394     .  0 0 "[    .    1    .    2]" 1 
       1436 1  64 ILE HA   1  65 THR HB   . . 4.990 4.687 4.606 4.798     .  0 0 "[    .    1    .    2]" 1 
       1437 1  64 ILE HA   1  71 LEU MD2  . . 4.560 4.453 4.341 4.552     .  0 0 "[    .    1    .    2]" 1 
       1438 1  64 ILE HB   1  64 ILE MD   . . 3.230 2.354 2.270 2.464     .  0 0 "[    .    1    .    2]" 1 
       1439 1  64 ILE HB   1  65 THR H    . . 4.270 4.128 3.983 4.256     .  0 0 "[    .    1    .    2]" 1 
       1440 1  64 ILE HB   1  71 LEU HA   . . 4.770 4.457 4.232 4.625     .  0 0 "[    .    1    .    2]" 1 
       1441 1  64 ILE HB   1  71 LEU MD2  . . 3.140 2.916 2.743 3.091     .  0 0 "[    .    1    .    2]" 1 
       1442 1  64 ILE MD   1  74 ALA MB   . . 3.480 2.959 2.644 3.194     .  0 0 "[    .    1    .    2]" 1 
       1443 1  64 ILE MD   1  75 LYS H    . . 4.040 3.619 3.277 3.872     .  0 0 "[    .    1    .    2]" 1 
       1444 1  64 ILE MD   1  75 LYS HA   . . 3.750 2.656 2.408 2.873     .  0 0 "[    .    1    .    2]" 1 
       1445 1  64 ILE MD   1  75 LYS HB2  . . 3.550 3.102 2.883 3.270     .  0 0 "[    .    1    .    2]" 1 
       1446 1  64 ILE MD   1  75 LYS HB3  . . 5.030 4.441 4.204 4.566     .  0 0 "[    .    1    .    2]" 1 
       1447 1  64 ILE MD   1  75 LYS HG2  . . 5.140 4.406 4.101 4.694     .  0 0 "[    .    1    .    2]" 1 
       1448 1  64 ILE MD   1  75 LYS QG   . . 4.310 3.128 2.911 3.434     .  0 0 "[    .    1    .    2]" 1 
       1449 1  64 ILE MD   1  75 LYS HG3  . . 5.140 3.201 2.972 3.531     .  0 0 "[    .    1    .    2]" 1 
       1450 1  64 ILE MD   1  78 LEU QB   . . 3.950 3.072 2.848 3.378     .  0 0 "[    .    1    .    2]" 1 
       1451 1  64 ILE HG13 1  65 THR H    . . 5.330 5.100 5.040 5.187     .  0 0 "[    .    1    .    2]" 1 
       1452 1  64 ILE MG   1  65 THR H    . . 3.480 2.527 2.170 2.884     .  0 0 "[    .    1    .    2]" 1 
       1453 1  64 ILE MG   1  65 THR HA   . . 4.950 3.953 3.759 4.149     .  0 0 "[    .    1    .    2]" 1 
       1454 1  64 ILE MG   1  71 LEU HA   . . 4.010 3.181 2.915 3.578     .  0 0 "[    .    1    .    2]" 1 
       1455 1  64 ILE MG   1  74 ALA MB   . . 3.370 2.657 2.433 2.856     .  0 0 "[    .    1    .    2]" 1 
       1456 1  65 THR H    1  65 THR HB   . . 3.490 2.606 2.522 2.721     .  0 0 "[    .    1    .    2]" 1 
       1457 1  65 THR H    1  65 THR MG   . . 4.050 3.832 3.804 3.862     .  0 0 "[    .    1    .    2]" 1 
       1458 1  65 THR H    1  66 GLY H    . . 4.550 4.517 4.464 4.546     .  0 0 "[    .    1    .    2]" 1 
       1459 1  65 THR H    1  71 LEU MD2  . . 4.180 3.963 3.859 4.121     .  0 0 "[    .    1    .    2]" 1 
       1460 1  65 THR HA   1  65 THR MG   . . 3.520 2.379 2.270 2.431     .  0 0 "[    .    1    .    2]" 1 
       1461 1  65 THR HA   1  66 GLY H    . . 2.990 2.205 2.174 2.234     .  0 0 "[    .    1    .    2]" 1 
       1462 1  65 THR HA   1  66 GLY QA   . . 4.870 3.933 3.923 3.944     .  0 0 "[    .    1    .    2]" 1 
       1463 1  65 THR HA   1  71 LEU MD1  . . 4.600 4.178 3.987 4.389     .  0 0 "[    .    1    .    2]" 1 
       1464 1  65 THR HA   1  71 LEU MD2  . . 4.100 2.803 2.684 2.896     .  0 0 "[    .    1    .    2]" 1 
       1465 1  65 THR HB   1  66 GLY H    . . 4.350 3.972 3.820 4.076     .  0 0 "[    .    1    .    2]" 1 
       1466 1  65 THR MG   1  66 GLY H    . . 3.450 2.122 1.938 2.315     .  0 0 "[    .    1    .    2]" 1 
       1467 1  65 THR MG   1  66 GLY QA   . . 4.100 3.024 2.906 3.236     .  0 0 "[    .    1    .    2]" 1 
       1468 1  65 THR MG   1  71 LEU MD2  . . 4.550 3.832 3.647 3.953     .  0 0 "[    .    1    .    2]" 1 
       1469 1  66 GLY H    1  67 LEU H    . . 4.770 4.368 4.346 4.391     .  0 0 "[    .    1    .    2]" 1 
       1470 1  66 GLY H    1  71 LEU MD1  . . 3.880 3.445 3.214 3.582     .  0 0 "[    .    1    .    2]" 1 
       1471 1  66 GLY H    1  71 LEU MD2  . . 3.610 2.423 2.211 2.645     .  0 0 "[    .    1    .    2]" 1 
       1472 1  66 GLY H    1  71 LEU HG   . . 5.150 4.048 3.856 4.235     .  0 0 "[    .    1    .    2]" 1 
       1473 1  66 GLY QA   1  67 LEU HA   . . 4.080 3.963 3.954 3.971     .  0 0 "[    .    1    .    2]" 1 
       1474 1  66 GLY QA   1  71 LEU MD2  . . 3.730 2.297 2.120 2.446     .  0 0 "[    .    1    .    2]" 1 
       1475 1  66 GLY HA2  1  67 LEU H    . . 3.330 2.485 2.433 2.553     .  0 0 "[    .    1    .    2]" 1 
       1476 1  66 GLY HA2  1  67 LEU HA   . . 4.680 4.296 4.291 4.302     .  0 0 "[    .    1    .    2]" 1 
       1477 1  66 GLY HA2  1  71 LEU MD2  . . 4.260 3.563 3.360 3.723     .  0 0 "[    .    1    .    2]" 1 
       1478 1  66 GLY HA3  1  67 LEU H    . . 3.330 2.644 2.574 2.701     .  0 0 "[    .    1    .    2]" 1 
       1479 1  66 GLY HA3  1  67 LEU HA   . . 4.680 4.650 4.610 4.682 0.002 17 0 "[    .    1    .    2]" 1 
       1480 1  66 GLY HA3  1  71 LEU MD2  . . 4.260 2.326 2.144 2.480     .  0 0 "[    .    1    .    2]" 1 
       1481 1  67 LEU H    1  67 LEU HB2  . . 3.160 2.384 2.307 2.505     .  0 0 "[    .    1    .    2]" 1 
       1482 1  67 LEU H    1  67 LEU HB3  . . 3.720 3.571 3.551 3.587     .  0 0 "[    .    1    .    2]" 1 
       1483 1  67 LEU H    1  67 LEU MD1  . . 3.800 3.651 3.475 3.790     .  0 0 "[    .    1    .    2]" 1 
       1484 1  67 LEU H    1  67 LEU MD2  . . 3.580 3.505 3.317 3.578     .  0 0 "[    .    1    .    2]" 1 
       1485 1  67 LEU H    1  67 LEU HG   . . 3.350 2.448 2.204 2.615     .  0 0 "[    .    1    .    2]" 1 
       1486 1  67 LEU H    1  68 ALA H    . . 4.800 4.599 4.584 4.612     .  0 0 "[    .    1    .    2]" 1 
       1487 1  67 LEU H    1  70 ASN H    . . 5.020 3.901 3.716 4.035     .  0 0 "[    .    1    .    2]" 1 
       1488 1  67 LEU H    1  70 ASN HB2  . . 4.440 2.812 2.662 3.073     .  0 0 "[    .    1    .    2]" 1 
       1489 1  67 LEU H    1  70 ASN HB3  . . 4.840 4.249 4.092 4.501     .  0 0 "[    .    1    .    2]" 1 
       1490 1  67 LEU H    1  70 ASN HD21 . . 4.870 2.644 2.195 3.207     .  0 0 "[    .    1    .    2]" 1 
       1491 1  67 LEU H    1  70 ASN QD   . . 4.040 2.554 2.151 2.992     .  0 0 "[    .    1    .    2]" 1 
       1492 1  67 LEU H    1  70 ASN HD22 . . 4.870 3.445 3.084 3.722     .  0 0 "[    .    1    .    2]" 1 
       1493 1  67 LEU H    1  71 LEU MD2  . . 4.800 4.104 3.895 4.264     .  0 0 "[    .    1    .    2]" 1 
       1494 1  67 LEU H    1  71 LEU HG   . . 3.960 3.856 3.590 3.960     .  0 0 "[    .    1    .    2]" 1 
       1495 1  67 LEU HA   1  67 LEU MD1  . . 4.520 3.856 3.812 3.899     .  0 0 "[    .    1    .    2]" 1 
       1496 1  67 LEU HA   1  67 LEU MD2  . . 2.890 2.064 1.960 2.197     .  0 0 "[    .    1    .    2]" 1 
       1497 1  67 LEU HA   1  67 LEU HG   . . 4.170 3.023 2.955 3.111     .  0 0 "[    .    1    .    2]" 1 
       1498 1  67 LEU HA   1  68 ALA H    . . 3.010 2.195 2.180 2.216     .  0 0 "[    .    1    .    2]" 1 
       1499 1  67 LEU HA   1  68 ALA HA   . . 5.170 4.320 4.312 4.327     .  0 0 "[    .    1    .    2]" 1 
       1500 1  67 LEU HA   1  68 ALA MB   . . 4.480 4.077 4.048 4.100     .  0 0 "[    .    1    .    2]" 1 
       1501 1  67 LEU HA   1  69 ALA H    . . 4.880 4.037 3.801 4.204     .  0 0 "[    .    1    .    2]" 1 
       1502 1  67 LEU HA   1  70 ASN H    . . 4.940 4.506 4.384 4.657     .  0 0 "[    .    1    .    2]" 1 
       1503 1  67 LEU HA   1  71 LEU MD1  . . 4.670 3.570 3.453 3.765     .  0 0 "[    .    1    .    2]" 1 
       1504 1  67 LEU HA   1  71 LEU MD2  . . 4.870 4.761 4.612 4.860     .  0 0 "[    .    1    .    2]" 1 
       1505 1  67 LEU HB2  1  67 LEU MD1  . . 3.560 2.296 2.175 2.410     .  0 0 "[    .    1    .    2]" 1 
       1506 1  67 LEU HB2  1  68 ALA H    . . 4.240 4.118 4.005 4.181     .  0 0 "[    .    1    .    2]" 1 
       1507 1  67 LEU HB2  1  69 ALA H    . . 4.230 3.501 3.220 3.750     .  0 0 "[    .    1    .    2]" 1 
       1508 1  67 LEU HB2  1  69 ALA MB   . . 4.480 3.450 3.227 3.668     .  0 0 "[    .    1    .    2]" 1 
       1509 1  67 LEU HB2  1  70 ASN H    . . 3.840 2.628 2.499 2.766     .  0 0 "[    .    1    .    2]" 1 
       1510 1  67 LEU HB2  1  70 ASN HB2  . . 4.550 3.323 3.139 3.469     .  0 0 "[    .    1    .    2]" 1 
       1511 1  67 LEU HB2  1  70 ASN HB3  . . 4.920 4.507 4.430 4.642     .  0 0 "[    .    1    .    2]" 1 
       1512 1  67 LEU HB2  1  70 ASN HD21 . . 4.450 3.222 2.835 3.565     .  0 0 "[    .    1    .    2]" 1 
       1513 1  67 LEU HB2  1  70 ASN QD   . . 3.900 2.664 2.448 2.836     .  0 0 "[    .    1    .    2]" 1 
       1514 1  67 LEU HB2  1  70 ASN HD22 . . 4.450 2.861 2.582 3.135     .  0 0 "[    .    1    .    2]" 1 
       1515 1  67 LEU HB3  1  67 LEU MD1  . . 3.440 2.376 2.266 2.472     .  0 0 "[    .    1    .    2]" 1 
       1516 1  67 LEU HB3  1  67 LEU MD2  . . 3.230 2.315 2.245 2.357     .  0 0 "[    .    1    .    2]" 1 
       1517 1  67 LEU HB3  1  68 ALA H    . . 3.790 3.037 2.945 3.108     .  0 0 "[    .    1    .    2]" 1 
       1518 1  67 LEU HB3  1  69 ALA H    . . 4.070 2.720 2.489 2.968     .  0 0 "[    .    1    .    2]" 1 
       1519 1  67 LEU HB3  1  69 ALA MB   . . 4.870 3.198 3.011 3.415     .  0 0 "[    .    1    .    2]" 1 
       1520 1  67 LEU HB3  1  70 ASN H    . . 3.730 3.379 3.255 3.576     .  0 0 "[    .    1    .    2]" 1 
       1521 1  67 LEU HB3  1  70 ASN HB2  . . 4.920 4.781 4.523 4.915     .  0 0 "[    .    1    .    2]" 1 
       1522 1  67 LEU HB3  1  70 ASN QD   . . 4.320 4.156 3.926 4.318     .  0 0 "[    .    1    .    2]" 1 
       1523 1  67 LEU MD1  1  68 ALA H    . . 5.000 4.844 4.709 4.956     .  0 0 "[    .    1    .    2]" 1 
       1524 1  67 LEU MD1  1  69 ALA H    . . 4.900 4.387 4.240 4.484     .  0 0 "[    .    1    .    2]" 1 
       1525 1  67 LEU MD1  1  70 ASN HD21 . . 4.140 3.775 3.356 4.095     .  0 0 "[    .    1    .    2]" 1 
       1526 1  67 LEU MD1  1  70 ASN HD22 . . 4.140 2.651 2.259 3.129     .  0 0 "[    .    1    .    2]" 1 
       1527 1  67 LEU MD2  1  68 ALA H    . . 3.760 3.260 3.100 3.551     .  0 0 "[    .    1    .    2]" 1 
       1528 1  67 LEU MD2  1  69 ALA H    . . 4.990 4.379 4.143 4.688     .  0 0 "[    .    1    .    2]" 1 
       1529 1  67 LEU HG   1  68 ALA H    . . 5.270 4.980 4.896 5.071     .  0 0 "[    .    1    .    2]" 1 
       1530 1  67 LEU HG   1  70 ASN HD21 . . 5.100 3.788 3.318 4.348     .  0 0 "[    .    1    .    2]" 1 
       1531 1  67 LEU HG   1  70 ASN QD   . . 4.450 3.219 2.779 3.527     .  0 0 "[    .    1    .    2]" 1 
       1532 1  67 LEU HG   1  70 ASN HD22 . . 5.100 3.506 2.983 3.942     .  0 0 "[    .    1    .    2]" 1 
       1533 1  68 ALA H    1  68 ALA MB   . . 3.020 2.258 2.202 2.267     .  0 0 "[    .    1    .    2]" 1 
       1534 1  68 ALA H    1  69 ALA H    . . 3.910 2.976 2.899 3.026     .  0 0 "[    .    1    .    2]" 1 
       1535 1  68 ALA H    1  70 ASN H    . . 5.020 4.554 4.432 4.683     .  0 0 "[    .    1    .    2]" 1 
       1536 1  68 ALA H    1  71 LEU H    . . 5.460 4.726 4.628 4.799     .  0 0 "[    .    1    .    2]" 1 
       1537 1  68 ALA H    1  71 LEU MD1  . . 4.530 3.000 2.858 3.150     .  0 0 "[    .    1    .    2]" 1 
       1538 1  68 ALA HA   1  70 ASN H    . . 4.910 4.700 4.505 4.875     .  0 0 "[    .    1    .    2]" 1 
       1539 1  68 ALA HA   1  71 LEU H    . . 4.150 3.710 3.516 3.928     .  0 0 "[    .    1    .    2]" 1 
       1540 1  68 ALA HA   1  71 LEU HB2  . . 3.970 2.806 2.667 2.877     .  0 0 "[    .    1    .    2]" 1 
       1541 1  68 ALA HA   1  71 LEU HB3  . . 4.310 4.268 4.138 4.311 0.001 16 0 "[    .    1    .    2]" 1 
       1542 1  68 ALA HA   1  71 LEU MD1  . . 3.340 1.980 1.858 2.160     .  0 0 "[    .    1    .    2]" 1 
       1543 1  68 ALA HA   1  71 LEU MD2  . . 4.600 4.349 4.211 4.473     .  0 0 "[    .    1    .    2]" 1 
       1544 1  68 ALA HA   1  71 LEU HG   . . 3.750 3.225 3.069 3.432     .  0 0 "[    .    1    .    2]" 1 
       1545 1  68 ALA HA   1  72 ASP H    . . 4.800 4.341 4.212 4.577     .  0 0 "[    .    1    .    2]" 1 
       1546 1  68 ALA MB   1  69 ALA H    . . 3.340 2.634 2.504 2.845     .  0 0 "[    .    1    .    2]" 1 
       1547 1  68 ALA MB   1  71 LEU MD1  . . 3.740 3.168 3.032 3.289     .  0 0 "[    .    1    .    2]" 1 
       1548 1  69 ALA H    1  69 ALA MB   . . 2.950 2.119 2.029 2.241     .  0 0 "[    .    1    .    2]" 1 
       1549 1  69 ALA H    1  70 ASN H    . . 3.360 2.675 2.494 2.794     .  0 0 "[    .    1    .    2]" 1 
       1550 1  69 ALA H    1  71 LEU H    . . 4.580 4.068 3.729 4.293     .  0 0 "[    .    1    .    2]" 1 
       1551 1  69 ALA HA   1  71 LEU H    . . 5.070 4.617 4.209 4.877     .  0 0 "[    .    1    .    2]" 1 
       1552 1  69 ALA HA   1  72 ASP H    . . 4.310 3.776 3.605 3.901     .  0 0 "[    .    1    .    2]" 1 
       1553 1  69 ALA HA   1  72 ASP HB2  . . 4.320 3.142 3.014 3.206     .  0 0 "[    .    1    .    2]" 1 
       1554 1  69 ALA HA   1  72 ASP HB3  . . 4.770 4.721 4.614 4.771 0.001 16 0 "[    .    1    .    2]" 1 
       1555 1  69 ALA MB   1  70 ASN H    . . 3.540 2.493 2.243 2.638     .  0 0 "[    .    1    .    2]" 1 
       1556 1  69 ALA MB   1  70 ASN HA   . . 4.450 3.734 3.640 3.805     .  0 0 "[    .    1    .    2]" 1 
       1557 1  69 ALA MB   1  73 ARG QD   . . 4.900 4.423 3.669 4.894     .  0 0 "[    .    1    .    2]" 1 
       1558 1  70 ASN H    1  70 ASN HB2  . . 3.380 2.659 2.501 2.756     .  0 0 "[    .    1    .    2]" 1 
       1559 1  70 ASN H    1  70 ASN HB3  . . 3.700 3.586 3.569 3.597     .  0 0 "[    .    1    .    2]" 1 
       1560 1  70 ASN H    1  70 ASN QD   . . 4.320 3.649 3.465 3.775     .  0 0 "[    .    1    .    2]" 1 
       1561 1  70 ASN H    1  72 ASP H    . . 4.550 4.157 4.015 4.295     .  0 0 "[    .    1    .    2]" 1 
       1562 1  70 ASN HA   1  70 ASN HD22 . . 4.980 4.782 4.690 4.847     .  0 0 "[    .    1    .    2]" 1 
       1563 1  70 ASN HA   1  72 ASP H    . . 4.970 4.132 4.003 4.256     .  0 0 "[    .    1    .    2]" 1 
       1564 1  70 ASN HA   1  73 ARG H    . . 4.400 3.492 3.252 3.742     .  0 0 "[    .    1    .    2]" 1 
       1565 1  70 ASN HA   1  73 ARG QB   . . 4.320 3.664 3.254 4.182     .  0 0 "[    .    1    .    2]" 1 
       1566 1  70 ASN HA   1  73 ARG QD   . . 3.890 3.136 2.253 3.850     .  0 0 "[    .    1    .    2]" 1 
       1567 1  70 ASN HA   1  73 ARG HG2  . . 4.990 3.149 1.996 3.946     .  0 0 "[    .    1    .    2]" 1 
       1568 1  70 ASN HA   1  73 ARG QG   . . 4.260 2.100 1.949 2.254     .  0 0 "[    .    1    .    2]" 1 
       1569 1  70 ASN HA   1  73 ARG HG3  . . 4.990 2.420 2.013 3.042     .  0 0 "[    .    1    .    2]" 1 
       1570 1  70 ASN HA   1  74 ALA H    . . 4.890 3.861 3.700 4.065     .  0 0 "[    .    1    .    2]" 1 
       1571 1  70 ASN HB2  1  70 ASN QD   . . 3.440 2.402 2.226 2.547     .  0 0 "[    .    1    .    2]" 1 
       1572 1  70 ASN HB2  1  70 ASN HD22 . . 3.980 3.565 3.487 3.632     .  0 0 "[    .    1    .    2]" 1 
       1573 1  70 ASN HB2  1  71 LEU H    . . 4.070 2.552 2.328 2.908     .  0 0 "[    .    1    .    2]" 1 
       1574 1  70 ASN HB2  1  71 LEU MD2  . . 4.760 3.778 3.591 4.011     .  0 0 "[    .    1    .    2]" 1 
       1575 1  70 ASN HB2  1  74 ALA MB   . . 4.740 4.480 4.204 4.667     .  0 0 "[    .    1    .    2]" 1 
       1576 1  70 ASN HB3  1  70 ASN HD22 . . 4.050 3.656 3.584 3.763     .  0 0 "[    .    1    .    2]" 1 
       1577 1  70 ASN HB3  1  71 LEU H    . . 4.450 3.760 3.500 4.064     .  0 0 "[    .    1    .    2]" 1 
       1578 1  70 ASN HB3  1  71 LEU HA   . . 5.080 4.627 4.395 4.806     .  0 0 "[    .    1    .    2]" 1 
       1579 1  70 ASN HB3  1  71 LEU MD2  . . 5.010 4.808 4.642 4.967     .  0 0 "[    .    1    .    2]" 1 
       1580 1  71 LEU H    1  71 LEU HB2  . . 3.460 2.656 2.593 2.696     .  0 0 "[    .    1    .    2]" 1 
       1581 1  71 LEU H    1  71 LEU HB3  . . 3.680 3.584 3.576 3.593     .  0 0 "[    .    1    .    2]" 1 
       1582 1  71 LEU H    1  71 LEU MD1  . . 3.630 3.389 3.311 3.471     .  0 0 "[    .    1    .    2]" 1 
       1583 1  71 LEU H    1  71 LEU MD2  . . 3.780 3.241 3.118 3.375     .  0 0 "[    .    1    .    2]" 1 
       1584 1  71 LEU H    1  71 LEU HG   . . 3.320 1.957 1.903 2.059     .  0 0 "[    .    1    .    2]" 1 
       1585 1  71 LEU H    1  72 ASP H    . . 3.380 2.782 2.540 2.957     .  0 0 "[    .    1    .    2]" 1 
       1586 1  71 LEU HA   1  71 LEU MD1  . . 4.160 3.943 3.905 3.973     .  0 0 "[    .    1    .    2]" 1 
       1587 1  71 LEU HA   1  71 LEU MD2  . . 3.140 2.375 2.148 2.478     .  0 0 "[    .    1    .    2]" 1 
       1588 1  71 LEU HA   1  71 LEU HG   . . 4.040 3.080 3.018 3.123     .  0 0 "[    .    1    .    2]" 1 
       1589 1  71 LEU HA   1  73 ARG H    . . 5.260 4.823 4.404 5.167     .  0 0 "[    .    1    .    2]" 1 
       1590 1  71 LEU HA   1  74 ALA H    . . 4.060 3.802 3.623 3.970     .  0 0 "[    .    1    .    2]" 1 
       1591 1  71 LEU HA   1  74 ALA MB   . . 3.430 2.803 2.466 3.029     .  0 0 "[    .    1    .    2]" 1 
       1592 1  71 LEU HA   1  75 LYS H    . . 4.500 3.339 3.144 3.462     .  0 0 "[    .    1    .    2]" 1 
       1593 1  71 LEU HB2  1  71 LEU MD1  . . 3.120 2.138 2.047 2.306     .  0 0 "[    .    1    .    2]" 1 
       1594 1  71 LEU HB2  1  71 LEU MD2  . . 3.620 3.163 3.149 3.176     .  0 0 "[    .    1    .    2]" 1 
       1595 1  71 LEU HB2  1  72 ASP H    . . 3.750 2.664 2.513 2.846     .  0 0 "[    .    1    .    2]" 1 
       1596 1  71 LEU HB3  1  71 LEU MD1  . . 3.340 2.492 2.368 2.588     .  0 0 "[    .    1    .    2]" 1 
       1597 1  71 LEU HB3  1  71 LEU MD2  . . 3.280 2.158 2.110 2.252     .  0 0 "[    .    1    .    2]" 1 
       1598 1  71 LEU HB3  1  72 ASP H    . . 4.060 3.803 3.657 3.950     .  0 0 "[    .    1    .    2]" 1 
       1599 1  71 LEU HB3  1  72 ASP HA   . . 4.830 4.563 4.435 4.665     .  0 0 "[    .    1    .    2]" 1 
       1600 1  71 LEU HB3  1  75 LYS H    . . 5.200 4.535 4.322 4.697     .  0 0 "[    .    1    .    2]" 1 
       1601 1  71 LEU HB3  1  75 LYS HB2  . . 4.440 3.815 3.563 3.940     .  0 0 "[    .    1    .    2]" 1 
       1602 1  71 LEU MD1  1  72 ASP H    . . 4.510 4.351 4.164 4.501     .  0 0 "[    .    1    .    2]" 1 
       1603 1  71 LEU MD2  1  72 ASP H    . . 4.780 4.751 4.691 4.781 0.001 13 0 "[    .    1    .    2]" 1 
       1604 1  71 LEU HG   1  72 ASP H    . . 4.420 4.190 4.105 4.278     .  0 0 "[    .    1    .    2]" 1 
       1605 1  72 ASP H    1  72 ASP HB2  . . 3.170 2.201 2.181 2.237     .  0 0 "[    .    1    .    2]" 1 
       1606 1  72 ASP H    1  72 ASP HB3  . . 3.590 3.505 3.488 3.526     .  0 0 "[    .    1    .    2]" 1 
       1607 1  72 ASP H    1  73 ARG H    . . 3.420 2.799 2.626 2.920     .  0 0 "[    .    1    .    2]" 1 
       1608 1  72 ASP H    1  74 ALA H    . . 4.410 4.205 3.699 4.412 0.002  2 0 "[    .    1    .    2]" 1 
       1609 1  72 ASP H    1  75 LYS H    . . 4.880 4.665 4.435 4.824     .  0 0 "[    .    1    .    2]" 1 
       1610 1  72 ASP HA   1  74 ALA H    . . 5.000 4.768 4.197 4.999     .  0 0 "[    .    1    .    2]" 1 
       1611 1  72 ASP HA   1  75 LYS H    . . 4.310 4.037 3.701 4.237     .  0 0 "[    .    1    .    2]" 1 
       1612 1  72 ASP HA   1  75 LYS HB2  . . 4.430 4.003 3.872 4.123     .  0 0 "[    .    1    .    2]" 1 
       1613 1  72 ASP HA   1  75 LYS HB3  . . 3.700 3.049 2.833 3.280     .  0 0 "[    .    1    .    2]" 1 
       1614 1  72 ASP HA   1  75 LYS QD   . . 4.380 3.707 3.350 3.983     .  0 0 "[    .    1    .    2]" 1 
       1615 1  72 ASP HA   1  76 ALA H    . . 4.410 4.024 3.759 4.244     .  0 0 "[    .    1    .    2]" 1 
       1616 1  72 ASP HA   1  76 ALA MB   . . 4.770 4.318 4.057 4.514     .  0 0 "[    .    1    .    2]" 1 
       1617 1  72 ASP HB2  1  73 ARG H    . . 3.610 2.562 2.417 2.760     .  0 0 "[    .    1    .    2]" 1 
       1618 1  72 ASP HB2  1  73 ARG HA   . . 4.940 4.683 4.622 4.720     .  0 0 "[    .    1    .    2]" 1 
       1619 1  72 ASP HB2  1  73 ARG QB   . . 5.380 4.785 4.415 5.030     .  0 0 "[    .    1    .    2]" 1 
       1620 1  72 ASP HB2  1  73 ARG QG   . . 5.340 3.495 3.198 3.963     .  0 0 "[    .    1    .    2]" 1 
       1621 1  72 ASP HB3  1  73 ARG H    . . 3.700 2.986 2.731 3.262     .  0 0 "[    .    1    .    2]" 1 
       1622 1  72 ASP HB3  1  73 ARG HA   . . 4.460 3.965 3.875 4.066     .  0 0 "[    .    1    .    2]" 1 
       1623 1  72 ASP HB3  1  73 ARG QB   . . 5.500 4.792 4.304 5.116     .  0 0 "[    .    1    .    2]" 1 
       1624 1  72 ASP HB3  1  73 ARG QG   . . 5.340 3.915 3.462 4.616     .  0 0 "[    .    1    .    2]" 1 
       1625 1  73 ARG H    1  73 ARG QB   . . 3.070 2.711 2.540 2.808     .  0 0 "[    .    1    .    2]" 1 
       1626 1  73 ARG H    1  73 ARG QD   . . 4.260 3.877 3.699 4.062     .  0 0 "[    .    1    .    2]" 1 
       1627 1  73 ARG H    1  73 ARG HG2  . . 3.840 2.053 1.900 2.213     .  0 0 "[    .    1    .    2]" 1 
       1628 1  73 ARG H    1  73 ARG HG3  . . 3.840 2.495 2.095 3.210     .  0 0 "[    .    1    .    2]" 1 
       1629 1  73 ARG H    1  74 ALA MB   . . 4.470 4.371 4.239 4.460     .  0 0 "[    .    1    .    2]" 1 
       1630 1  73 ARG H    1  75 LYS H    . . 4.740 4.498 4.327 4.637     .  0 0 "[    .    1    .    2]" 1 
       1631 1  73 ARG H    1  76 ALA H    . . 5.280 4.757 4.684 4.824     .  0 0 "[    .    1    .    2]" 1 
       1632 1  73 ARG H    1  76 ALA MB   . . 4.760 4.557 4.425 4.627     .  0 0 "[    .    1    .    2]" 1 
       1633 1  73 ARG HA   1  73 ARG QD   . . 4.520 4.095 3.711 4.466     .  0 0 "[    .    1    .    2]" 1 
       1634 1  73 ARG HA   1  73 ARG HG2  . . 3.770 3.151 2.775 3.722     .  0 0 "[    .    1    .    2]" 1 
       1635 1  73 ARG HA   1  73 ARG HG3  . . 3.770 3.745 3.710 3.804 0.034 17 0 "[    .    1    .    2]" 1 
       1636 1  73 ARG HA   1  76 ALA H    . . 3.860 3.785 3.646 3.858     .  0 0 "[    .    1    .    2]" 1 
       1637 1  73 ARG HA   1  76 ALA MB   . . 3.250 2.739 2.613 2.928     .  0 0 "[    .    1    .    2]" 1 
       1638 1  73 ARG HA   1  77 GLY H    . . 4.750 4.621 4.437 4.746     .  0 0 "[    .    1    .    2]" 1 
       1639 1  73 ARG QB   1  73 ARG QD   . . 3.110 2.165 2.008 2.421     .  0 0 "[    .    1    .    2]" 1 
       1640 1  73 ARG QB   1  74 ALA H    . . 3.540 2.690 2.209 3.527     .  0 0 "[    .    1    .    2]" 1 
       1641 1  73 ARG QB   1  74 ALA HA   . . 5.280 3.899 3.700 4.330     .  0 0 "[    .    1    .    2]" 1 
       1642 1  73 ARG QD   1  74 ALA H    . . 4.990 4.408 3.792 4.968     .  0 0 "[    .    1    .    2]" 1 
       1643 1  73 ARG QG   1  74 ALA H    . . 3.630 2.791 1.859 3.346     .  0 0 "[    .    1    .    2]" 1 
       1644 1  73 ARG HG2  1  74 ALA H    . . 4.220 3.663 2.643 4.231 0.011  2 0 "[    .    1    .    2]" 1 
       1645 1  73 ARG HG3  1  74 ALA H    . . 4.220 2.904 1.900 3.508     .  0 0 "[    .    1    .    2]" 1 
       1646 1  74 ALA H    1  74 ALA MB   . . 3.050 2.102 2.025 2.266     .  0 0 "[    .    1    .    2]" 1 
       1647 1  74 ALA H    1  75 LYS H    . . 3.410 2.873 2.581 3.007     .  0 0 "[    .    1    .    2]" 1 
       1648 1  74 ALA H    1  75 LYS HB3  . . 5.290 5.021 4.775 5.251     .  0 0 "[    .    1    .    2]" 1 
       1649 1  74 ALA H    1  76 ALA H    . . 4.450 4.081 3.743 4.329     .  0 0 "[    .    1    .    2]" 1 
       1650 1  74 ALA H    1  77 GLY H    . . 5.110 4.855 4.710 4.951     .  0 0 "[    .    1    .    2]" 1 
       1651 1  74 ALA HA   1  76 ALA H    . . 5.280 4.307 4.105 4.632     .  0 0 "[    .    1    .    2]" 1 
       1652 1  74 ALA HA   1  77 GLY H    . . 4.210 3.432 3.324 3.564     .  0 0 "[    .    1    .    2]" 1 
       1653 1  74 ALA HA   1  77 GLY HA3  . . 5.150 4.039 3.762 4.301     .  0 0 "[    .    1    .    2]" 1 
       1654 1  74 ALA HA   1  78 LEU H    . . 4.620 4.465 4.216 4.620     . 12 0 "[    .    1    .    2]" 1 
       1655 1  74 ALA MB   1  75 LYS H    . . 3.340 2.266 2.130 2.438     .  0 0 "[    .    1    .    2]" 1 
       1656 1  74 ALA MB   1  75 LYS HA   . . 3.790 3.637 3.564 3.771     .  0 0 "[    .    1    .    2]" 1 
       1657 1  74 ALA MB   1  75 LYS HB2  . . 4.730 3.898 3.806 4.017     .  0 0 "[    .    1    .    2]" 1 
       1658 1  74 ALA MB   1  75 LYS HB3  . . 4.700 4.564 4.483 4.651     .  0 0 "[    .    1    .    2]" 1 
       1659 1  75 LYS H    1  75 LYS HB2  . . 3.250 2.391 2.283 2.478     .  0 0 "[    .    1    .    2]" 1 
       1660 1  75 LYS H    1  75 LYS HB3  . . 3.230 2.677 2.566 2.820     .  0 0 "[    .    1    .    2]" 1 
       1661 1  75 LYS H    1  75 LYS QD   . . 4.620 4.394 4.363 4.433     .  0 0 "[    .    1    .    2]" 1 
       1662 1  75 LYS H    1  75 LYS QG   . . 4.240 3.944 3.894 3.967     .  0 0 "[    .    1    .    2]" 1 
       1663 1  75 LYS H    1  76 ALA H    . . 3.470 2.842 2.691 2.933     .  0 0 "[    .    1    .    2]" 1 
       1664 1  75 LYS H    1  77 GLY H    . . 4.810 4.265 3.956 4.412     .  0 0 "[    .    1    .    2]" 1 
       1665 1  75 LYS HA   1  75 LYS QD   . . 4.500 4.039 3.992 4.077     .  0 0 "[    .    1    .    2]" 1 
       1666 1  75 LYS HA   1  75 LYS QE   . . 4.870 4.673 4.587 4.855     .  0 0 "[    .    1    .    2]" 1 
       1667 1  75 LYS HA   1  75 LYS HG2  . . 3.960 2.950 2.771 3.071     .  0 0 "[    .    1    .    2]" 1 
       1668 1  75 LYS HA   1  75 LYS QG   . . 3.410 2.443 2.379 2.495     .  0 0 "[    .    1    .    2]" 1 
       1669 1  75 LYS HA   1  75 LYS HG3  . . 3.960 2.612 2.521 2.723     .  0 0 "[    .    1    .    2]" 1 
       1670 1  75 LYS HA   1  77 GLY H    . . 4.370 4.223 3.772 4.359     .  0 0 "[    .    1    .    2]" 1 
       1671 1  75 LYS HA   1  78 LEU H    . . 4.000 3.506 3.334 3.686     .  0 0 "[    .    1    .    2]" 1 
       1672 1  75 LYS HA   1  78 LEU HB2  . . 4.080 3.488 3.339 3.576     .  0 0 "[    .    1    .    2]" 1 
       1673 1  75 LYS HA   1  78 LEU QB   . . 3.580 3.010 2.868 3.172     .  0 0 "[    .    1    .    2]" 1 
       1674 1  75 LYS HA   1  78 LEU HB3  . . 4.080 3.301 3.058 3.591     .  0 0 "[    .    1    .    2]" 1 
       1675 1  75 LYS HA   1  78 LEU MD1  . . 5.280 5.184 5.030 5.266     .  0 0 "[    .    1    .    2]" 1 
       1676 1  75 LYS HA   1  78 LEU MD2  . . 4.380 3.794 3.542 4.073     .  0 0 "[    .    1    .    2]" 1 
       1677 1  75 LYS HA   1  79 LEU H    . . 4.640 3.946 3.822 4.106     .  0 0 "[    .    1    .    2]" 1 
       1678 1  75 LYS HA   1  79 LEU MD1  . . 4.920 4.419 4.231 4.596     .  0 0 "[    .    1    .    2]" 1 
       1679 1  75 LYS HA   1  79 LEU HG   . . 4.890 4.109 4.022 4.211     .  0 0 "[    .    1    .    2]" 1 
       1680 1  75 LYS HB2  1  76 ALA H    . . 3.950 3.840 3.716 3.946     .  0 0 "[    .    1    .    2]" 1 
       1681 1  75 LYS HB2  1  79 LEU MD1  . . 5.500 4.706 4.634 4.801     .  0 0 "[    .    1    .    2]" 1 
       1682 1  75 LYS HB3  1  75 LYS QD   . . 3.390 2.264 2.151 2.377     .  0 0 "[    .    1    .    2]" 1 
       1683 1  75 LYS HB3  1  75 LYS QE   . . 3.960 3.821 3.630 3.960     . 12 0 "[    .    1    .    2]" 1 
       1684 1  75 LYS HB3  1  76 ALA H    . . 3.480 2.625 2.421 2.840     .  0 0 "[    .    1    .    2]" 1 
       1685 1  75 LYS HB3  1  77 GLY H    . . 5.380 5.001 4.634 5.236     .  0 0 "[    .    1    .    2]" 1 
       1686 1  75 LYS HB3  1  79 LEU MD1  . . 3.900 3.822 3.627 3.900     .  8 0 "[    .    1    .    2]" 1 
       1687 1  75 LYS QD   1  76 ALA H    . . 4.960 4.484 4.229 4.666     .  0 0 "[    .    1    .    2]" 1 
       1688 1  75 LYS QD   1  76 ALA HA   . . 5.140 5.035 4.751 5.140     . 20 0 "[    .    1    .    2]" 1 
       1689 1  75 LYS QD   1  79 LEU MD1  . . 3.600 3.259 2.941 3.463     .  0 0 "[    .    1    .    2]" 1 
       1690 1  75 LYS QE   1  75 LYS HG2  . . 3.530 2.298 2.199 2.473     .  0 0 "[    .    1    .    2]" 1 
       1691 1  75 LYS QE   1  75 LYS HG3  . . 3.530 2.559 2.297 2.923     .  0 0 "[    .    1    .    2]" 1 
       1692 1  75 LYS QE   1  79 LEU MD1  . . 3.100 2.102 1.872 2.311     .  0 0 "[    .    1    .    2]" 1 
       1693 1  75 LYS QE   1  79 LEU MD2  . . 4.060 2.995 2.748 3.337     .  0 0 "[    .    1    .    2]" 1 
       1694 1  75 LYS QE   1  79 LEU HG   . . 5.140 3.426 3.117 3.772     .  0 0 "[    .    1    .    2]" 1 
       1695 1  75 LYS QG   1  76 ALA HA   . . 4.930 3.847 3.569 4.086     .  0 0 "[    .    1    .    2]" 1 
       1696 1  75 LYS QG   1  79 LEU H    . . 5.190 3.869 3.665 4.065     .  0 0 "[    .    1    .    2]" 1 
       1697 1  75 LYS QG   1  79 LEU MD1  . . 3.210 2.087 1.963 2.234     .  0 0 "[    .    1    .    2]" 1 
       1698 1  75 LYS QG   1  79 LEU MD2  . . 4.260 3.447 3.287 3.592     .  0 0 "[    .    1    .    2]" 1 
       1699 1  75 LYS QG   1  79 LEU HG   . . 4.240 2.582 2.378 2.824     .  0 0 "[    .    1    .    2]" 1 
       1700 1  75 LYS HG2  1  76 ALA H    . . 5.070 3.957 3.613 4.156     .  0 0 "[    .    1    .    2]" 1 
       1701 1  75 LYS HG2  1  79 LEU MD1  . . 3.800 2.102 1.977 2.250     .  0 0 "[    .    1    .    2]" 1 
       1702 1  75 LYS HG3  1  76 ALA H    . . 5.070 4.903 4.690 5.059     .  0 0 "[    .    1    .    2]" 1 
       1703 1  75 LYS HG3  1  79 LEU MD1  . . 3.800 3.533 3.319 3.795     .  0 0 "[    .    1    .    2]" 1 
       1704 1  76 ALA H    1  76 ALA MB   . . 2.950 2.118 2.025 2.237     .  0 0 "[    .    1    .    2]" 1 
       1705 1  76 ALA H    1  77 GLY H    . . 3.480 2.687 2.598 2.794     .  0 0 "[    .    1    .    2]" 1 
       1706 1  76 ALA H    1  78 LEU H    . . 4.750 4.378 4.162 4.620     .  0 0 "[    .    1    .    2]" 1 
       1707 1  76 ALA H    1  79 LEU H    . . 5.180 5.049 4.906 5.158     .  0 0 "[    .    1    .    2]" 1 
       1708 1  76 ALA H    1  79 LEU MD1  . . 4.840 4.334 3.997 4.570     .  0 0 "[    .    1    .    2]" 1 
       1709 1  76 ALA HA   1  78 LEU H    . . 5.220 4.653 4.376 4.999     .  0 0 "[    .    1    .    2]" 1 
       1710 1  76 ALA HA   1  79 LEU H    . . 4.350 3.970 3.751 4.141     .  0 0 "[    .    1    .    2]" 1 
       1711 1  76 ALA HA   1  79 LEU HB2  . . 3.720 2.998 2.776 3.211     .  0 0 "[    .    1    .    2]" 1 
       1712 1  76 ALA HA   1  79 LEU MD1  . . 3.700 2.779 2.163 3.131     .  0 0 "[    .    1    .    2]" 1 
       1713 1  76 ALA HA   1  79 LEU HG   . . 4.330 4.062 3.712 4.296     .  0 0 "[    .    1    .    2]" 1 
       1714 1  76 ALA HA   1  80 GLU H    . . 4.780 4.208 3.940 4.408     .  0 0 "[    .    1    .    2]" 1 
       1715 1  76 ALA MB   1  77 GLY H    . . 3.410 2.712 2.555 2.983     .  0 0 "[    .    1    .    2]" 1 
       1716 1  76 ALA MB   1  77 GLY HA2  . . 4.730 3.786 3.686 3.887     .  0 0 "[    .    1    .    2]" 1 
       1717 1  76 ALA MB   1  77 GLY HA3  . . 4.920 4.233 4.135 4.322     .  0 0 "[    .    1    .    2]" 1 
       1718 1  77 GLY H    1  78 LEU H    . . 3.510 2.676 2.456 2.831     .  0 0 "[    .    1    .    2]" 1 
       1719 1  77 GLY H    1  78 LEU QB   . . 5.340 4.384 4.205 4.503     .  0 0 "[    .    1    .    2]" 1 
       1720 1  77 GLY H    1  79 LEU H    . . 4.710 4.412 4.080 4.611     .  0 0 "[    .    1    .    2]" 1 
       1721 1  77 GLY HA2  1  80 GLU H    . . 4.140 3.901 3.734 3.981     .  0 0 "[    .    1    .    2]" 1 
       1722 1  77 GLY HA2  1  80 GLU HB2  . . 4.180 3.109 2.822 3.302     .  0 0 "[    .    1    .    2]" 1 
       1723 1  77 GLY HA2  1  80 GLU QG   . . 4.460 4.126 3.698 4.455     .  0 0 "[    .    1    .    2]" 1 
       1724 1  77 GLY HA3  1  80 GLU H    . . 5.050 5.011 4.830 5.052 0.002 18 0 "[    .    1    .    2]" 1 
       1725 1  77 GLY HA3  1  80 GLU HB2  . . 4.830 4.677 4.382 4.821     .  0 0 "[    .    1    .    2]" 1 
       1726 1  77 GLY HA3  1  81 ARG HB2  . . 5.050 4.882 4.681 5.049     .  0 0 "[    .    1    .    2]" 1 
       1727 1  78 LEU H    1  78 LEU HB2  . . 3.310 2.277 2.198 2.387     .  0 0 "[    .    1    .    2]" 1 
       1728 1  78 LEU H    1  78 LEU HB3  . . 3.310 2.766 2.653 2.865     .  0 0 "[    .    1    .    2]" 1 
       1729 1  78 LEU H    1  78 LEU MD1  . . 4.040 3.774 3.544 3.958     .  0 0 "[    .    1    .    2]" 1 
       1730 1  78 LEU H    1  78 LEU MD2  . . 4.620 4.218 4.168 4.265     .  0 0 "[    .    1    .    2]" 1 
       1731 1  78 LEU H    1  78 LEU HG   . . 4.610 4.554 4.532 4.589     .  0 0 "[    .    1    .    2]" 1 
       1732 1  78 LEU H    1  79 LEU H    . . 3.540 2.830 2.667 2.996     .  0 0 "[    .    1    .    2]" 1 
       1733 1  78 LEU H    1  80 GLU H    . . 5.420 4.333 4.102 4.737     .  0 0 "[    .    1    .    2]" 1 
       1734 1  78 LEU H    1  81 ARG H    . . 5.070 4.630 4.543 4.846     .  0 0 "[    .    1    .    2]" 1 
       1735 1  78 LEU H    1  81 ARG HB2  . . 4.900 4.744 4.576 4.890     .  0 0 "[    .    1    .    2]" 1 
       1736 1  78 LEU HA   1  78 LEU MD1  . . 3.240 2.055 1.964 2.212     .  0 0 "[    .    1    .    2]" 1 
       1737 1  78 LEU HA   1  78 LEU MD2  . . 4.220 3.844 3.783 3.878     .  0 0 "[    .    1    .    2]" 1 
       1738 1  78 LEU HA   1  78 LEU HG   . . 4.230 2.884 2.778 3.064     .  0 0 "[    .    1    .    2]" 1 
       1739 1  78 LEU HA   1  80 GLU H    . . 5.100 4.537 4.303 4.893     .  0 0 "[    .    1    .    2]" 1 
       1740 1  78 LEU HA   1  81 ARG H    . . 3.800 3.313 3.169 3.613     .  0 0 "[    .    1    .    2]" 1 
       1741 1  78 LEU HA   1  81 ARG HB2  . . 3.670 2.682 2.546 2.813     .  0 0 "[    .    1    .    2]" 1 
       1742 1  78 LEU HA   1  81 ARG HB3  . . 3.710 2.839 2.646 3.147     .  0 0 "[    .    1    .    2]" 1 
       1743 1  78 LEU HA   1  81 ARG HD2  . . 5.500 5.349 5.160 5.483     .  0 0 "[    .    1    .    2]" 1 
       1744 1  78 LEU HA   1  81 ARG HD3  . . 4.600 4.440 4.232 4.587     .  0 0 "[    .    1    .    2]" 1 
       1745 1  78 LEU HA   1  81 ARG HG2  . . 4.820 4.137 3.951 4.393     .  0 0 "[    .    1    .    2]" 1 
       1746 1  78 LEU HA   1  81 ARG HG3  . . 5.500 5.149 4.937 5.388     .  0 0 "[    .    1    .    2]" 1 
       1747 1  78 LEU HA   1  82 VAL H    . . 4.490 4.174 3.903 4.495 0.005 11 0 "[    .    1    .    2]" 1 
       1748 1  78 LEU QB   1  78 LEU MD1  . . 3.040 2.251 2.173 2.315     .  0 0 "[    .    1    .    2]" 1 
       1749 1  78 LEU QB   1  79 LEU H    . . 3.550 2.203 2.049 2.359     .  0 0 "[    .    1    .    2]" 1 
       1750 1  78 LEU QB   1  82 VAL MG2  . . 4.800 3.996 3.651 4.422     .  0 0 "[    .    1    .    2]" 1 
       1751 1  78 LEU HB2  1  78 LEU MD1  . . 3.670 2.302 2.212 2.378     .  0 0 "[    .    1    .    2]" 1 
       1752 1  78 LEU HB2  1  79 LEU H    . . 4.340 3.497 3.360 3.595     .  0 0 "[    .    1    .    2]" 1 
       1753 1  78 LEU HB3  1  78 LEU MD1  . . 3.670 3.187 3.177 3.195     .  0 0 "[    .    1    .    2]" 1 
       1754 1  78 LEU HB3  1  79 LEU H    . . 4.340 2.228 2.064 2.396     .  0 0 "[    .    1    .    2]" 1 
       1755 1  78 LEU MD1  1  79 LEU H    . . 5.010 4.546 4.406 4.672     .  0 0 "[    .    1    .    2]" 1 
       1756 1  78 LEU MD1  1  81 ARG H    . . 4.930 4.690 4.324 4.899     .  0 0 "[    .    1    .    2]" 1 
       1757 1  78 LEU MD1  1  81 ARG HB2  . . 3.840 3.695 3.491 3.837     .  0 0 "[    .    1    .    2]" 1 
       1758 1  78 LEU MD1  1  81 ARG HB3  . . 4.990 3.120 2.665 3.398     .  0 0 "[    .    1    .    2]" 1 
       1759 1  78 LEU MD1  1  81 ARG HD3  . . 5.290 4.738 4.499 5.058     .  0 0 "[    .    1    .    2]" 1 
       1760 1  78 LEU MD1  1  82 VAL H    . . 5.390 4.635 4.123 4.934     .  0 0 "[    .    1    .    2]" 1 
       1761 1  78 LEU MD1  1  82 VAL MG2  . . 3.640 3.376 2.877 3.640     .  0 0 "[    .    1    .    2]" 1 
       1762 1  78 LEU MD2  1  79 LEU H    . . 4.790 4.064 3.870 4.307     .  0 0 "[    .    1    .    2]" 1 
       1763 1  78 LEU HG   1  79 LEU H    . . 4.990 3.954 3.672 4.190     .  0 0 "[    .    1    .    2]" 1 
       1764 1  78 LEU HG   1  79 LEU HA   . . 4.670 4.215 3.940 4.455     .  0 0 "[    .    1    .    2]" 1 
       1765 1  78 LEU HG   1  81 ARG H    . . 5.500 5.122 4.943 5.499     .  0 0 "[    .    1    .    2]" 1 
       1766 1  78 LEU HG   1  81 ARG HB2  . . 5.130 4.985 4.872 5.130 0.000 10 0 "[    .    1    .    2]" 1 
       1767 1  78 LEU HG   1  81 ARG HB3  . . 5.070 4.080 3.799 4.302     .  0 0 "[    .    1    .    2]" 1 
       1768 1  78 LEU HG   1  82 VAL H    . . 5.180 4.424 4.055 4.764     .  0 0 "[    .    1    .    2]" 1 
       1769 1  78 LEU HG   1  82 VAL HB   . . 5.370 4.939 4.448 5.368     .  0 0 "[    .    1    .    2]" 1 
       1770 1  78 LEU HG   1  82 VAL MG2  . . 3.540 2.686 2.341 3.084     .  0 0 "[    .    1    .    2]" 1 
       1771 1  79 LEU H    1  79 LEU HB2  . . 3.250 2.462 2.392 2.533     .  0 0 "[    .    1    .    2]" 1 
       1772 1  79 LEU H    1  79 LEU HB3  . . 3.790 3.590 3.574 3.606     .  0 0 "[    .    1    .    2]" 1 
       1773 1  79 LEU H    1  79 LEU MD1  . . 4.070 3.551 3.399 3.719     .  0 0 "[    .    1    .    2]" 1 
       1774 1  79 LEU H    1  79 LEU MD2  . . 3.550 3.486 3.309 3.550 0.000  1 0 "[    .    1    .    2]" 1 
       1775 1  79 LEU H    1  79 LEU HG   . . 3.230 2.317 2.205 2.447     .  0 0 "[    .    1    .    2]" 1 
       1776 1  79 LEU H    1  80 GLU H    . . 3.320 2.981 2.874 3.097     .  0 0 "[    .    1    .    2]" 1 
       1777 1  79 LEU H    1  81 ARG H    . . 5.360 4.127 3.961 4.322     .  0 0 "[    .    1    .    2]" 1 
       1778 1  79 LEU HA   1  79 LEU MD1  . . 3.900 3.868 3.828 3.894     .  0 0 "[    .    1    .    2]" 1 
       1779 1  79 LEU HA   1  79 LEU MD2  . . 2.970 2.103 1.976 2.369     .  0 0 "[    .    1    .    2]" 1 
       1780 1  79 LEU HA   1  79 LEU HG   . . 3.730 2.923 2.857 2.998     .  0 0 "[    .    1    .    2]" 1 
       1781 1  79 LEU HA   1  81 ARG H    . . 5.070 4.367 4.070 4.575     .  0 0 "[    .    1    .    2]" 1 
       1782 1  79 LEU HA   1  82 VAL H    . . 3.850 3.606 3.468 3.762     .  0 0 "[    .    1    .    2]" 1 
       1783 1  79 LEU HA   1  82 VAL HB   . . 3.400 3.151 2.936 3.366     .  0 0 "[    .    1    .    2]" 1 
       1784 1  79 LEU HA   1  82 VAL MG2  . . 3.620 3.065 2.847 3.290     .  0 0 "[    .    1    .    2]" 1 
       1785 1  79 LEU HA   1  83 LYS H    . . 4.540 4.364 4.129 4.543 0.003 18 0 "[    .    1    .    2]" 1 
       1786 1  79 LEU HB2  1  79 LEU MD1  . . 3.230 2.223 2.126 2.315     .  0 0 "[    .    1    .    2]" 1 
       1787 1  79 LEU HB2  1  80 GLU H    . . 3.750 2.445 2.226 2.612     .  0 0 "[    .    1    .    2]" 1 
       1788 1  79 LEU HB3  1  79 LEU MD1  . . 3.210 2.425 2.320 2.526     .  0 0 "[    .    1    .    2]" 1 
       1789 1  79 LEU HB3  1  79 LEU MD2  . . 3.160 2.282 2.130 2.353     .  0 0 "[    .    1    .    2]" 1 
       1790 1  79 LEU HB3  1  80 GLU H    . . 3.930 3.315 3.063 3.459     .  0 0 "[    .    1    .    2]" 1 
       1791 1  79 LEU HB3  1  80 GLU HA   . . 4.250 4.190 4.087 4.244     .  0 0 "[    .    1    .    2]" 1 
       1792 1  79 LEU HB3  1  80 GLU QG   . . 5.010 4.131 3.856 4.384     .  0 0 "[    .    1    .    2]" 1 
       1793 1  79 LEU HB3  1  81 ARG H    . . 5.500 5.337 5.133 5.495     .  0 0 "[    .    1    .    2]" 1 
       1794 1  79 LEU MD1  1  80 GLU H    . . 4.910 4.298 4.045 4.516     .  0 0 "[    .    1    .    2]" 1 
       1795 1  79 LEU MD2  1  80 GLU H    . . 4.690 4.644 4.521 4.690     .  6 0 "[    .    1    .    2]" 1 
       1796 1  79 LEU HG   1  80 GLU H    . . 4.600 4.457 4.359 4.540     .  0 0 "[    .    1    .    2]" 1 
       1797 1  80 GLU H    1  80 GLU HB2  . . 3.190 2.333 2.228 2.447     .  0 0 "[    .    1    .    2]" 1 
       1798 1  80 GLU H    1  80 GLU HB3  . . 3.590 3.558 3.519 3.591 0.001 10 0 "[    .    1    .    2]" 1 
       1799 1  80 GLU H    1  80 GLU HG2  . . 3.980 3.410 2.326 3.917     .  0 0 "[    .    1    .    2]" 1 
       1800 1  80 GLU H    1  80 GLU QG   . . 3.390 2.542 2.270 2.798     .  0 0 "[    .    1    .    2]" 1 
       1801 1  80 GLU H    1  80 GLU HG3  . . 3.980 2.781 2.305 3.838     .  0 0 "[    .    1    .    2]" 1 
       1802 1  80 GLU H    1  81 ARG H    . . 3.370 2.623 2.506 2.892     .  0 0 "[    .    1    .    2]" 1 
       1803 1  80 GLU HA   1  80 GLU HG2  . . 3.870 2.442 2.183 3.202     .  0 0 "[    .    1    .    2]" 1 
       1804 1  80 GLU HA   1  80 GLU QG   . . 3.110 2.341 2.146 3.002     .  0 0 "[    .    1    .    2]" 1 
       1805 1  80 GLU HA   1  80 GLU HG3  . . 3.870 3.152 2.509 3.752     .  0 0 "[    .    1    .    2]" 1 
       1806 1  80 GLU HA   1  82 VAL H    . . 4.520 4.235 4.081 4.365     .  0 0 "[    .    1    .    2]" 1 
       1807 1  80 GLU HA   1  83 LYS H    . . 3.700 3.452 3.134 3.690     .  0 0 "[    .    1    .    2]" 1 
       1808 1  80 GLU HA   1  83 LYS QB   . . 2.970 2.748 2.409 2.949     .  0 0 "[    .    1    .    2]" 1 
       1809 1  80 GLU HA   1  83 LYS QD   . . 3.630 2.595 1.990 3.639 0.009 11 0 "[    .    1    .    2]" 1 
       1810 1  80 GLU HA   1  83 LYS QE   . . 4.240 3.857 1.988 4.228     .  0 0 "[    .    1    .    2]" 1 
       1811 1  80 GLU HB2  1  81 ARG H    . . 3.250 2.821 2.579 3.048     .  0 0 "[    .    1    .    2]" 1 
       1812 1  80 GLU HB2  1  81 ARG HA   . . 4.670 4.495 4.313 4.669     .  0 0 "[    .    1    .    2]" 1 
       1813 1  80 GLU QG   1  81 ARG H    . . 4.480 4.255 4.084 4.396     .  0 0 "[    .    1    .    2]" 1 
       1814 1  80 GLU HG2  1  81 ARG H    . . 5.180 4.951 4.390 5.179     .  0 0 "[    .    1    .    2]" 1 
       1815 1  80 GLU HG2  1  83 LYS QD   . . 5.220 3.737 3.135 4.835     .  0 0 "[    .    1    .    2]" 1 
       1816 1  80 GLU HG3  1  81 ARG H    . . 5.180 4.676 4.349 5.122     .  0 0 "[    .    1    .    2]" 1 
       1817 1  80 GLU HG3  1  83 LYS QD   . . 5.220 4.648 4.122 5.223 0.003 18 0 "[    .    1    .    2]" 1 
       1818 1  81 ARG H    1  81 ARG HB2  . . 3.150 2.231 2.171 2.314     .  0 0 "[    .    1    .    2]" 1 
       1819 1  81 ARG H    1  81 ARG HB3  . . 3.250 2.877 2.806 2.974     .  0 0 "[    .    1    .    2]" 1 
       1820 1  81 ARG H    1  81 ARG HD2  . . 4.660 4.121 3.858 4.283     .  0 0 "[    .    1    .    2]" 1 
       1821 1  81 ARG H    1  81 ARG HD3  . . 4.850 4.371 4.133 4.676     .  0 0 "[    .    1    .    2]" 1 
       1822 1  81 ARG H    1  81 ARG HG2  . . 4.680 4.622 4.588 4.655     .  0 0 "[    .    1    .    2]" 1 
       1823 1  81 ARG H    1  81 ARG HG3  . . 4.630 4.452 4.418 4.506     .  0 0 "[    .    1    .    2]" 1 
       1824 1  81 ARG H    1  82 VAL H    . . 3.380 2.627 2.464 2.882     .  0 0 "[    .    1    .    2]" 1 
       1825 1  81 ARG H    1  82 VAL MG2  . . 4.520 4.226 3.901 4.502     .  0 0 "[    .    1    .    2]" 1 
       1826 1  81 ARG H    1  85 LEU MD1  . . 5.500 4.956 4.817 5.054     .  0 0 "[    .    1    .    2]" 1 
       1827 1  81 ARG HA   1  81 ARG HD2  . . 3.760 2.340 2.052 2.479     .  0 0 "[    .    1    .    2]" 1 
       1828 1  81 ARG HA   1  81 ARG HD3  . . 3.820 3.568 3.336 3.704     .  0 0 "[    .    1    .    2]" 1 
       1829 1  81 ARG HA   1  81 ARG HG2  . . 4.130 3.646 3.630 3.673     .  0 0 "[    .    1    .    2]" 1 
       1830 1  81 ARG HA   1  83 LYS H    . . 4.970 4.608 4.324 4.963     .  0 0 "[    .    1    .    2]" 1 
       1831 1  81 ARG HA   1  84 GLU H    . . 4.110 3.638 3.491 3.829     .  0 0 "[    .    1    .    2]" 1 
       1832 1  81 ARG HA   1  84 GLU HB2  . . 4.360 3.349 2.772 4.283     .  0 0 "[    .    1    .    2]" 1 
       1833 1  81 ARG HA   1  84 GLU QB   . . 3.580 2.867 2.733 3.012     .  0 0 "[    .    1    .    2]" 1 
       1834 1  81 ARG HA   1  84 GLU HB3  . . 4.360 3.694 2.780 4.362 0.002 18 0 "[    .    1    .    2]" 1 
       1835 1  81 ARG HA   1  84 GLU QG   . . 4.690 4.415 4.062 4.638     .  0 0 "[    .    1    .    2]" 1 
       1836 1  81 ARG HA   1  85 LEU H    . . 4.740 3.725 3.481 3.935     .  0 0 "[    .    1    .    2]" 1 
       1837 1  81 ARG HA   1  85 LEU MD1  . . 4.790 3.643 3.372 3.824     .  0 0 "[    .    1    .    2]" 1 
       1838 1  81 ARG HB2  1  81 ARG HD2  . . 4.150 2.742 2.624 2.928     .  0 0 "[    .    1    .    2]" 1 
       1839 1  81 ARG HB2  1  81 ARG HD3  . . 4.020 2.385 2.308 2.582     .  0 0 "[    .    1    .    2]" 1 
       1840 1  81 ARG HB2  1  82 VAL H    . . 3.850 3.650 3.565 3.717     .  0 0 "[    .    1    .    2]" 1 
       1841 1  81 ARG HB2  1  82 VAL MG2  . . 4.970 4.499 4.304 4.743     .  0 0 "[    .    1    .    2]" 1 
       1842 1  81 ARG HB2  1  85 LEU MD1  . . 4.260 4.028 3.887 4.199     .  0 0 "[    .    1    .    2]" 1 
       1843 1  81 ARG HB3  1  81 ARG HD2  . . 4.110 3.741 3.648 3.802     .  0 0 "[    .    1    .    2]" 1 
       1844 1  81 ARG HB3  1  81 ARG HD3  . . 3.770 3.560 3.502 3.697     .  0 0 "[    .    1    .    2]" 1 
       1845 1  81 ARG HB3  1  82 VAL H    . . 3.850 2.750 2.603 2.877     .  0 0 "[    .    1    .    2]" 1 
       1846 1  81 ARG HB3  1  82 VAL MG2  . . 4.170 3.165 2.986 3.447     .  0 0 "[    .    1    .    2]" 1 
       1847 1  81 ARG HB3  1  85 LEU MD1  . . 5.250 2.879 2.660 3.076     .  0 0 "[    .    1    .    2]" 1 
       1848 1  81 ARG HD2  1  84 GLU QB   . . 4.530 4.269 3.769 4.518     .  0 0 "[    .    1    .    2]" 1 
       1849 1  81 ARG HD2  1  85 LEU MD1  . . 4.410 4.160 3.877 4.402     .  0 0 "[    .    1    .    2]" 1 
       1850 1  81 ARG HD2  1  85 LEU HG   . . 5.450 4.356 3.892 4.766     .  0 0 "[    .    1    .    2]" 1 
       1851 1  81 ARG HD3  1  85 LEU MD1  . . 4.920 4.428 4.174 4.634     .  0 0 "[    .    1    .    2]" 1 
       1852 1  81 ARG HG2  1  82 VAL H    . . 5.100 4.927 4.794 5.072     .  0 0 "[    .    1    .    2]" 1 
       1853 1  81 ARG HG2  1  85 LEU MD1  . . 3.520 2.590 2.320 2.802     .  0 0 "[    .    1    .    2]" 1 
       1854 1  81 ARG HG3  1  82 VAL H    . . 4.640 4.497 4.352 4.567     .  0 0 "[    .    1    .    2]" 1 
       1855 1  81 ARG HG3  1  82 VAL HA   . . 5.500 4.696 4.500 4.770     .  0 0 "[    .    1    .    2]" 1 
       1856 1  81 ARG HG3  1  85 LEU HA   . . 5.500 5.241 4.994 5.499     .  0 0 "[    .    1    .    2]" 1 
       1857 1  81 ARG HG3  1  85 LEU MD1  . . 3.570 2.020 1.817 2.214     .  0 0 "[    .    1    .    2]" 1 
       1858 1  82 VAL H    1  82 VAL HB   . . 3.260 2.461 2.333 2.556     .  0 0 "[    .    1    .    2]" 1 
       1859 1  82 VAL H    1  82 VAL MG1  . . 3.800 3.753 3.707 3.773     .  0 0 "[    .    1    .    2]" 1 
       1860 1  82 VAL H    1  82 VAL MG2  . . 3.260 2.378 2.139 2.580     .  0 0 "[    .    1    .    2]" 1 
       1861 1  82 VAL H    1  83 LYS H    . . 3.510 2.594 2.494 2.740     .  0 0 "[    .    1    .    2]" 1 
       1862 1  82 VAL H    1  83 LYS HA   . . 5.500 5.213 5.136 5.309     .  0 0 "[    .    1    .    2]" 1 
       1863 1  82 VAL H    1  83 LYS QG   . . 5.340 4.408 3.885 5.340     .  0 0 "[    .    1    .    2]" 1 
       1864 1  82 VAL H    1  84 GLU H    . . 4.660 3.978 3.842 4.164     .  0 0 "[    .    1    .    2]" 1 
       1865 1  82 VAL H    1  85 LEU MD1  . . 3.940 3.883 3.687 3.942 0.002  1 0 "[    .    1    .    2]" 1 
       1866 1  82 VAL HA   1  82 VAL MG1  . . 3.330 2.438 2.344 2.498     .  0 0 "[    .    1    .    2]" 1 
       1867 1  82 VAL HA   1  82 VAL MG2  . . 3.230 2.297 2.131 2.441     .  0 0 "[    .    1    .    2]" 1 
       1868 1  82 VAL HA   1  83 LYS HA   . . 5.270 4.783 4.718 4.835     .  0 0 "[    .    1    .    2]" 1 
       1869 1  82 VAL HA   1  85 LEU H    . . 4.110 3.533 3.275 3.876     .  0 0 "[    .    1    .    2]" 1 
       1870 1  82 VAL HA   1  85 LEU HB2  . . 3.680 2.498 2.297 2.767     .  0 0 "[    .    1    .    2]" 1 
       1871 1  82 VAL HA   1  85 LEU HB3  . . 4.400 4.064 3.858 4.373     .  0 0 "[    .    1    .    2]" 1 
       1872 1  82 VAL HA   1  85 LEU MD1  . . 3.440 2.663 2.282 2.964     .  0 0 "[    .    1    .    2]" 1 
       1873 1  82 VAL HA   1  85 LEU HG   . . 4.440 4.227 4.046 4.434     .  0 0 "[    .    1    .    2]" 1 
       1874 1  82 VAL HA   1  86 GLN H    . . 4.510 3.579 3.326 3.889     .  0 0 "[    .    1    .    2]" 1 
       1875 1  82 VAL HB   1  83 LYS H    . . 3.430 2.568 2.279 2.818     .  0 0 "[    .    1    .    2]" 1 
       1876 1  82 VAL HB   1  83 LYS HA   . . 4.960 4.306 4.164 4.479     .  0 0 "[    .    1    .    2]" 1 
       1877 1  82 VAL HB   1  83 LYS QG   . . 4.840 3.382 3.044 4.436     .  0 0 "[    .    1    .    2]" 1 
       1878 1  82 VAL MG1  1  83 LYS H    . . 3.870 3.336 2.988 3.551     .  0 0 "[    .    1    .    2]" 1 
       1879 1  82 VAL MG1  1  83 LYS HA   . . 4.020 3.397 3.079 3.647     .  0 0 "[    .    1    .    2]" 1 
       1880 1  82 VAL MG1  1  83 LYS QG   . . 3.980 3.548 3.168 3.843     .  0 0 "[    .    1    .    2]" 1 
       1881 1  82 VAL MG1  1  86 GLN H    . . 4.500 3.717 3.328 4.004     .  0 0 "[    .    1    .    2]" 1 
       1882 1  82 VAL MG1  1  86 GLN HE21 . . 4.240 2.220 1.867 4.225     .  0 0 "[    .    1    .    2]" 1 
       1883 1  82 VAL MG1  1  86 GLN QE   . . 3.720 2.136 1.841 3.344     .  0 0 "[    .    1    .    2]" 1 
       1884 1  82 VAL MG1  1  86 GLN HE22 . . 4.240 3.030 2.635 3.516     .  0 0 "[    .    1    .    2]" 1 
       1885 1  82 VAL MG1  1  86 GLN HG2  . . 3.790 3.661 3.396 3.781     .  0 0 "[    .    1    .    2]" 1 
       1886 1  82 VAL MG2  1  83 LYS H    . . 4.100 3.865 3.729 4.017     .  0 0 "[    .    1    .    2]" 1 
       1887 1  82 VAL MG2  1  85 LEU H    . . 5.500 5.151 4.971 5.374     .  0 0 "[    .    1    .    2]" 1 
       1888 1  82 VAL MG2  1  85 LEU MD1  . . 4.140 3.266 3.081 3.416     .  0 0 "[    .    1    .    2]" 1 
       1889 1  83 LYS H    1  83 LYS QB   . . 2.950 2.398 2.193 2.563     .  0 0 "[    .    1    .    2]" 1 
       1890 1  83 LYS H    1  83 LYS QD   . . 4.230 3.473 2.097 4.210     .  0 0 "[    .    1    .    2]" 1 
       1891 1  83 LYS H    1  83 LYS QE   . . 4.730 4.337 2.994 4.730 0.000  2 0 "[    .    1    .    2]" 1 
       1892 1  83 LYS H    1  83 LYS HG2  . . 4.150 3.682 3.103 4.118     .  0 0 "[    .    1    .    2]" 1 
       1893 1  83 LYS H    1  83 LYS QG   . . 3.490 2.347 1.954 3.202     .  0 0 "[    .    1    .    2]" 1 
       1894 1  83 LYS H    1  83 LYS HG3  . . 4.150 2.381 1.964 3.356     .  0 0 "[    .    1    .    2]" 1 
       1895 1  83 LYS H    1  85 LEU HB2  . . 5.500 5.039 4.760 5.226     .  0 0 "[    .    1    .    2]" 1 
       1896 1  83 LYS HA   1  83 LYS QE   . . 5.500 4.533 4.122 4.942     .  0 0 "[    .    1    .    2]" 1 
       1897 1  83 LYS HA   1  83 LYS HG2  . . 3.990 2.740 2.515 3.493     .  0 0 "[    .    1    .    2]" 1 
       1898 1  83 LYS HA   1  83 LYS QG   . . 3.430 2.432 2.220 2.549     .  0 0 "[    .    1    .    2]" 1 
       1899 1  83 LYS HA   1  83 LYS HG3  . . 3.990 2.804 2.245 3.334     .  0 0 "[    .    1    .    2]" 1 
       1900 1  83 LYS HA   1  86 GLN H    . . 4.220 4.111 3.699 4.223 0.003 11 0 "[    .    1    .    2]" 1 
       1901 1  83 LYS HA   1  86 GLN HG2  . . 4.480 2.409 2.136 2.701     .  0 0 "[    .    1    .    2]" 1 
       1902 1  83 LYS HA   1  86 GLN HG3  . . 4.050 3.712 3.450 3.959     .  0 0 "[    .    1    .    2]" 1 
       1903 1  83 LYS QB   1  83 LYS QD   . . 3.090 2.141 2.054 2.216     .  0 0 "[    .    1    .    2]" 1 
       1904 1  83 LYS QB   1  83 LYS QE   . . 3.700 3.007 2.005 3.649     .  0 0 "[    .    1    .    2]" 1 
       1905 1  83 LYS QB   1  84 GLU H    . . 3.390 2.689 2.547 2.894     .  0 0 "[    .    1    .    2]" 1 
       1906 1  83 LYS QE   1  83 LYS HG2  . . 3.490 2.504 2.146 3.248     .  0 0 "[    .    1    .    2]" 1 
       1907 1  83 LYS QE   1  83 LYS HG3  . . 3.490 2.723 2.077 3.441     .  0 0 "[    .    1    .    2]" 1 
       1908 1  83 LYS QG   1  84 GLU H    . . 4.440 4.188 3.978 4.444 0.004 18 0 "[    .    1    .    2]" 1 
       1909 1  83 LYS HG2  1  84 GLU H    . . 5.220 5.127 4.871 5.220     .  0 0 "[    .    1    .    2]" 1 
       1910 1  83 LYS HG3  1  84 GLU H    . . 5.220 4.448 4.212 4.879     .  0 0 "[    .    1    .    2]" 1 
       1911 1  84 GLU H    1  84 GLU HB2  . . 3.490 2.365 2.179 2.754     .  0 0 "[    .    1    .    2]" 1 
       1912 1  84 GLU H    1  84 GLU QB   . . 3.040 2.211 2.153 2.293     .  0 0 "[    .    1    .    2]" 1 
       1913 1  84 GLU H    1  84 GLU HB3  . . 3.490 3.079 2.377 3.496 0.006  7 0 "[    .    1    .    2]" 1 
       1914 1  84 GLU H    1  84 GLU QG   . . 3.990 3.511 2.935 4.027 0.037 19 0 "[    .    1    .    2]" 1 
       1915 1  84 GLU H    1  85 LEU H    . . 3.480 2.481 2.217 2.727     .  0 0 "[    .    1    .    2]" 1 
       1916 1  84 GLU H    1  85 LEU HG   . . 5.110 4.710 4.501 5.110     .  0 0 "[    .    1    .    2]" 1 
       1917 1  84 GLU H    1  86 GLN H    . . 4.810 4.217 3.877 4.460     .  0 0 "[    .    1    .    2]" 1 
       1918 1  84 GLU H    1  86 GLN HG2  . . 4.930 4.294 4.067 4.513     .  0 0 "[    .    1    .    2]" 1 
       1919 1  84 GLU HA   1  84 GLU QG   . . 3.900 2.457 2.138 2.892     .  0 0 "[    .    1    .    2]" 1 
       1920 1  84 GLU HA   1  86 GLN H    . . 4.880 4.731 4.182 4.881 0.001 16 0 "[    .    1    .    2]" 1 
       1921 1  84 GLU HA   1  87 ALA H    . . 3.790 3.547 3.138 3.757     .  0 0 "[    .    1    .    2]" 1 
       1922 1  84 GLU HA   1  87 ALA MB   . . 3.250 2.529 2.167 2.730     .  0 0 "[    .    1    .    2]" 1 
       1923 1  84 GLU HB2  1  85 LEU H    . . 3.800 3.226 2.666 3.801 0.001  3 0 "[    .    1    .    2]" 1 
       1924 1  84 GLU HB3  1  85 LEU H    . . 3.800 2.920 2.256 3.585     .  0 0 "[    .    1    .    2]" 1 
       1925 1  84 GLU QG   1  85 LEU H    . . 4.870 4.054 3.160 4.518     .  0 0 "[    .    1    .    2]" 1 
       1926 1  85 LEU H    1  85 LEU HB2  . . 3.390 2.315 2.204 2.426     .  0 0 "[    .    1    .    2]" 1 
       1927 1  85 LEU H    1  85 LEU HB3  . . 3.740 3.552 3.507 3.582     .  0 0 "[    .    1    .    2]" 1 
       1928 1  85 LEU H    1  85 LEU MD1  . . 3.560 3.445 3.309 3.556     .  0 0 "[    .    1    .    2]" 1 
       1929 1  85 LEU H    1  85 LEU MD2  . . 4.020 3.835 3.683 4.011     .  0 0 "[    .    1    .    2]" 1 
       1930 1  85 LEU H    1  85 LEU HG   . . 3.400 2.615 2.376 2.910     .  0 0 "[    .    1    .    2]" 1 
       1931 1  85 LEU H    1  86 GLN H    . . 3.550 2.844 2.569 3.051     .  0 0 "[    .    1    .    2]" 1 
       1932 1  85 LEU H    1  86 GLN HG2  . . 5.400 4.271 3.840 4.555     .  0 0 "[    .    1    .    2]" 1 
       1933 1  85 LEU H    1  87 ALA H    . . 4.350 4.025 3.794 4.244     .  0 0 "[    .    1    .    2]" 1 
       1934 1  85 LEU HA   1  85 LEU MD1  . . 3.900 3.857 3.833 3.889     .  0 0 "[    .    1    .    2]" 1 
       1935 1  85 LEU HA   1  85 LEU MD2  . . 3.090 2.253 2.088 2.456     .  0 0 "[    .    1    .    2]" 1 
       1936 1  85 LEU HA   1  85 LEU HG   . . 3.540 2.740 2.628 2.826     .  0 0 "[    .    1    .    2]" 1 
       1937 1  85 LEU HA   1  88 GLU QG   . . 3.680 2.953 1.996 3.477     .  0 0 "[    .    1    .    2]" 1 
       1938 1  85 LEU HB2  1  85 LEU MD1  . . 3.430 2.190 2.048 2.287     .  0 0 "[    .    1    .    2]" 1 
       1939 1  85 LEU HB2  1  85 LEU MD2  . . 3.520 3.165 3.145 3.179     .  0 0 "[    .    1    .    2]" 1 
       1940 1  85 LEU HB2  1  86 GLN H    . . 3.350 2.460 2.302 2.753     .  0 0 "[    .    1    .    2]" 1 
       1941 1  85 LEU HB2  1  87 ALA H    . . 5.500 4.811 4.615 4.946     .  0 0 "[    .    1    .    2]" 1 
       1942 1  85 LEU HB3  1  85 LEU MD1  . . 3.490 2.512 2.433 2.631     .  0 0 "[    .    1    .    2]" 1 
       1943 1  85 LEU HB3  1  85 LEU MD2  . . 3.420 2.208 2.076 2.321     .  0 0 "[    .    1    .    2]" 1 
       1944 1  85 LEU HB3  1  86 GLN H    . . 4.100 3.168 2.961 3.566     .  0 0 "[    .    1    .    2]" 1 
       1945 1  85 LEU HB3  1  86 GLN HA   . . 4.780 4.080 3.966 4.273     .  0 0 "[    .    1    .    2]" 1 
       1946 1  85 LEU HB3  1  87 ALA H    . . 5.300 5.197 4.850 5.301 0.001  4 0 "[    .    1    .    2]" 1 
       1947 1  85 LEU HG   1  86 GLN H    . . 4.640 4.566 4.467 4.640 0.000 18 0 "[    .    1    .    2]" 1 
       1948 1  86 GLN H    1  86 GLN HB2  . . 3.850 3.575 3.540 3.621     .  0 0 "[    .    1    .    2]" 1 
       1949 1  86 GLN H    1  86 GLN QB   . . 3.150 2.363 2.248 2.507     .  0 0 "[    .    1    .    2]" 1 
       1950 1  86 GLN H    1  86 GLN HB3  . . 3.850 2.398 2.274 2.559     .  0 0 "[    .    1    .    2]" 1 
       1951 1  86 GLN H    1  86 GLN QE   . . 5.340 3.688 3.395 4.406     .  0 0 "[    .    1    .    2]" 1 
       1952 1  86 GLN H    1  86 GLN HG2  . . 3.600 2.402 2.061 2.652     .  0 0 "[    .    1    .    2]" 1 
       1953 1  86 GLN H    1  86 GLN HG3  . . 3.870 3.532 3.270 3.707     .  0 0 "[    .    1    .    2]" 1 
       1954 1  86 GLN H    1  87 ALA H    . . 3.310 2.708 2.379 2.858     .  0 0 "[    .    1    .    2]" 1 
       1955 1  86 GLN H    1  87 ALA MB   . . 4.510 4.301 3.993 4.417     .  0 0 "[    .    1    .    2]" 1 
       1956 1  86 GLN H    1  88 GLU H    . . 4.700 4.120 3.897 4.413     .  0 0 "[    .    1    .    2]" 1 
       1957 1  86 GLN HA   1  86 GLN HG2  . . 3.930 3.801 3.635 3.876     .  0 0 "[    .    1    .    2]" 1 
       1958 1  86 GLN HA   1  86 GLN HG3  . . 3.900 3.681 3.596 3.886     .  0 0 "[    .    1    .    2]" 1 
       1959 1  86 GLN HA   1  89 GLN H    . . 3.950 3.722 3.386 3.951 0.001  6 0 "[    .    1    .    2]" 1 
       1960 1  86 GLN HA   1  89 GLN QG   . . 4.320 2.112 1.882 3.473     .  0 0 "[    .    1    .    2]" 1 
       1961 1  86 GLN QB   1  86 GLN QE   . . 3.740 2.141 1.886 2.833     .  0 0 "[    .    1    .    2]" 1 
       1962 1  86 GLN HB2  1  87 ALA H    . . 4.130 3.921 3.613 4.136 0.006  6 0 "[    .    1    .    2]" 1 
       1963 1  86 GLN HB3  1  87 ALA H    . . 4.130 3.877 3.733 4.136 0.006  6 0 "[    .    1    .    2]" 1 
       1964 1  86 GLN QE   1  86 GLN HG3  . . 3.370 3.303 2.699 3.349     .  0 0 "[    .    1    .    2]" 1 
       1965 1  86 GLN HG2  1  87 ALA H    . . 4.680 2.515 2.048 3.053     .  0 0 "[    .    1    .    2]" 1 
       1966 1  86 GLN HG3  1  87 ALA H    . . 4.390 2.469 2.079 2.847     .  0 0 "[    .    1    .    2]" 1 
       1967 1  86 GLN HG3  1  87 ALA HA   . . 4.690 3.145 2.945 3.474     .  0 0 "[    .    1    .    2]" 1 
       1968 1  86 GLN HG3  1  87 ALA MB   . . 4.350 3.273 3.114 3.499     .  0 0 "[    .    1    .    2]" 1 
       1969 1  87 ALA H    1  87 ALA MB   . . 2.830 2.113 2.024 2.274     .  0 0 "[    .    1    .    2]" 1 
       1970 1  87 ALA HA   1  89 GLN QG   . . 5.500 4.976 4.601 5.460     .  0 0 "[    .    1    .    2]" 1 
       1971 1  87 ALA HA   1  90 GLU H    . . 4.300 4.000 3.667 4.300 0.000 15 0 "[    .    1    .    2]" 1 
       1972 1  87 ALA HA   1  90 GLU QB   . . 3.490 3.022 2.303 3.489     .  0 0 "[    .    1    .    2]" 1 
       1973 1  87 ALA HA   1  90 GLU QG   . . 5.500 4.266 2.219 5.353     .  0 0 "[    .    1    .    2]" 1 
       1974 1  87 ALA HA   1  91 ASP H    . . 4.300 3.973 3.626 4.281     .  0 0 "[    .    1    .    2]" 1 
       1975 1  87 ALA MB   1  88 GLU H    . . 3.440 2.914 2.536 3.150     .  0 0 "[    .    1    .    2]" 1 
       1976 1  87 ALA MB   1  88 GLU HA   . . 3.930 3.872 3.779 3.935 0.005  9 0 "[    .    1    .    2]" 1 
       1977 1  87 ALA MB   1  88 GLU QB   . . 4.800 4.318 3.675 4.627     .  0 0 "[    .    1    .    2]" 1 
       1978 1  87 ALA MB   1  90 GLU QB   . . 5.170 4.378 3.877 4.783     .  0 0 "[    .    1    .    2]" 1 
       1979 1  87 ALA MB   1  91 ASP QB   . . 5.000 4.279 3.770 4.993     .  0 0 "[    .    1    .    2]" 1 
       1980 1  88 GLU H    1  88 GLU QB   . . 2.980 2.425 2.301 2.509     .  0 0 "[    .    1    .    2]" 1 
       1981 1  88 GLU H    1  88 GLU HG2  . . 3.890 2.654 2.301 3.616     .  0 0 "[    .    1    .    2]" 1 
       1982 1  88 GLU H    1  88 GLU HG3  . . 3.890 3.475 2.533 3.888     .  0 0 "[    .    1    .    2]" 1 
       1983 1  88 GLU H    1  90 GLU H    . . 3.730 3.526 3.367 3.730     .  6 0 "[    .    1    .    2]" 1 
       1984 1  88 GLU H    1  91 ASP QB   . . 5.120 4.658 4.265 5.085     .  0 0 "[    .    1    .    2]" 1 
       1985 1  88 GLU HA   1  88 GLU HG2  . . 3.860 2.989 2.276 3.860 0.000  4 0 "[    .    1    .    2]" 1 
       1986 1  88 GLU HA   1  88 GLU QG   . . 3.340 2.826 2.236 3.318     .  0 0 "[    .    1    .    2]" 1 
       1987 1  88 GLU HA   1  88 GLU HG3  . . 3.860 3.651 3.136 3.830     .  0 0 "[    .    1    .    2]" 1 
       1988 1  88 GLU HA   1  91 ASP H    . . 3.810 3.327 3.152 3.715     .  0 0 "[    .    1    .    2]" 1 
       1989 1  88 GLU HA   1  91 ASP QB   . . 3.430 2.585 2.185 3.030     .  0 0 "[    .    1    .    2]" 1 
       1990 1  88 GLU HA   1  92 ARG H    . . 5.500 4.556 3.815 5.109     .  0 0 "[    .    1    .    2]" 1 
       1991 1  88 GLU QB   1  89 GLN H    . . 3.400 2.268 1.901 3.392     .  0 0 "[    .    1    .    2]" 1 
       1992 1  88 GLU QB   1  91 ASP QB   . . 4.660 4.149 3.926 4.594     .  0 0 "[    .    1    .    2]" 1 
       1993 1  89 GLN H    1  89 GLN HB2  . . 3.790 3.582 3.498 3.610     .  0 0 "[    .    1    .    2]" 1 
       1994 1  89 GLN H    1  89 GLN QB   . . 3.280 2.436 2.171 2.666     .  0 0 "[    .    1    .    2]" 1 
       1995 1  89 GLN H    1  89 GLN HB3  . . 3.790 2.480 2.193 2.751     .  0 0 "[    .    1    .    2]" 1 
       1996 1  89 GLN H    1  89 GLN QG   . . 3.410 2.388 2.008 2.890     .  0 0 "[    .    1    .    2]" 1 
       1997 1  89 GLN H    1  90 GLU H    . . 3.320 2.728 2.455 2.923     .  0 0 "[    .    1    .    2]" 1 
       1998 1  89 GLN H    1  91 ASP H    . . 4.510 4.303 3.934 4.504     .  0 0 "[    .    1    .    2]" 1 
       1999 1  89 GLN H    1  91 ASP QB   . . 5.500 4.936 4.755 5.373     .  0 0 "[    .    1    .    2]" 1 
       2000 1  89 GLN HA   1  89 GLN QG   . . 3.590 3.351 3.276 3.442     .  0 0 "[    .    1    .    2]" 1 
       2001 1  89 GLN HA   1  91 ASP H    . . 4.900 4.598 4.079 4.850     .  0 0 "[    .    1    .    2]" 1 
       2002 1  89 GLN HA   1  92 ARG QD   . . 4.120 3.198 2.531 3.926     .  0 0 "[    .    1    .    2]" 1 
       2003 1  89 GLN HA   1  92 ARG QG   . . 3.450 2.843 2.392 3.333     .  0 0 "[    .    1    .    2]" 1 
       2004 1  89 GLN HB2  1  90 GLU H    . . 4.270 4.011 3.680 4.233     .  0 0 "[    .    1    .    2]" 1 
       2005 1  89 GLN HB3  1  90 GLU H    . . 4.270 4.065 3.732 4.263     .  0 0 "[    .    1    .    2]" 1 
       2006 1  89 GLN QE   1  90 GLU QB   . . 5.340 3.824 3.050 5.158     .  0 0 "[    .    1    .    2]" 1 
       2007 1  89 GLN QG   1  90 GLU H    . . 3.760 2.278 1.967 2.641     .  0 0 "[    .    1    .    2]" 1 
       2008 1  89 GLN QG   1  90 GLU HA   . . 4.310 3.611 3.175 4.274     .  0 0 "[    .    1    .    2]" 1 
       2009 1  90 GLU H    1  90 GLU QB   . . 2.930 2.339 2.263 2.532     .  0 0 "[    .    1    .    2]" 1 
       2010 1  90 GLU H    1  90 GLU QG   . . 4.240 3.418 2.287 4.092     .  0 0 "[    .    1    .    2]" 1 
       2011 1  90 GLU H    1  91 ASP QB   . . 5.040 4.059 3.934 4.221     .  0 0 "[    .    1    .    2]" 1 
       2012 1  90 GLU HA   1  90 GLU QG   . . 3.770 2.601 2.199 3.301     .  0 0 "[    .    1    .    2]" 1 
       2013 1  90 GLU HA   1  92 ARG H    . . 5.500 4.343 3.845 4.677     .  0 0 "[    .    1    .    2]" 1 
       2014 1  90 GLU HA   1  93 ALA H    . . 3.450 3.259 2.991 3.450     .  0 0 "[    .    1    .    2]" 1 
       2015 1  90 GLU HA   1  93 ALA MB   . . 3.590 2.459 2.053 3.071     .  0 0 "[    .    1    .    2]" 1 
       2016 1  90 GLU HA   1  94 LEU H    . . 4.350 4.084 3.453 4.349     .  0 0 "[    .    1    .    2]" 1 
       2017 1  90 GLU QB   1  91 ASP H    . . 3.480 2.668 2.393 3.436     .  0 0 "[    .    1    .    2]" 1 
       2018 1  90 GLU QB   1  91 ASP HA   . . 4.920 3.976 3.791 4.619     .  0 0 "[    .    1    .    2]" 1 
       2019 1  90 GLU QB   1  91 ASP QB   . . 5.040 4.239 3.993 4.924     .  0 0 "[    .    1    .    2]" 1 
       2020 1  90 GLU QG   1  91 ASP H    . . 4.150 3.779 2.050 4.151 0.001  6 0 "[    .    1    .    2]" 1 
       2021 1  90 GLU QG   1  93 ALA MB   . . 4.800 3.601 2.770 4.800 0.000 16 0 "[    .    1    .    2]" 1 
       2022 1  91 ASP H    1  91 ASP QB   . . 3.040 2.235 2.140 2.295     .  0 0 "[    .    1    .    2]" 1 
       2023 1  91 ASP HA   1  93 ALA H    . . 5.000 4.394 3.970 5.003 0.003 16 0 "[    .    1    .    2]" 1 
       2024 1  91 ASP HA   1  94 LEU H    . . 4.300 3.557 3.162 4.025     .  0 0 "[    .    1    .    2]" 1 
       2025 1  91 ASP HA   1  94 LEU HB2  . . 4.830 3.261 2.231 4.685     .  0 0 "[    .    1    .    2]" 1 
       2026 1  91 ASP HA   1  94 LEU QB   . . 4.020 2.756 2.201 3.202     .  0 0 "[    .    1    .    2]" 1 
       2027 1  91 ASP HA   1  94 LEU HB3  . . 4.830 3.341 2.395 4.800     .  0 0 "[    .    1    .    2]" 1 
       2028 1  91 ASP HA   1  94 LEU QD   . . 4.280 3.221 2.241 3.714     .  0 0 "[    .    1    .    2]" 1 
       2029 1  91 ASP QB   1  92 ARG H    . . 3.320 2.496 2.024 3.309     .  0 0 "[    .    1    .    2]" 1 
       2030 1  91 ASP QB   1  92 ARG HA   . . 4.660 4.172 3.746 4.562     .  0 0 "[    .    1    .    2]" 1 
       2031 1  91 ASP QB   1  92 ARG QG   . . 4.610 3.821 3.005 4.555     .  0 0 "[    .    1    .    2]" 1 
       2032 1  91 ASP QB   1  94 LEU QD   . . 4.940 4.491 3.655 4.924     .  0 0 "[    .    1    .    2]" 1 
       2033 1  92 ARG H    1  92 ARG QB   . . 3.030 2.607 2.388 2.805     .  0 0 "[    .    1    .    2]" 1 
       2034 1  92 ARG H    1  92 ARG QD   . . 4.990 3.856 3.375 4.181     .  0 0 "[    .    1    .    2]" 1 
       2035 1  92 ARG H    1  92 ARG HG2  . . 4.150 2.115 1.914 3.345     .  0 0 "[    .    1    .    2]" 1 
       2036 1  92 ARG H    1  92 ARG QG   . . 3.490 2.006 1.857 2.331     .  0 0 "[    .    1    .    2]" 1 
       2037 1  92 ARG H    1  92 ARG HG3  . . 4.150 2.868 2.162 3.605     .  0 0 "[    .    1    .    2]" 1 
       2038 1  92 ARG HA   1  94 LEU H    . . 4.850 4.488 3.895 4.829     .  0 0 "[    .    1    .    2]" 1 
       2039 1  92 ARG HA   1  95 ARG H    . . 4.700 3.841 3.478 4.321     .  0 0 "[    .    1    .    2]" 1 
       2040 1  92 ARG QB   1  92 ARG QD   . . 3.480 2.238 2.075 2.523     .  0 0 "[    .    1    .    2]" 1 
       2041 1  92 ARG QB   1  93 ALA H    . . 3.550 3.242 2.113 3.551 0.001  9 0 "[    .    1    .    2]" 1 
       2042 1  92 ARG QB   1  93 ALA HA   . . 4.730 4.187 3.673 4.490     .  0 0 "[    .    1    .    2]" 1 
       2043 1  92 ARG QG   1  93 ALA H    . . 3.480 2.298 1.918 3.252     .  0 0 "[    .    1    .    2]" 1 
       2044 1  92 ARG HG2  1  93 ALA H    . . 4.140 3.128 2.002 4.167 0.027 17 0 "[    .    1    .    2]" 1 
       2045 1  92 ARG HG3  1  93 ALA H    . . 4.140 2.409 1.979 3.394     .  0 0 "[    .    1    .    2]" 1 
       2046 1  93 ALA H    1  93 ALA MB   . . 2.990 2.134 2.044 2.272     .  0 0 "[    .    1    .    2]" 1 
       2047 1  93 ALA MB   1  94 LEU H    . . 3.450 2.636 2.265 2.984     .  0 0 "[    .    1    .    2]" 1 
       2048 1  93 ALA MB   1  94 LEU HA   . . 4.750 3.757 3.644 3.880     .  0 0 "[    .    1    .    2]" 1 
       2049 1  94 LEU H    1  94 LEU HB2  . . 3.520 2.424 2.146 3.488     .  0 0 "[    .    1    .    2]" 1 
       2050 1  94 LEU H    1  94 LEU QB   . . 2.950 2.189 2.098 2.257     .  0 0 "[    .    1    .    2]" 1 
       2051 1  94 LEU H    1  94 LEU HB3  . . 3.520 2.798 2.176 3.519     .  0 0 "[    .    1    .    2]" 1 
       2052 1  94 LEU H    1  94 LEU MD1  . . 4.690 3.867 1.992 4.258     .  0 0 "[    .    1    .    2]" 1 
       2053 1  94 LEU H    1  94 LEU QD   . . 3.940 3.421 1.988 3.754     .  0 0 "[    .    1    .    2]" 1 
       2054 1  94 LEU H    1  94 LEU MD2  . . 4.690 4.027 2.015 4.341     .  0 0 "[    .    1    .    2]" 1 
       2055 1  94 LEU H    1  94 LEU HG   . . 4.510 4.142 2.859 4.524 0.014 19 0 "[    .    1    .    2]" 1 
       2056 1  94 LEU HA   1  94 LEU MD1  . . 4.490 2.779 2.005 3.835     .  0 0 "[    .    1    .    2]" 1 
       2057 1  94 LEU HA   1  94 LEU QD   . . 3.000 2.408 1.933 3.063 0.063 20 0 "[    .    1    .    2]" 1 
       2058 1  94 LEU HA   1  94 LEU MD2  . . 4.490 3.386 2.016 4.115     .  0 0 "[    .    1    .    2]" 1 
       2059 1  94 LEU QB   1  95 ARG H    . . 3.420 2.543 2.057 3.333     .  0 0 "[    .    1    .    2]" 1 
       2060 1  94 LEU HB2  1  95 ARG H    . . 4.040 3.549 2.580 4.028     .  0 0 "[    .    1    .    2]" 1 
       2061 1  94 LEU HB3  1  95 ARG H    . . 4.040 2.719 2.070 3.621     .  0 0 "[    .    1    .    2]" 1 
       2062 1  95 ARG HA   1  95 ARG QD   . . 4.490 3.848 2.310 4.390     .  0 0 "[    .    1    .    2]" 1 
       2063 1  95 ARG HA   1  95 ARG QG   . . 3.370 2.493 2.162 3.343     .  0 0 "[    .    1    .    2]" 1 
       2064 1  98 LYS QE   1  99 SER H    . . 4.740 4.147 1.870 4.707     .  0 0 "[    .    1    .    2]" 1 
       2065 1 100 GLY QA   1 101 PRO QD   . . 3.800 2.008 1.921 2.163     .  0 0 "[    .    1    .    2]" 1 
    stop_

save_



Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Tuesday, May 14, 2024 4:01:20 AM GMT (wattos1)