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
400833 1v63 10111 cing 4-filtered-FRED Wattos check violation distance


data_1v63


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              2076
    _Distance_constraint_stats_list.Viol_count                    2523
    _Distance_constraint_stats_list.Viol_total                    3547.008
    _Distance_constraint_stats_list.Viol_max                      0.981
    _Distance_constraint_stats_list.Viol_rms                      0.0329
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0043
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0703
    _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  4 GLY  0.000 0.000  . 0 "[    .    1    .    2]" 
       1  5 SER  0.000 0.000  . 0 "[    .    1    .    2]" 
       1  6 SER  0.000 0.000  . 0 "[    .    1    .    2]" 
       1  7 GLY  0.012 0.008 19 0 "[    .    1    .    2]" 
       1  8 PRO  0.530 0.064 16 0 "[    .    1    .    2]" 
       1  9 LYS  5.705 0.704 16 1 "[    .    1    .+   2]" 
       1 10 LYS 10.910 0.754  3 4 "[  + .    1    .* * -]" 
       1 11 PRO  4.581 0.369 18 0 "[    .    1    .    2]" 
       1 12 PRO  0.825 0.406 16 0 "[    .    1    .    2]" 
       1 13 MET  4.186 0.945  1 3 "[+   .    1  * .   -2]" 
       1 14 ASN  0.081 0.039  4 0 "[    .    1    .    2]" 
       1 15 GLY  0.160 0.041  4 0 "[    .    1    .    2]" 
       1 16 TYR  1.022 0.077 18 0 "[    .    1    .    2]" 
       1 17 GLN  4.161 0.945  1 2 "[+   .    1  - .    2]" 
       1 18 LYS  9.831 0.744 11 8 "[  * .*** *+   .- * 2]" 
       1 19 PHE  3.172 0.122  7 0 "[    .    1    .    2]" 
       1 20 SER  0.729 0.094 19 0 "[    .    1    .    2]" 
       1 21 GLN  3.512 0.367  3 0 "[    .    1    .    2]" 
       1 22 GLU  9.128 0.601  8 3 "[  * .  + 1 -  .    2]" 
       1 23 LEU 12.259 0.601  8 3 "[  * .  + 1 -  .    2]" 
       1 24 LEU  1.639 0.076  2 0 "[    .    1    .    2]" 
       1 25 SER  2.459 0.138 19 0 "[    .    1    .    2]" 
       1 26 ASN  6.894 0.210 20 0 "[    .    1    .    2]" 
       1 27 GLY  1.081 0.076 18 0 "[    .    1    .    2]" 
       1 28 GLU  9.232 0.258 18 0 "[    .    1    .    2]" 
       1 29 LEU  3.159 0.514  1 1 "[+   .    1    .    2]" 
       1 30 ASN  0.000 0.000  . 0 "[    .    1    .    2]" 
       1 31 HIS  0.007 0.007 19 0 "[    .    1    .    2]" 
       1 32 LEU  6.727 0.835  1 1 "[+   .    1    .    2]" 
       1 33 PRO  1.360 0.095 14 0 "[    .    1    .    2]" 
       1 34 LEU  1.556 0.076  8 0 "[    .    1    .    2]" 
       1 35 LYS  3.922 0.744 17 3 "[   *.    1    - +  2]" 
       1 36 GLU 13.438 0.744 17 3 "[   *.    1    - +  2]" 
       1 37 ARG  2.206 0.531  1 1 "[+   .    1    .    2]" 
       1 38 MET  0.812 0.074 13 0 "[    .    1    .    2]" 
       1 39 VAL  2.314 0.201 17 0 "[    .    1    .    2]" 
       1 40 GLU  5.329 0.835  1 1 "[+   .    1    .    2]" 
       1 41 ILE  4.498 0.291  1 0 "[    .    1    .    2]" 
       1 42 GLY  0.033 0.020 17 0 "[    .    1    .    2]" 
       1 43 SER  1.980 0.320  1 0 "[    .    1    .    2]" 
       1 44 ARG  5.561 0.447  1 0 "[    .    1    .    2]" 
       1 45 TRP  2.722 0.452 10 0 "[    .    1    .    2]" 
       1 46 GLN  0.907 0.075 16 0 "[    .    1    .    2]" 
       1 47 ARG  0.210 0.038 19 0 "[    .    1    .    2]" 
       1 48 ILE  2.588 0.499 10 0 "[    .    1    .    2]" 
       1 49 SER  1.653 0.192  6 0 "[    .    1    .    2]" 
       1 50 GLN  1.432 0.297 13 0 "[    .    1    .    2]" 
       1 51 SER  0.512 0.192  6 0 "[    .    1    .    2]" 
       1 52 GLN  1.962 0.152 16 0 "[    .    1    .    2]" 
       1 53 LYS  3.199 0.499 10 0 "[    .    1    .    2]" 
       1 54 GLU  1.338 0.111 13 0 "[    .    1    .    2]" 
       1 55 HIS  2.337 0.152 16 0 "[    .    1    .    2]" 
       1 56 TYR 11.320 0.744 11 8 "[  * .*** *+   .- * 2]" 
       1 57 LYS  0.997 0.153 20 0 "[    .    1    .    2]" 
       1 58 LYS 10.299 0.867  2 5 "[ +  . *  1   *- *  2]" 
       1 59 LEU  5.788 0.466 11 0 "[    .    1    .    2]" 
       1 60 ALA  0.428 0.085 19 0 "[    .    1    .    2]" 
       1 61 GLU  2.222 0.867  2 2 "[ +  . -  1    .    2]" 
       1 62 GLU  4.954 0.303 11 0 "[    .    1    .    2]" 
       1 63 GLN  1.693 0.406 16 0 "[    .    1    .    2]" 
       1 64 GLN  4.703 0.618 19 1 "[    .    1    .   +2]" 
       1 65 ARG  2.627 0.242  4 0 "[    .    1    .    2]" 
       1 66 GLN  0.063 0.032  9 0 "[    .    1    .    2]" 
       1 67 TYR  5.878 0.754  3 3 "[  + .    1    .* - 2]" 
       1 68 LYS  2.387 0.493  3 0 "[    .    1    .    2]" 
       1 69 VAL  3.376 0.493  3 0 "[    .    1    .    2]" 
       1 70 HIS  2.445 0.100  5 0 "[    .    1    .    2]" 
       1 71 LEU  0.086 0.015 17 0 "[    .    1    .    2]" 
       1 72 ASP  0.135 0.023  7 0 "[    .    1    .    2]" 
       1 73 LEU  0.098 0.016  5 0 "[    .    1    .    2]" 
       1 74 TRP  2.411 0.091  2 0 "[    .    1    .    2]" 
       1 75 VAL  1.212 0.101  9 0 "[    .    1    .    2]" 
       1 76 LYS  0.092 0.019 15 0 "[    .    1    .    2]" 
       1 77 SER  0.216 0.093 19 0 "[    .    1    .    2]" 
       1 78 LEU  0.863 0.090 19 0 "[    .    1    .    2]" 
       1 79 SER  1.111 0.406 14 0 "[    .    1    .    2]" 
       1 80 PRO  1.351 0.182  9 0 "[    .    1    .    2]" 
       1 81 GLN  7.153 0.862 15 5 "[ - *.  * 1   *+    2]" 
       1 82 ASP  0.456 0.070 15 0 "[    .    1    .    2]" 
       1 83 ARG  7.202 0.862 15 5 "[ - *.  * 1   *+    2]" 
       1 84 ALA  3.598 0.445 15 0 "[    .    1    .    2]" 
       1 85 ALA  2.223 0.190  6 0 "[    .    1    .    2]" 
       1 86 TYR  1.854 0.491  6 0 "[    .    1    .    2]" 
       1 87 LYS  1.665 0.491  6 0 "[    .    1    .    2]" 
       1 88 GLU  5.934 0.285  2 0 "[    .    1    .    2]" 
       1 89 TYR  2.618 0.776 20 2 "[    .    1    . -  +]" 
       1 90 ILE  6.878 0.453  9 0 "[    .    1    .    2]" 
       1 91 SER  0.471 0.060  6 0 "[    .    1    .    2]" 
       1 92 ASN  0.245 0.085  6 0 "[    .    1    .    2]" 
       1 93 LYS  4.486 0.776 20 5 "[  - .  * 1    . ** +]" 
       1 94 ARG 13.233 0.981  8 7 "[*   *  +**    .-  *2]" 
       1 95 LYS  1.076 0.332 10 0 "[    .    1    .    2]" 
       1 96 SER  0.518 0.092  2 0 "[    .    1    .    2]" 
       1 97 GLY  0.000 0.000  . 0 "[    .    1    .    2]" 
       1 98 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  4 GLY QA   1  5 SER HA   . . 5.060 3.973 3.900 4.305     .  0 0 "[    .    1    .    2]" 1 
          2 1  4 GLY QA   1  6 SER H    . . 5.500 4.585 3.916 5.438     .  0 0 "[    .    1    .    2]" 1 
          3 1  6 SER H    1  7 GLY H    . . 5.040 4.108 2.499 4.643     .  0 0 "[    .    1    .    2]" 1 
          4 1  6 SER HB3  1  7 GLY H    . . 4.950 3.415 2.250 4.318     .  0 0 "[    .    1    .    2]" 1 
          5 1  7 GLY H    1  8 PRO HD2  . . 5.090 3.120 2.128 4.909     .  0 0 "[    .    1    .    2]" 1 
          6 1  7 GLY H    1  8 PRO HD3  . . 4.470 3.538 2.851 4.439     .  0 0 "[    .    1    .    2]" 1 
          7 1  7 GLY H    1 74 TRP HE1  . . 5.500 4.977 4.349 5.462     .  0 0 "[    .    1    .    2]" 1 
          8 1  7 GLY QA   1 74 TRP HD1  . . 5.190 3.441 2.540 3.985     .  0 0 "[    .    1    .    2]" 1 
          9 1  7 GLY QA   1 74 TRP HE1  . . 5.340 4.895 3.976 5.348 0.008 19 0 "[    .    1    .    2]" 1 
         10 1  8 PRO HA   1  9 LYS H    . . 2.880 2.265 2.155 2.636     .  0 0 "[    .    1    .    2]" 1 
         11 1  8 PRO HA   1  9 LYS QB   . . 4.280 4.007 3.867 4.158     .  0 0 "[    .    1    .    2]" 1 
         12 1  8 PRO HA   1  9 LYS QG   . . 4.950 4.624 4.225 4.969 0.019  3 0 "[    .    1    .    2]" 1 
         13 1  8 PRO HB2  1  9 LYS H    . . 4.040 3.234 2.249 3.685     .  0 0 "[    .    1    .    2]" 1 
         14 1  8 PRO HB2  1 67 TYR HA   . . 4.950 3.912 3.663 4.177     .  0 0 "[    .    1    .    2]" 1 
         15 1  8 PRO HB2  1 67 TYR QD   . . 3.670 2.635 1.976 3.192     .  0 0 "[    .    1    .    2]" 1 
         16 1  8 PRO HB2  1 67 TYR QE   . . 3.620 2.866 2.703 3.031     .  0 0 "[    .    1    .    2]" 1 
         17 1  8 PRO HB2  1 70 HIS HB2  . . 4.410 3.973 3.343 4.156     .  0 0 "[    .    1    .    2]" 1 
         18 1  8 PRO HB2  1 70 HIS HB3  . . 4.320 4.297 3.882 4.361 0.041 20 0 "[    .    1    .    2]" 1 
         19 1  8 PRO HB2  1 71 LEU QD   . . 4.690 3.337 2.910 3.726     .  0 0 "[    .    1    .    2]" 1 
         20 1  8 PRO HB3  1  9 LYS H    . . 3.980 3.704 3.197 3.993 0.013  3 0 "[    .    1    .    2]" 1 
         21 1  8 PRO HB3  1 67 TYR QD   . . 4.230 3.587 2.446 4.253 0.023 16 0 "[    .    1    .    2]" 1 
         22 1  8 PRO HB3  1 67 TYR QE   . . 4.420 4.412 4.027 4.484 0.064 16 0 "[    .    1    .    2]" 1 
         23 1  8 PRO HB3  1 70 HIS HB2  . . 4.410 2.666 2.295 3.666     .  0 0 "[    .    1    .    2]" 1 
         24 1  8 PRO HB3  1 70 HIS HB3  . . 4.180 2.671 2.516 3.456     .  0 0 "[    .    1    .    2]" 1 
         25 1  8 PRO HD2  1 71 LEU HA   . . 5.350 4.747 4.133 5.159     .  0 0 "[    .    1    .    2]" 1 
         26 1  8 PRO HD2  1 71 LEU QD   . . 4.040 3.415 2.642 3.731     .  0 0 "[    .    1    .    2]" 1 
         27 1  8 PRO HD2  1 74 TRP HB2  . . 4.560 4.285 3.274 4.524     .  0 0 "[    .    1    .    2]" 1 
         28 1  8 PRO HD2  1 74 TRP HB3  . . 5.060 4.698 3.817 4.998     .  0 0 "[    .    1    .    2]" 1 
         29 1  8 PRO HD3  1 71 LEU QD   . . 5.500 3.558 3.237 4.031     .  0 0 "[    .    1    .    2]" 1 
         30 1  8 PRO HD3  1 74 TRP HB2  . . 5.060 2.914 2.655 3.441     .  0 0 "[    .    1    .    2]" 1 
         31 1  8 PRO HD3  1 74 TRP HB3  . . 5.190 3.603 3.170 4.081     .  0 0 "[    .    1    .    2]" 1 
         32 1  8 PRO HD3  1 74 TRP HD1  . . 5.030 4.092 3.383 4.768     .  0 0 "[    .    1    .    2]" 1 
         33 1  8 PRO HG2  1 67 TYR QE   . . 4.150 3.744 3.063 4.160 0.010 17 0 "[    .    1    .    2]" 1 
         34 1  8 PRO HG2  1 70 HIS HB2  . . 5.190 4.875 4.076 5.177     .  0 0 "[    .    1    .    2]" 1 
         35 1  8 PRO HG2  1 70 HIS HB3  . . 5.350 4.819 4.038 5.361 0.011 16 0 "[    .    1    .    2]" 1 
         36 1  8 PRO HG2  1 71 LEU QD   . . 3.990 2.073 1.778 2.481     .  0 0 "[    .    1    .    2]" 1 
         37 1  8 PRO HG3  1 67 TYR QE   . . 5.350 4.776 4.077 5.108     .  0 0 "[    .    1    .    2]" 1 
         38 1  8 PRO HG3  1 70 HIS HB2  . . 4.950 3.653 2.763 4.449     .  0 0 "[    .    1    .    2]" 1 
         39 1  8 PRO HG3  1 70 HIS HB3  . . 4.690 3.375 2.676 4.527     .  0 0 "[    .    1    .    2]" 1 
         40 1  8 PRO HG3  1 71 LEU HA   . . 4.250 2.627 2.147 3.353     .  0 0 "[    .    1    .    2]" 1 
         41 1  8 PRO HG3  1 74 TRP HB2  . . 5.190 3.981 3.119 4.602     .  0 0 "[    .    1    .    2]" 1 
         42 1  8 PRO HG3  1 74 TRP HB3  . . 5.190 3.757 2.987 4.296     .  0 0 "[    .    1    .    2]" 1 
         43 1  9 LYS H    1  9 LYS QB   . . 3.070 2.495 2.045 3.088 0.018 20 0 "[    .    1    .    2]" 1 
         44 1  9 LYS H    1  9 LYS QD   . . 4.770 3.768 1.815 4.750     .  0 0 "[    .    1    .    2]" 1 
         45 1  9 LYS H    1  9 LYS QG   . . 3.830 3.175 2.402 3.826     .  0 0 "[    .    1    .    2]" 1 
         46 1  9 LYS H    1 67 TYR QD   . . 5.190 3.491 2.922 4.417     .  0 0 "[    .    1    .    2]" 1 
         47 1  9 LYS H    1 67 TYR QE   . . 5.500 4.434 4.056 4.910     .  0 0 "[    .    1    .    2]" 1 
         48 1  9 LYS HA   1  9 LYS QD   . . 3.770 3.708 3.565 3.770 0.000  9 0 "[    .    1    .    2]" 1 
         49 1  9 LYS HA   1  9 LYS QG   . . 3.670 2.681 1.968 3.390     .  0 0 "[    .    1    .    2]" 1 
         50 1  9 LYS HA   1 10 LYS H    . . 2.880 2.354 2.177 3.008 0.128 20 0 "[    .    1    .    2]" 1 
         51 1  9 LYS HA   1 10 LYS HB2  . . 5.060 4.303 3.974 4.943     .  0 0 "[    .    1    .    2]" 1 
         52 1  9 LYS HA   1 10 LYS HB3  . . 4.850 5.081 4.746 5.554 0.704 16 1 "[    .    1    .+   2]" 1 
         53 1  9 LYS HA   1 67 TYR QE   . . 5.030 4.306 3.583 5.084 0.054 20 0 "[    .    1    .    2]" 1 
         54 1  9 LYS QB   1 10 LYS H    . . 3.720 3.117 2.173 4.106 0.386 20 0 "[    .    1    .    2]" 1 
         55 1  9 LYS QD   1  9 LYS QG   . . 2.440 2.093 2.048 2.134     .  0 0 "[    .    1    .    2]" 1 
         56 1  9 LYS QE   1  9 LYS QG   . . 3.010 2.098 1.950 2.328     .  0 0 "[    .    1    .    2]" 1 
         57 1  9 LYS QG   1 10 LYS H    . . 3.550 3.446 2.949 3.611 0.061  6 0 "[    .    1    .    2]" 1 
         58 1 10 LYS H    1 10 LYS HB2  . . 3.800 2.268 2.041 3.021     .  0 0 "[    .    1    .    2]" 1 
         59 1 10 LYS H    1 10 LYS HB3  . . 3.250 2.942 2.419 3.879 0.629 16 2 "[    .    1    .+   -]" 1 
         60 1 10 LYS H    1 10 LYS QD   . . 4.410 3.933 3.067 4.426 0.016  7 0 "[    .    1    .    2]" 1 
         61 1 10 LYS H    1 10 LYS QE   . . 5.040 4.638 3.557 5.057 0.017  3 0 "[    .    1    .    2]" 1 
         62 1 10 LYS H    1 10 LYS HG3  . . 4.230 4.246 3.878 4.420 0.190  3 0 "[    .    1    .    2]" 1 
         63 1 10 LYS H    1 67 TYR QE   . . 4.800 4.069 2.676 4.993 0.193 16 0 "[    .    1    .    2]" 1 
         64 1 10 LYS HA   1 10 LYS QD   . . 4.690 3.064 2.454 3.613     .  0 0 "[    .    1    .    2]" 1 
         65 1 10 LYS HA   1 10 LYS HG2  . . 4.250 3.323 2.273 3.761     .  0 0 "[    .    1    .    2]" 1 
         66 1 10 LYS HA   1 67 TYR QE   . . 3.990 2.992 2.479 3.838     .  0 0 "[    .    1    .    2]" 1 
         67 1 10 LYS HB2  1 10 LYS QE   . . 4.320 3.196 1.908 4.221     .  0 0 "[    .    1    .    2]" 1 
         68 1 10 LYS HB3  1 10 LYS QE   . . 4.180 3.853 2.820 4.289 0.109 12 0 "[    .    1    .    2]" 1 
         69 1 10 LYS QD   1 67 TYR QE   . . 4.850 4.097 2.311 4.868 0.018 17 0 "[    .    1    .    2]" 1 
         70 1 10 LYS QE   1 10 LYS HG3  . . 3.380 2.569 1.976 3.384 0.004 10 0 "[    .    1    .    2]" 1 
         71 1 10 LYS QE   1 67 TYR QE   . . 4.270 3.899 2.766 4.291 0.021  4 0 "[    .    1    .    2]" 1 
         72 1 10 LYS HG3  1 67 TYR QE   . . 4.550 4.559 4.176 5.304 0.754  3 3 "[  + .    1    .* - 2]" 1 
         73 1 11 PRO HA   1 12 PRO HD2  . . 3.450 2.932 2.834 2.957     .  0 0 "[    .    1    .    2]" 1 
         74 1 11 PRO HA   1 12 PRO HD3  . . 3.320 2.166 2.094 2.185     .  0 0 "[    .    1    .    2]" 1 
         75 1 11 PRO HB2  1 12 PRO HD3  . . 3.300 3.131 3.080 3.328 0.028  5 0 "[    .    1    .    2]" 1 
         76 1 11 PRO HB2  1 63 GLN HE21 . . 5.420 3.931 3.266 4.992     .  0 0 "[    .    1    .    2]" 1 
         77 1 11 PRO HB2  1 63 GLN HE22 . . 5.500 4.526 4.033 5.068     .  0 0 "[    .    1    .    2]" 1 
         78 1 11 PRO HB2  1 64 GLN HA   . . 4.410 3.558 2.914 4.020     .  0 0 "[    .    1    .    2]" 1 
         79 1 11 PRO HB2  1 64 GLN HG2  . . 4.450 2.912 2.064 3.193     .  0 0 "[    .    1    .    2]" 1 
         80 1 11 PRO HB2  1 64 GLN HG3  . . 4.450 2.727 2.211 3.079     .  0 0 "[    .    1    .    2]" 1 
         81 1 11 PRO HB2  1 67 TYR QB   . . 4.450 4.312 4.095 4.648 0.198 16 0 "[    .    1    .    2]" 1 
         82 1 11 PRO HB3  1 12 PRO HD2  . . 3.480 2.772 2.751 2.859     .  0 0 "[    .    1    .    2]" 1 
         83 1 11 PRO HB3  1 12 PRO HD3  . . 3.890 3.161 3.127 3.297     .  0 0 "[    .    1    .    2]" 1 
         84 1 11 PRO HB3  1 63 GLN HG2  . . 4.950 4.227 1.980 4.870     .  0 0 "[    .    1    .    2]" 1 
         85 1 11 PRO HB3  1 63 GLN HG3  . . 5.190 3.598 2.215 4.580     .  0 0 "[    .    1    .    2]" 1 
         86 1 11 PRO HB3  1 64 GLN HA   . . 4.410 3.931 3.225 4.395     .  0 0 "[    .    1    .    2]" 1 
         87 1 11 PRO HB3  1 64 GLN HG2  . . 4.360 4.263 3.332 4.454 0.094 11 0 "[    .    1    .    2]" 1 
         88 1 11 PRO HB3  1 64 GLN HG3  . . 4.090 4.162 3.379 4.459 0.369 18 0 "[    .    1    .    2]" 1 
         89 1 11 PRO HD2  1 67 TYR QD   . . 4.150 3.541 2.581 3.893     .  0 0 "[    .    1    .    2]" 1 
         90 1 11 PRO HD3  1 67 TYR QD   . . 5.190 2.252 1.991 3.107     .  0 0 "[    .    1    .    2]" 1 
         91 1 11 PRO HG2  1 12 PRO HD2  . . 5.350 4.334 4.278 4.551     .  0 0 "[    .    1    .    2]" 1 
         92 1 11 PRO HG2  1 64 GLN HA   . . 4.360 2.501 1.992 3.234     .  0 0 "[    .    1    .    2]" 1 
         93 1 11 PRO HG2  1 64 GLN HG2  . . 4.120 2.071 1.987 2.205     .  0 0 "[    .    1    .    2]" 1 
         94 1 11 PRO HG2  1 64 GLN HG3  . . 4.850 3.153 2.720 3.513     .  0 0 "[    .    1    .    2]" 1 
         95 1 11 PRO HG2  1 67 TYR QB   . . 4.620 3.229 2.897 3.689     .  0 0 "[    .    1    .    2]" 1 
         96 1 11 PRO HG2  1 67 TYR QD   . . 3.940 3.858 3.444 4.036 0.096 20 0 "[    .    1    .    2]" 1 
         97 1 11 PRO HG3  1 12 PRO HD2  . . 5.470 4.667 4.624 4.837     .  0 0 "[    .    1    .    2]" 1 
         98 1 11 PRO HG3  1 64 GLN HA   . . 3.800 2.603 2.022 2.864     .  0 0 "[    .    1    .    2]" 1 
         99 1 11 PRO HG3  1 64 GLN HG2  . . 4.450 3.561 3.035 3.781     .  0 0 "[    .    1    .    2]" 1 
        100 1 11 PRO HG3  1 64 GLN HG3  . . 4.510 4.205 3.845 4.516 0.006  5 0 "[    .    1    .    2]" 1 
        101 1 11 PRO HG3  1 67 TYR H    . . 5.040 3.908 3.404 4.464     .  0 0 "[    .    1    .    2]" 1 
        102 1 11 PRO HG3  1 67 TYR QB   . . 4.150 2.065 1.871 2.370     .  0 0 "[    .    1    .    2]" 1 
        103 1 11 PRO HG3  1 67 TYR QD   . . 3.620 2.902 2.322 3.507     .  0 0 "[    .    1    .    2]" 1 
        104 1 12 PRO HA   1 13 MET H    . . 3.160 2.619 2.287 2.783     .  0 0 "[    .    1    .    2]" 1 
        105 1 12 PRO HA   1 13 MET QB   . . 4.850 4.155 3.919 4.432     .  0 0 "[    .    1    .    2]" 1 
        106 1 12 PRO HA   1 13 MET HG2  . . 5.060 4.107 2.988 4.942     .  0 0 "[    .    1    .    2]" 1 
        107 1 12 PRO HA   1 13 MET HG3  . . 4.690 4.458 4.041 4.880 0.190 20 0 "[    .    1    .    2]" 1 
        108 1 12 PRO HA   1 17 GLN HB3  . . 4.620 3.575 3.064 4.067     .  0 0 "[    .    1    .    2]" 1 
        109 1 12 PRO HA   1 17 GLN HE21 . . 5.060 3.338 2.265 3.801     .  0 0 "[    .    1    .    2]" 1 
        110 1 12 PRO HA   1 60 ALA MB   . . 5.060 4.712 4.100 5.102 0.042 18 0 "[    .    1    .    2]" 1 
        111 1 12 PRO HB2  1 13 MET H    . . 4.620 2.299 1.947 3.116     .  0 0 "[    .    1    .    2]" 1 
        112 1 12 PRO HB2  1 18 LYS H    . . 4.050 3.306 2.766 3.729     .  0 0 "[    .    1    .    2]" 1 
        113 1 12 PRO HB2  1 60 ALA MB   . . 3.680 2.907 2.451 3.349     .  0 0 "[    .    1    .    2]" 1 
        114 1 12 PRO HB3  1 13 MET H    . . 4.320 3.228 3.101 3.619     .  0 0 "[    .    1    .    2]" 1 
        115 1 12 PRO HB3  1 17 GLN HE21 . . 4.770 4.000 3.265 4.599     .  0 0 "[    .    1    .    2]" 1 
        116 1 12 PRO HB3  1 18 LYS H    . . 4.510 3.709 2.884 4.110     .  0 0 "[    .    1    .    2]" 1 
        117 1 12 PRO HB3  1 18 LYS HA   . . 3.990 2.790 2.246 3.338     .  0 0 "[    .    1    .    2]" 1 
        118 1 12 PRO HB3  1 60 ALA MB   . . 5.060 4.321 3.913 4.667     .  0 0 "[    .    1    .    2]" 1 
        119 1 12 PRO HD2  1 60 ALA MB   . . 4.850 3.975 3.543 4.292     .  0 0 "[    .    1    .    2]" 1 
        120 1 12 PRO HD2  1 63 GLN HB2  . . 4.770 2.889 2.467 4.155     .  0 0 "[    .    1    .    2]" 1 
        121 1 12 PRO HD2  1 63 GLN HB3  . . 4.040 2.359 2.021 3.292     .  0 0 "[    .    1    .    2]" 1 
        122 1 12 PRO HD2  1 63 GLN HE21 . . 5.500 3.395 2.624 4.423     .  0 0 "[    .    1    .    2]" 1 
        123 1 12 PRO HD2  1 63 GLN HE22 . . 5.500 4.483 3.612 5.200     .  0 0 "[    .    1    .    2]" 1 
        124 1 12 PRO HD2  1 64 GLN HG3  . . 4.950 3.749 3.066 4.119     .  0 0 "[    .    1    .    2]" 1 
        125 1 12 PRO HD3  1 63 GLN HB2  . . 4.850 4.205 3.802 4.770     .  0 0 "[    .    1    .    2]" 1 
        126 1 12 PRO HD3  1 63 GLN HB3  . . 4.250 3.579 3.248 4.359 0.109 19 0 "[    .    1    .    2]" 1 
        127 1 12 PRO HD3  1 63 GLN HE21 . . 5.190 2.867 1.971 4.483     .  0 0 "[    .    1    .    2]" 1 
        128 1 12 PRO HD3  1 63 GLN HE22 . . 5.190 3.910 2.787 4.996     .  0 0 "[    .    1    .    2]" 1 
        129 1 12 PRO HD3  1 63 GLN HG3  . . 4.950 3.391 2.612 4.872     .  0 0 "[    .    1    .    2]" 1 
        130 1 12 PRO QG   1 18 LYS H    . . 5.060 4.102 3.645 4.541     .  0 0 "[    .    1    .    2]" 1 
        131 1 12 PRO QG   1 18 LYS HA   . . 3.990 2.498 1.991 3.027     .  0 0 "[    .    1    .    2]" 1 
        132 1 12 PRO QG   1 18 LYS HB2  . . 3.950 2.379 1.973 3.009     .  0 0 "[    .    1    .    2]" 1 
        133 1 12 PRO QG   1 18 LYS HG2  . . 4.620 4.012 3.366 4.421     .  0 0 "[    .    1    .    2]" 1 
        134 1 12 PRO QG   1 60 ALA H    . . 4.870 4.253 3.617 4.745     .  0 0 "[    .    1    .    2]" 1 
        135 1 12 PRO QG   1 60 ALA HA   . . 4.210 2.475 1.988 3.015     .  0 0 "[    .    1    .    2]" 1 
        136 1 12 PRO QG   1 60 ALA MB   . . 4.180 2.696 1.967 2.857     .  0 0 "[    .    1    .    2]" 1 
        137 1 12 PRO QG   1 63 GLN HE21 . . 5.210 4.193 3.291 5.616 0.406 16 0 "[    .    1    .    2]" 1 
        138 1 13 MET H    1 13 MET QB   . . 3.700 2.674 2.242 3.278     .  0 0 "[    .    1    .    2]" 1 
        139 1 13 MET H    1 13 MET HG2  . . 4.210 3.420 2.418 4.200     .  0 0 "[    .    1    .    2]" 1 
        140 1 13 MET H    1 13 MET HG3  . . 4.040 3.588 2.340 4.213 0.173 15 0 "[    .    1    .    2]" 1 
        141 1 13 MET H    1 17 GLN HB2  . . 4.320 2.439 1.938 2.869     .  0 0 "[    .    1    .    2]" 1 
        142 1 13 MET H    1 17 GLN HB3  . . 3.380 3.488 3.239 4.325 0.945  1 2 "[+   .    1  - .    2]" 1 
        143 1 13 MET H    1 17 GLN HE21 . . 4.000 1.958 1.841 2.200     .  0 0 "[    .    1    .    2]" 1 
        144 1 13 MET H    1 17 GLN HE22 . . 5.500 3.174 2.507 3.741     .  0 0 "[    .    1    .    2]" 1 
        145 1 13 MET H    1 17 GLN HG2  . . 5.210 5.067 4.693 5.219 0.009 10 0 "[    .    1    .    2]" 1 
        146 1 13 MET H    1 17 GLN HG3  . . 5.340 4.197 3.645 4.538     .  0 0 "[    .    1    .    2]" 1 
        147 1 13 MET HA   1 13 MET ME   . . 4.320 4.110 3.149 4.317     .  0 0 "[    .    1    .    2]" 1 
        148 1 13 MET HA   1 13 MET HG3  . . 4.250 3.537 3.187 3.777     .  0 0 "[    .    1    .    2]" 1 
        149 1 13 MET HA   1 17 GLN HE21 . . 4.410 4.323 4.046 4.530 0.120  3 0 "[    .    1    .    2]" 1 
        150 1 13 MET HA   1 64 GLN HE21 . . 3.970 3.307 2.352 4.588 0.618 19 1 "[    .    1    .   +2]" 1 
        151 1 13 MET HA   1 64 GLN HE22 . . 4.620 2.644 1.951 3.528     .  0 0 "[    .    1    .    2]" 1 
        152 1 13 MET HA   1 64 GLN HG2  . . 5.190 4.669 4.249 5.060     .  0 0 "[    .    1    .    2]" 1 
        153 1 13 MET QB   1 14 ASN HD22 . . 5.270 3.824 2.404 5.022     .  0 0 "[    .    1    .    2]" 1 
        154 1 13 MET QB   1 17 GLN HE21 . . 4.640 2.626 2.001 4.163     .  0 0 "[    .    1    .    2]" 1 
        155 1 13 MET QB   1 17 GLN HE22 . . 5.060 2.610 1.940 3.988     .  0 0 "[    .    1    .    2]" 1 
        156 1 13 MET ME   1 13 MET HG2  . . 3.870 3.212 2.225 3.388     .  0 0 "[    .    1    .    2]" 1 
        157 1 13 MET ME   1 14 ASN HD21 . . 5.060 4.290 2.352 5.029     .  0 0 "[    .    1    .    2]" 1 
        158 1 13 MET ME   1 14 ASN HD22 . . 4.950 3.898 2.558 4.954 0.004  4 0 "[    .    1    .    2]" 1 
        159 1 13 MET HG2  1 17 GLN HE21 . . 5.350 3.916 2.245 4.871     .  0 0 "[    .    1    .    2]" 1 
        160 1 13 MET HG3  1 17 GLN HE21 . . 4.790 3.484 1.985 4.277     .  0 0 "[    .    1    .    2]" 1 
        161 1 13 MET HG3  1 17 GLN HE22 . . 5.500 2.903 1.938 3.891     .  0 0 "[    .    1    .    2]" 1 
        162 1 14 ASN HA   1 14 ASN HD22 . . 5.500 4.612 4.281 5.163     .  0 0 "[    .    1    .    2]" 1 
        163 1 14 ASN HA   1 16 TYR H    . . 5.500 4.584 3.888 5.072     .  0 0 "[    .    1    .    2]" 1 
        164 1 14 ASN HA   1 60 ALA MB   . . 4.250 3.880 3.385 4.289 0.039  4 0 "[    .    1    .    2]" 1 
        165 1 14 ASN HB2  1 15 GLY H    . . 4.540 2.899 1.963 4.351     .  0 0 "[    .    1    .    2]" 1 
        166 1 14 ASN HB2  1 16 TYR H    . . 4.700 2.976 2.301 4.264     .  0 0 "[    .    1    .    2]" 1 
        167 1 14 ASN HB3  1 15 GLY H    . . 4.620 2.832 1.993 3.848     .  0 0 "[    .    1    .    2]" 1 
        168 1 14 ASN HB3  1 16 TYR H    . . 5.150 3.027 2.448 4.398     .  0 0 "[    .    1    .    2]" 1 
        169 1 14 ASN HD21 1 16 TYR QD   . . 5.500 4.720 3.772 5.356     .  0 0 "[    .    1    .    2]" 1 
        170 1 14 ASN HD21 1 17 GLN H    . . 5.500 4.329 3.398 5.219     .  0 0 "[    .    1    .    2]" 1 
        171 1 14 ASN HD21 1 17 GLN HG3  . . 5.210 3.500 2.428 4.678     .  0 0 "[    .    1    .    2]" 1 
        172 1 15 GLY H    1 16 TYR H    . . 4.200 2.480 1.892 3.015     .  0 0 "[    .    1    .    2]" 1 
        173 1 15 GLY H    1 57 LYS HA   . . 4.510 3.364 1.968 4.511 0.001  1 0 "[    .    1    .    2]" 1 
        174 1 15 GLY H    1 60 ALA MB   . . 5.350 3.850 3.281 4.340     .  0 0 "[    .    1    .    2]" 1 
        175 1 15 GLY QA   1 17 GLN H    . . 5.270 4.389 3.790 4.788     .  0 0 "[    .    1    .    2]" 1 
        176 1 15 GLY QA   1 18 LYS H    . . 4.730 3.392 3.149 3.657     .  0 0 "[    .    1    .    2]" 1 
        177 1 15 GLY QA   1 18 LYS HB2  . . 4.620 3.400 3.035 3.741     .  0 0 "[    .    1    .    2]" 1 
        178 1 15 GLY QA   1 18 LYS HB3  . . 4.620 2.614 2.401 2.923     .  0 0 "[    .    1    .    2]" 1 
        179 1 15 GLY QA   1 45 TRP HH2  . . 3.870 2.457 1.984 2.992     .  0 0 "[    .    1    .    2]" 1 
        180 1 15 GLY QA   1 45 TRP HZ2  . . 4.620 3.946 3.539 4.283     .  0 0 "[    .    1    .    2]" 1 
        181 1 15 GLY QA   1 45 TRP HZ3  . . 5.030 3.933 3.484 4.470     .  0 0 "[    .    1    .    2]" 1 
        182 1 15 GLY QA   1 56 TYR H    . . 4.950 4.690 4.254 4.991 0.041  4 0 "[    .    1    .    2]" 1 
        183 1 15 GLY QA   1 56 TYR HB2  . . 4.250 3.126 2.587 3.550     .  0 0 "[    .    1    .    2]" 1 
        184 1 15 GLY QA   1 56 TYR HB3  . . 4.320 2.549 2.101 2.978     .  0 0 "[    .    1    .    2]" 1 
        185 1 15 GLY QA   1 56 TYR QD   . . 5.030 4.289 3.881 4.660     .  0 0 "[    .    1    .    2]" 1 
        186 1 15 GLY QA   1 57 LYS H    . . 3.960 2.867 2.186 3.563     .  0 0 "[    .    1    .    2]" 1 
        187 1 15 GLY QA   1 57 LYS HB3  . . 4.770 3.661 2.241 4.324     .  0 0 "[    .    1    .    2]" 1 
        188 1 15 GLY QA   1 57 LYS QD   . . 4.620 3.874 3.064 4.598     .  0 0 "[    .    1    .    2]" 1 
        189 1 15 GLY QA   1 57 LYS HG2  . . 4.950 4.659 4.240 4.915     .  0 0 "[    .    1    .    2]" 1 
        190 1 15 GLY QA   1 57 LYS HG3  . . 5.060 3.769 3.459 4.531     .  0 0 "[    .    1    .    2]" 1 
        191 1 15 GLY QA   1 60 ALA H    . . 4.870 3.886 3.557 4.192     .  0 0 "[    .    1    .    2]" 1 
        192 1 15 GLY QA   1 60 ALA MB   . . 4.040 2.807 2.282 3.377     .  0 0 "[    .    1    .    2]" 1 
        193 1 16 TYR H    1 16 TYR HB2  . . 3.600 2.427 2.316 2.549     .  0 0 "[    .    1    .    2]" 1 
        194 1 16 TYR H    1 16 TYR HB3  . . 3.560 2.224 2.113 2.340     .  0 0 "[    .    1    .    2]" 1 
        195 1 16 TYR H    1 16 TYR QD   . . 4.870 4.057 4.033 4.072     .  0 0 "[    .    1    .    2]" 1 
        196 1 16 TYR H    1 17 GLN H    . . 3.790 2.816 2.605 3.110     .  0 0 "[    .    1    .    2]" 1 
        197 1 16 TYR H    1 17 GLN HG3  . . 5.500 4.655 3.912 5.432     .  0 0 "[    .    1    .    2]" 1 
        198 1 16 TYR H    1 18 LYS H    . . 4.910 3.887 3.672 4.037     .  0 0 "[    .    1    .    2]" 1 
        199 1 16 TYR H    1 45 TRP HE1  . . 5.500 5.168 4.906 5.426     .  0 0 "[    .    1    .    2]" 1 
        200 1 16 TYR H    1 45 TRP HH2  . . 4.990 3.478 2.965 3.960     .  0 0 "[    .    1    .    2]" 1 
        201 1 16 TYR H    1 45 TRP HZ2  . . 4.510 3.485 3.135 3.780     .  0 0 "[    .    1    .    2]" 1 
        202 1 16 TYR HA   1 16 TYR QD   . . 3.730 2.314 2.126 2.481     .  0 0 "[    .    1    .    2]" 1 
        203 1 16 TYR HA   1 19 PHE H    . . 5.190 3.537 3.338 3.665     .  0 0 "[    .    1    .    2]" 1 
        204 1 16 TYR HA   1 19 PHE HB2  . . 4.450 4.220 3.931 4.498 0.048 19 0 "[    .    1    .    2]" 1 
        205 1 16 TYR HA   1 19 PHE HB3  . . 4.120 2.863 2.538 3.098     .  0 0 "[    .    1    .    2]" 1 
        206 1 16 TYR HA   1 19 PHE QD   . . 5.030 3.597 3.053 4.026     .  0 0 "[    .    1    .    2]" 1 
        207 1 16 TYR HA   1 20 SER H    . . 5.500 3.928 3.623 4.311     .  0 0 "[    .    1    .    2]" 1 
        208 1 16 TYR HA   1 45 TRP HH2  . . 4.900 3.371 3.148 3.616     .  0 0 "[    .    1    .    2]" 1 
        209 1 16 TYR HA   1 45 TRP HZ2  . . 4.900 3.797 3.524 4.095     .  0 0 "[    .    1    .    2]" 1 
        210 1 16 TYR HA   1 45 TRP HZ3  . . 5.350 2.992 2.844 3.277     .  0 0 "[    .    1    .    2]" 1 
        211 1 16 TYR HB2  1 17 GLN H    . . 4.690 3.731 3.514 4.068     .  0 0 "[    .    1    .    2]" 1 
        212 1 16 TYR HB2  1 45 TRP HE1  . . 4.560 3.291 3.072 3.372     .  0 0 "[    .    1    .    2]" 1 
        213 1 16 TYR HB2  1 45 TRP HH2  . . 5.380 4.260 4.012 4.515     .  0 0 "[    .    1    .    2]" 1 
        214 1 16 TYR HB2  1 45 TRP HZ2  . . 4.550 3.112 2.943 3.297     .  0 0 "[    .    1    .    2]" 1 
        215 1 16 TYR HB3  1 17 GLN H    . . 3.900 2.253 1.937 2.762     .  0 0 "[    .    1    .    2]" 1 
        216 1 16 TYR HB3  1 45 TRP HE1  . . 4.990 4.962 4.719 5.008 0.018 17 0 "[    .    1    .    2]" 1 
        217 1 16 TYR HB3  1 45 TRP HZ2  . . 4.900 4.551 4.354 4.739     .  0 0 "[    .    1    .    2]" 1 
        218 1 16 TYR QD   1 17 GLN H    . . 4.620 3.433 3.054 3.902     .  0 0 "[    .    1    .    2]" 1 
        219 1 16 TYR QD   1 17 GLN HA   . . 4.700 4.026 3.823 4.174     .  0 0 "[    .    1    .    2]" 1 
        220 1 16 TYR QD   1 17 GLN HG2  . . 5.060 3.658 3.348 3.965     .  0 0 "[    .    1    .    2]" 1 
        221 1 16 TYR QD   1 17 GLN HG3  . . 4.700 3.244 2.949 3.458     .  0 0 "[    .    1    .    2]" 1 
        222 1 16 TYR QD   1 41 ILE MG   . . 4.900 3.882 3.739 4.038     .  0 0 "[    .    1    .    2]" 1 
        223 1 16 TYR QD   1 42 GLY HA2  . . 5.190 4.358 4.211 4.535     .  0 0 "[    .    1    .    2]" 1 
        224 1 16 TYR QD   1 45 TRP HA   . . 4.850 4.474 4.240 4.654     .  0 0 "[    .    1    .    2]" 1 
        225 1 16 TYR QD   1 45 TRP HB2  . . 4.270 2.561 2.257 2.747     .  0 0 "[    .    1    .    2]" 1 
        226 1 16 TYR QD   1 45 TRP HB3  . . 4.370 3.194 3.035 3.310     .  0 0 "[    .    1    .    2]" 1 
        227 1 16 TYR QD   1 45 TRP HD1  . . 4.550 3.670 3.542 3.793     .  0 0 "[    .    1    .    2]" 1 
        228 1 16 TYR QD   1 45 TRP HE1  . . 4.910 4.153 4.050 4.337     .  0 0 "[    .    1    .    2]" 1 
        229 1 16 TYR QD   1 45 TRP HE3  . . 3.320 3.116 2.848 3.304     .  0 0 "[    .    1    .    2]" 1 
        230 1 16 TYR QD   1 45 TRP HZ2  . . 4.730 4.645 4.556 4.807 0.077 18 0 "[    .    1    .    2]" 1 
        231 1 16 TYR QE   1 17 GLN HA   . . 4.900 4.823 4.687 4.915 0.015 19 0 "[    .    1    .    2]" 1 
        232 1 16 TYR QE   1 17 GLN HG2  . . 4.550 4.523 4.344 4.573 0.023 17 0 "[    .    1    .    2]" 1 
        233 1 16 TYR QE   1 19 PHE QE   . . 4.370 3.867 3.208 4.240     .  0 0 "[    .    1    .    2]" 1 
        234 1 16 TYR QE   1 20 SER QB   . . 5.190 4.366 3.566 4.623     .  0 0 "[    .    1    .    2]" 1 
        235 1 16 TYR QE   1 41 ILE HB   . . 4.900 4.129 3.870 4.409     .  0 0 "[    .    1    .    2]" 1 
        236 1 16 TYR QE   1 41 ILE MD   . . 5.190 4.918 4.568 5.168     .  0 0 "[    .    1    .    2]" 1 
        237 1 16 TYR QE   1 41 ILE MG   . . 3.390 2.441 2.143 2.672     .  0 0 "[    .    1    .    2]" 1 
        238 1 16 TYR QE   1 42 GLY H    . . 4.700 3.747 3.518 3.991     .  0 0 "[    .    1    .    2]" 1 
        239 1 16 TYR QE   1 42 GLY HA2  . . 3.470 2.263 1.994 2.614     .  0 0 "[    .    1    .    2]" 1 
        240 1 16 TYR QE   1 43 SER H    . . 5.500 5.304 5.161 5.446     .  0 0 "[    .    1    .    2]" 1 
        241 1 16 TYR QE   1 45 TRP H    . . 4.550 3.894 3.467 4.046     .  0 0 "[    .    1    .    2]" 1 
        242 1 16 TYR QE   1 45 TRP HA   . . 4.900 4.858 4.584 4.951 0.051 13 0 "[    .    1    .    2]" 1 
        243 1 16 TYR QE   1 45 TRP HB2  . . 3.730 2.624 2.392 2.734     .  0 0 "[    .    1    .    2]" 1 
        244 1 16 TYR QE   1 45 TRP HB3  . . 3.680 2.454 2.138 2.595     .  0 0 "[    .    1    .    2]" 1 
        245 1 16 TYR QE   1 45 TRP HD1  . . 4.420 4.024 3.951 4.109     .  0 0 "[    .    1    .    2]" 1 
        246 1 16 TYR QE   1 45 TRP HE1  . . 5.500 5.522 5.486 5.575 0.075 17 0 "[    .    1    .    2]" 1 
        247 1 16 TYR QE   1 46 GLN H    . . 5.380 5.253 4.870 5.390 0.010 14 0 "[    .    1    .    2]" 1 
        248 1 17 GLN H    1 17 GLN HB2  . . 3.970 2.410 2.230 2.633     .  0 0 "[    .    1    .    2]" 1 
        249 1 17 GLN H    1 17 GLN HB3  . . 3.590 3.542 3.495 3.563     .  0 0 "[    .    1    .    2]" 1 
        250 1 17 GLN H    1 17 GLN HE21 . . 4.790 3.860 3.543 4.074     .  0 0 "[    .    1    .    2]" 1 
        251 1 17 GLN H    1 17 GLN HG2  . . 4.360 3.274 2.825 3.575     .  0 0 "[    .    1    .    2]" 1 
        252 1 17 GLN H    1 17 GLN HG3  . . 4.010 2.297 1.932 2.675     .  0 0 "[    .    1    .    2]" 1 
        253 1 17 GLN H    1 18 LYS H    . . 4.010 2.736 2.498 2.924     .  0 0 "[    .    1    .    2]" 1 
        254 1 17 GLN H    1 19 PHE H    . . 5.210 4.748 4.593 4.916     .  0 0 "[    .    1    .    2]" 1 
        255 1 17 GLN HA   1 17 GLN HG2  . . 3.700 2.324 2.176 2.547     .  0 0 "[    .    1    .    2]" 1 
        256 1 17 GLN HA   1 20 SER H    . . 4.450 3.575 3.346 3.792     .  0 0 "[    .    1    .    2]" 1 
        257 1 17 GLN HA   1 20 SER QB   . . 3.320 2.530 2.324 2.967     .  0 0 "[    .    1    .    2]" 1 
        258 1 17 GLN HA   1 21 GLN H    . . 4.850 3.860 3.641 4.215     .  0 0 "[    .    1    .    2]" 1 
        259 1 17 GLN HB2  1 17 GLN HE21 . . 4.560 1.971 1.916 2.316     .  0 0 "[    .    1    .    2]" 1 
        260 1 17 GLN HB2  1 18 LYS H    . . 4.360 3.032 2.912 3.121     .  0 0 "[    .    1    .    2]" 1 
        261 1 17 GLN HB3  1 17 GLN HE21 . . 4.320 2.674 2.331 3.410     .  0 0 "[    .    1    .    2]" 1 
        262 1 17 GLN HB3  1 17 GLN HE22 . . 5.090 3.666 3.468 4.098     .  0 0 "[    .    1    .    2]" 1 
        263 1 17 GLN HB3  1 18 LYS H    . . 3.950 3.876 3.515 4.143 0.193 13 0 "[    .    1    .    2]" 1 
        264 1 17 GLN HB3  1 21 GLN H    . . 5.500 4.810 4.546 5.140     .  0 0 "[    .    1    .    2]" 1 
        265 1 17 GLN HE21 1 18 LYS H    . . 4.830 4.863 4.839 4.905 0.075 18 0 "[    .    1    .    2]" 1 
        266 1 17 GLN HG3  1 18 LYS H    . . 5.190 4.593 4.225 4.819     .  0 0 "[    .    1    .    2]" 1 
        267 1 18 LYS H    1 18 LYS HB2  . . 3.790 2.698 2.561 2.923     .  0 0 "[    .    1    .    2]" 1 
        268 1 18 LYS H    1 18 LYS HB3  . . 3.850 2.284 2.125 2.391     .  0 0 "[    .    1    .    2]" 1 
        269 1 18 LYS H    1 18 LYS HG2  . . 4.790 4.499 4.418 4.584     .  0 0 "[    .    1    .    2]" 1 
        270 1 18 LYS H    1 19 PHE H    . . 3.890 2.772 2.726 2.855     .  0 0 "[    .    1    .    2]" 1 
        271 1 18 LYS H    1 19 PHE HA   . . 5.210 5.267 5.238 5.317 0.107 20 0 "[    .    1    .    2]" 1 
        272 1 18 LYS H    1 19 PHE HB3  . . 5.040 4.392 4.291 4.503     .  0 0 "[    .    1    .    2]" 1 
        273 1 18 LYS H    1 20 SER H    . . 4.910 3.928 3.849 4.028     .  0 0 "[    .    1    .    2]" 1 
        274 1 18 LYS H    1 56 TYR QD   . . 5.500 5.411 5.188 5.515 0.015  6 0 "[    .    1    .    2]" 1 
        275 1 18 LYS H    1 60 ALA MB   . . 4.690 4.109 3.651 4.516     .  0 0 "[    .    1    .    2]" 1 
        276 1 18 LYS HA   1 18 LYS QE   . . 4.690 4.075 3.639 4.492     .  0 0 "[    .    1    .    2]" 1 
        277 1 18 LYS HA   1 18 LYS HG2  . . 3.970 3.809 3.688 3.914     .  0 0 "[    .    1    .    2]" 1 
        278 1 18 LYS HA   1 19 PHE HA   . . 4.950 4.789 4.723 4.828     .  0 0 "[    .    1    .    2]" 1 
        279 1 18 LYS HA   1 20 SER H    . . 5.500 4.522 4.382 4.822     .  0 0 "[    .    1    .    2]" 1 
        280 1 18 LYS HA   1 21 GLN H    . . 4.060 3.751 3.490 4.090 0.030 19 0 "[    .    1    .    2]" 1 
        281 1 18 LYS HB2  1 19 PHE H    . . 4.320 3.864 3.795 3.956     .  0 0 "[    .    1    .    2]" 1 
        282 1 18 LYS HB2  1 60 ALA HA   . . 4.250 3.748 3.122 4.196     .  0 0 "[    .    1    .    2]" 1 
        283 1 18 LYS HB2  1 60 ALA MB   . . 3.660 2.631 1.965 3.214     .  0 0 "[    .    1    .    2]" 1 
        284 1 18 LYS HB3  1 19 PHE H    . . 4.050 2.444 2.328 2.605     .  0 0 "[    .    1    .    2]" 1 
        285 1 18 LYS HB3  1 19 PHE HA   . . 4.770 4.502 4.373 4.738     .  0 0 "[    .    1    .    2]" 1 
        286 1 18 LYS HB3  1 20 SER H    . . 4.870 4.902 4.877 4.964 0.094 19 0 "[    .    1    .    2]" 1 
        287 1 18 LYS HB3  1 56 TYR QD   . . 4.480 3.568 3.199 3.894     .  0 0 "[    .    1    .    2]" 1 
        288 1 18 LYS HB3  1 60 ALA H    . . 5.500 4.435 3.725 4.919     .  0 0 "[    .    1    .    2]" 1 
        289 1 18 LYS HB3  1 60 ALA MB   . . 4.150 3.429 2.805 3.962     .  0 0 "[    .    1    .    2]" 1 
        290 1 18 LYS HD2  1 56 TYR QD   . . 4.480 4.517 3.460 5.224 0.744 11 8 "[  * .*** *+   .- * 2]" 1 
        291 1 18 LYS QE   1 56 TYR QD   . . 4.770 3.388 2.933 3.752     .  0 0 "[    .    1    .    2]" 1 
        292 1 18 LYS QE   1 56 TYR QE   . . 4.700 4.447 3.917 4.562     .  0 0 "[    .    1    .    2]" 1 
        293 1 18 LYS QE   1 59 LEU QD   . . 4.690 2.812 2.355 3.654     .  0 0 "[    .    1    .    2]" 1 
        294 1 18 LYS QE   1 60 ALA H    . . 5.420 4.231 3.387 4.724     .  0 0 "[    .    1    .    2]" 1 
        295 1 18 LYS QE   1 60 ALA HA   . . 5.190 4.158 3.431 4.853     .  0 0 "[    .    1    .    2]" 1 
        296 1 18 LYS QE   1 60 ALA MB   . . 5.190 4.511 4.026 4.906     .  0 0 "[    .    1    .    2]" 1 
        297 1 18 LYS HG2  1 19 PHE H    . . 4.850 3.846 3.503 4.337     .  0 0 "[    .    1    .    2]" 1 
        298 1 18 LYS HG2  1 56 TYR QD   . . 4.190 2.211 2.060 2.439     .  0 0 "[    .    1    .    2]" 1 
        299 1 18 LYS HG2  1 56 TYR QE   . . 4.270 4.269 3.815 4.326 0.056  7 0 "[    .    1    .    2]" 1 
        300 1 18 LYS HG2  1 59 LEU QD   . . 4.560 3.297 2.788 3.739     .  0 0 "[    .    1    .    2]" 1 
        301 1 18 LYS HG2  1 60 ALA H    . . 5.040 3.869 3.290 4.354     .  0 0 "[    .    1    .    2]" 1 
        302 1 18 LYS HG2  1 60 ALA MB   . . 4.360 4.012 3.579 4.377 0.017 14 0 "[    .    1    .    2]" 1 
        303 1 18 LYS HG3  1 19 PHE H    . . 4.850 3.211 2.319 3.777     .  0 0 "[    .    1    .    2]" 1 
        304 1 18 LYS HG3  1 56 TYR QD   . . 4.080 2.627 1.993 3.469     .  0 0 "[    .    1    .    2]" 1 
        305 1 18 LYS HG3  1 56 TYR QE   . . 4.320 3.847 3.111 4.330 0.010 18 0 "[    .    1    .    2]" 1 
        306 1 19 PHE H    1 19 PHE HB2  . . 3.770 2.612 2.496 2.726     .  0 0 "[    .    1    .    2]" 1 
        307 1 19 PHE H    1 19 PHE HB3  . . 3.760 2.123 2.031 2.254     .  0 0 "[    .    1    .    2]" 1 
        308 1 19 PHE H    1 19 PHE QD   . . 4.590 3.990 3.881 4.073     .  0 0 "[    .    1    .    2]" 1 
        309 1 19 PHE H    1 20 SER H    . . 3.950 2.824 2.683 2.944     .  0 0 "[    .    1    .    2]" 1 
        310 1 19 PHE H    1 20 SER QB   . . 5.040 4.820 4.659 4.877     .  0 0 "[    .    1    .    2]" 1 
        311 1 19 PHE H    1 21 GLN H    . . 5.420 4.616 4.351 4.779     .  0 0 "[    .    1    .    2]" 1 
        312 1 19 PHE H    1 56 TYR HB3  . . 4.990 3.106 2.742 3.332     .  0 0 "[    .    1    .    2]" 1 
        313 1 19 PHE H    1 56 TYR QD   . . 4.990 3.709 3.535 3.868     .  0 0 "[    .    1    .    2]" 1 
        314 1 19 PHE H    1 56 TYR QE   . . 5.500 4.620 4.381 4.772     .  0 0 "[    .    1    .    2]" 1 
        315 1 19 PHE HA   1 19 PHE QD   . . 3.970 2.772 2.618 2.988     .  0 0 "[    .    1    .    2]" 1 
        316 1 19 PHE HA   1 22 GLU H    . . 4.560 3.446 3.228 3.592     .  0 0 "[    .    1    .    2]" 1 
        317 1 19 PHE HA   1 22 GLU HB2  . . 4.150 2.667 2.568 2.833     .  0 0 "[    .    1    .    2]" 1 
        318 1 19 PHE HA   1 22 GLU HB3  . . 4.360 3.569 3.387 3.735     .  0 0 "[    .    1    .    2]" 1 
        319 1 19 PHE HA   1 56 TYR QD   . . 4.770 3.620 3.183 3.935     .  0 0 "[    .    1    .    2]" 1 
        320 1 19 PHE HA   1 56 TYR QE   . . 3.920 3.079 2.686 3.524     .  0 0 "[    .    1    .    2]" 1 
        321 1 19 PHE HB2  1 20 SER H    . . 4.240 3.983 3.935 4.038     .  0 0 "[    .    1    .    2]" 1 
        322 1 19 PHE HB2  1 45 TRP HE3  . . 5.190 2.993 2.636 3.540     .  0 0 "[    .    1    .    2]" 1 
        323 1 19 PHE HB2  1 45 TRP HZ3  . . 4.550 2.420 2.097 3.081     .  0 0 "[    .    1    .    2]" 1 
        324 1 19 PHE HB2  1 56 TYR QD   . . 4.800 2.868 2.565 3.171     .  0 0 "[    .    1    .    2]" 1 
        325 1 19 PHE HB2  1 56 TYR QE   . . 4.480 2.962 2.700 3.372     .  0 0 "[    .    1    .    2]" 1 
        326 1 19 PHE HB3  1 20 SER H    . . 3.890 2.610 2.537 2.713     .  0 0 "[    .    1    .    2]" 1 
        327 1 19 PHE HB3  1 45 TRP HE3  . . 5.190 2.411 2.135 2.652     .  0 0 "[    .    1    .    2]" 1 
        328 1 19 PHE HB3  1 45 TRP HZ3  . . 4.900 2.563 2.352 2.790     .  0 0 "[    .    1    .    2]" 1 
        329 1 19 PHE QD   1 20 SER H    . . 4.260 3.092 2.655 3.353     .  0 0 "[    .    1    .    2]" 1 
        330 1 19 PHE QD   1 20 SER QB   . . 5.190 4.402 3.527 4.658     .  0 0 "[    .    1    .    2]" 1 
        331 1 19 PHE QD   1 22 GLU HB2  . . 5.500 4.131 3.399 4.570     .  0 0 "[    .    1    .    2]" 1 
        332 1 19 PHE QD   1 23 LEU MD1  . . 4.510 3.062 2.934 3.287     .  0 0 "[    .    1    .    2]" 1 
        333 1 19 PHE QD   1 23 LEU MD2  . . 4.850 4.703 4.511 4.898 0.048 19 0 "[    .    1    .    2]" 1 
        334 1 19 PHE QD   1 41 ILE MG   . . 4.190 3.019 2.732 3.494     .  0 0 "[    .    1    .    2]" 1 
        335 1 19 PHE QD   1 44 ARG HB3  . . 5.190 5.203 4.757 5.312 0.122  7 0 "[    .    1    .    2]" 1 
        336 1 19 PHE QD   1 45 TRP H    . . 4.950 4.354 3.994 4.660     .  0 0 "[    .    1    .    2]" 1 
        337 1 19 PHE QD   1 45 TRP HA   . . 5.060 3.591 3.245 3.911     .  0 0 "[    .    1    .    2]" 1 
        338 1 19 PHE QD   1 45 TRP HB2  . . 4.320 2.225 2.052 2.435     .  0 0 "[    .    1    .    2]" 1 
        339 1 19 PHE QD   1 45 TRP HB3  . . 5.190 3.901 3.723 4.084     .  0 0 "[    .    1    .    2]" 1 
        340 1 19 PHE QD   1 45 TRP HE3  . . 4.900 2.139 1.986 2.394     .  0 0 "[    .    1    .    2]" 1 
        341 1 19 PHE QD   1 45 TRP HZ3  . . 4.900 3.855 3.807 3.995     .  0 0 "[    .    1    .    2]" 1 
        342 1 19 PHE QD   1 48 ILE MD   . . 4.560 3.389 3.249 3.532     .  0 0 "[    .    1    .    2]" 1 
        343 1 19 PHE QD   1 56 TYR QD   . . 5.380 4.156 4.025 4.300     .  0 0 "[    .    1    .    2]" 1 
        344 1 19 PHE QD   1 56 TYR QE   . . 4.080 2.805 2.462 3.067     .  0 0 "[    .    1    .    2]" 1 
        345 1 19 PHE QE   1 23 LEU MD1  . . 3.930 2.386 2.313 2.480     .  0 0 "[    .    1    .    2]" 1 
        346 1 19 PHE QE   1 23 LEU MD2  . . 4.060 3.251 3.042 3.388     .  0 0 "[    .    1    .    2]" 1 
        347 1 19 PHE QE   1 41 ILE HA   . . 4.560 3.635 3.215 4.307     .  0 0 "[    .    1    .    2]" 1 
        348 1 19 PHE QE   1 41 ILE MG   . . 3.470 2.226 1.963 2.709     .  0 0 "[    .    1    .    2]" 1 
        349 1 19 PHE QE   1 44 ARG H    . . 5.040 4.249 4.020 4.411     .  0 0 "[    .    1    .    2]" 1 
        350 1 19 PHE QE   1 44 ARG HA   . . 5.380 4.753 4.475 5.020     .  0 0 "[    .    1    .    2]" 1 
        351 1 19 PHE QE   1 44 ARG HB2  . . 4.230 2.541 2.270 2.959     .  0 0 "[    .    1    .    2]" 1 
        352 1 19 PHE QE   1 44 ARG HB3  . . 4.370 3.174 2.544 3.343     .  0 0 "[    .    1    .    2]" 1 
        353 1 19 PHE QE   1 45 TRP H    . . 4.180 2.561 2.400 2.676     .  0 0 "[    .    1    .    2]" 1 
        354 1 19 PHE QE   1 45 TRP HA   . . 4.620 3.023 2.787 3.278     .  0 0 "[    .    1    .    2]" 1 
        355 1 19 PHE QE   1 45 TRP HB2  . . 4.450 2.336 1.991 2.641     .  0 0 "[    .    1    .    2]" 1 
        356 1 19 PHE QE   1 45 TRP HB3  . . 4.690 3.448 3.057 3.712     .  0 0 "[    .    1    .    2]" 1 
        357 1 19 PHE QE   1 45 TRP HE3  . . 5.500 3.643 3.526 3.830     .  0 0 "[    .    1    .    2]" 1 
        358 1 19 PHE QE   1 46 GLN H    . . 4.910 4.887 4.784 4.927 0.017 13 0 "[    .    1    .    2]" 1 
        359 1 19 PHE QE   1 48 ILE MD   . . 3.990 3.728 3.636 3.842     .  0 0 "[    .    1    .    2]" 1 
        360 1 19 PHE QE   1 56 TYR QE   . . 4.420 4.143 3.948 4.405     .  0 0 "[    .    1    .    2]" 1 
        361 1 19 PHE HZ   1 23 LEU MD1  . . 4.050 2.072 1.925 2.338     .  0 0 "[    .    1    .    2]" 1 
        362 1 19 PHE HZ   1 23 LEU MD2  . . 4.180 2.957 2.704 3.402     .  0 0 "[    .    1    .    2]" 1 
        363 1 19 PHE HZ   1 41 ILE HA   . . 5.190 4.384 3.802 4.902     .  0 0 "[    .    1    .    2]" 1 
        364 1 19 PHE HZ   1 41 ILE MG   . . 3.910 3.874 3.537 4.024 0.114 19 0 "[    .    1    .    2]" 1 
        365 1 19 PHE HZ   1 44 ARG H    . . 5.210 4.717 4.280 5.122     .  0 0 "[    .    1    .    2]" 1 
        366 1 19 PHE HZ   1 44 ARG HA   . . 4.690 4.365 4.141 4.581     .  0 0 "[    .    1    .    2]" 1 
        367 1 19 PHE HZ   1 44 ARG HB2  . . 3.810 2.336 1.986 2.927     .  0 0 "[    .    1    .    2]" 1 
        368 1 19 PHE HZ   1 44 ARG HB3  . . 3.570 1.958 1.914 1.990     .  0 0 "[    .    1    .    2]" 1 
        369 1 19 PHE HZ   1 44 ARG HD2  . . 4.690 4.513 4.383 4.758 0.068 18 0 "[    .    1    .    2]" 1 
        370 1 19 PHE HZ   1 44 ARG HD3  . . 4.690 2.995 2.692 4.647     .  0 0 "[    .    1    .    2]" 1 
        371 1 19 PHE HZ   1 44 ARG QG   . . 4.800 3.758 2.988 3.960     .  0 0 "[    .    1    .    2]" 1 
        372 1 19 PHE HZ   1 45 TRP H    . . 4.620 3.998 3.353 4.361     .  0 0 "[    .    1    .    2]" 1 
        373 1 19 PHE HZ   1 45 TRP HA   . . 4.620 4.048 3.493 4.560     .  0 0 "[    .    1    .    2]" 1 
        374 1 19 PHE HZ   1 45 TRP HB2  . . 5.190 4.518 3.932 5.019     .  0 0 "[    .    1    .    2]" 1 
        375 1 19 PHE HZ   1 48 ILE MD   . . 4.480 4.432 4.232 4.497 0.017  3 0 "[    .    1    .    2]" 1 
        376 1 20 SER H    1 20 SER QB   . . 3.850 2.458 2.175 2.610     .  0 0 "[    .    1    .    2]" 1 
        377 1 20 SER H    1 21 GLN H    . . 3.920 2.936 2.781 3.075     .  0 0 "[    .    1    .    2]" 1 
        378 1 20 SER H    1 21 GLN QB   . . 4.830 4.499 4.397 4.605     .  0 0 "[    .    1    .    2]" 1 
        379 1 20 SER H    1 41 ILE MG   . . 4.830 3.763 3.678 3.831     .  0 0 "[    .    1    .    2]" 1 
        380 1 20 SER HA   1 23 LEU H    . . 4.670 3.211 3.141 3.352     .  0 0 "[    .    1    .    2]" 1 
        381 1 20 SER HA   1 23 LEU HB2  . . 4.320 2.988 2.853 3.194     .  0 0 "[    .    1    .    2]" 1 
        382 1 20 SER HA   1 23 LEU HB3  . . 4.950 4.666 4.547 4.855     .  0 0 "[    .    1    .    2]" 1 
        383 1 20 SER HA   1 23 LEU MD1  . . 4.560 2.403 2.259 2.561     .  0 0 "[    .    1    .    2]" 1 
        384 1 20 SER HA   1 23 LEU MD2  . . 4.950 4.879 4.777 5.010 0.060 19 0 "[    .    1    .    2]" 1 
        385 1 20 SER HA   1 23 LEU HG   . . 4.510 4.106 4.006 4.213     .  0 0 "[    .    1    .    2]" 1 
        386 1 20 SER HA   1 24 LEU H    . . 4.990 4.473 4.222 4.936     .  0 0 "[    .    1    .    2]" 1 
        387 1 20 SER HA   1 24 LEU MD2  . . 5.060 4.968 4.836 5.069 0.009 11 0 "[    .    1    .    2]" 1 
        388 1 20 SER HA   1 41 ILE HB   . . 4.950 4.664 4.578 4.745     .  0 0 "[    .    1    .    2]" 1 
        389 1 20 SER HA   1 41 ILE MD   . . 3.850 3.506 3.033 3.682     .  0 0 "[    .    1    .    2]" 1 
        390 1 20 SER HA   1 41 ILE MG   . . 3.260 1.953 1.934 1.986     .  0 0 "[    .    1    .    2]" 1 
        391 1 20 SER QB   1 21 GLN H    . . 4.060 2.311 2.128 3.128     .  0 0 "[    .    1    .    2]" 1 
        392 1 20 SER QB   1 21 GLN HA   . . 4.850 3.754 3.690 4.405     .  0 0 "[    .    1    .    2]" 1 
        393 1 20 SER QB   1 21 GLN QB   . . 5.060 4.014 3.873 4.594     .  0 0 "[    .    1    .    2]" 1 
        394 1 20 SER QB   1 24 LEU MD1  . . 4.950 3.517 3.298 3.749     .  0 0 "[    .    1    .    2]" 1 
        395 1 20 SER QB   1 24 LEU HG   . . 5.500 3.408 3.135 3.806     .  0 0 "[    .    1    .    2]" 1 
        396 1 20 SER QB   1 38 MET ME   . . 4.450 2.815 2.035 3.267     .  0 0 "[    .    1    .    2]" 1 
        397 1 20 SER QB   1 41 ILE MD   . . 4.320 2.813 2.579 2.974     .  0 0 "[    .    1    .    2]" 1 
        398 1 20 SER QB   1 41 ILE MG   . . 3.630 2.587 2.266 2.980     .  0 0 "[    .    1    .    2]" 1 
        399 1 21 GLN H    1 21 GLN QB   . . 3.060 2.092 2.022 2.155     .  0 0 "[    .    1    .    2]" 1 
        400 1 21 GLN H    1 21 GLN HG2  . . 3.950 3.666 2.954 4.317 0.367  3 0 "[    .    1    .    2]" 1 
        401 1 21 GLN H    1 21 GLN HG3  . . 4.340 3.329 2.921 4.270     .  0 0 "[    .    1    .    2]" 1 
        402 1 21 GLN H    1 22 GLU HA   . . 5.340 5.329 5.238 5.375 0.035  1 0 "[    .    1    .    2]" 1 
        403 1 21 GLN H    1 23 LEU H    . . 5.270 4.424 4.332 4.570     .  0 0 "[    .    1    .    2]" 1 
        404 1 21 GLN H    1 24 LEU MD1  . . 5.500 4.538 4.198 4.672     .  0 0 "[    .    1    .    2]" 1 
        405 1 21 GLN H    1 24 LEU HG   . . 5.150 4.542 4.370 4.714     .  0 0 "[    .    1    .    2]" 1 
        406 1 21 GLN H    1 41 ILE MD   . . 5.500 5.370 5.160 5.483     .  0 0 "[    .    1    .    2]" 1 
        407 1 21 GLN H    1 41 ILE MG   . . 5.060 4.889 4.755 5.033     .  0 0 "[    .    1    .    2]" 1 
        408 1 21 GLN HA   1 21 GLN HG2  . . 4.180 2.281 2.001 3.027     .  0 0 "[    .    1    .    2]" 1 
        409 1 21 GLN HA   1 21 GLN HG3  . . 3.800 2.949 2.012 3.557     .  0 0 "[    .    1    .    2]" 1 
        410 1 21 GLN HA   1 23 LEU H    . . 5.340 4.386 4.309 4.558     .  0 0 "[    .    1    .    2]" 1 
        411 1 21 GLN HA   1 24 LEU H    . . 4.060 3.185 3.111 3.374     .  0 0 "[    .    1    .    2]" 1 
        412 1 21 GLN HA   1 24 LEU HB2  . . 3.830 2.267 2.200 2.607     .  0 0 "[    .    1    .    2]" 1 
        413 1 21 GLN HA   1 24 LEU HB3  . . 4.690 3.865 3.795 4.134     .  0 0 "[    .    1    .    2]" 1 
        414 1 21 GLN HA   1 24 LEU MD1  . . 4.040 2.976 2.518 3.195     .  0 0 "[    .    1    .    2]" 1 
        415 1 21 GLN HA   1 24 LEU MD2  . . 4.850 4.487 4.309 4.596     .  0 0 "[    .    1    .    2]" 1 
        416 1 21 GLN HA   1 24 LEU HG   . . 3.910 3.049 2.728 3.241     .  0 0 "[    .    1    .    2]" 1 
        417 1 21 GLN HA   1 25 SER H    . . 4.830 4.237 4.102 4.704     .  0 0 "[    .    1    .    2]" 1 
        418 1 21 GLN QB   1 23 LEU H    . . 4.770 4.879 4.845 5.023 0.253 18 0 "[    .    1    .    2]" 1 
        419 1 21 GLN QB   1 24 LEU H    . . 4.990 4.616 4.549 4.767     .  0 0 "[    .    1    .    2]" 1 
        420 1 21 GLN QB   1 24 LEU MD1  . . 4.950 4.637 4.344 4.823     .  0 0 "[    .    1    .    2]" 1 
        421 1 21 GLN QB   1 25 SER H    . . 5.210 4.763 4.688 4.975     .  0 0 "[    .    1    .    2]" 1 
        422 1 21 GLN HG2  1 24 LEU MD1  . . 5.350 3.552 2.865 4.379     .  0 0 "[    .    1    .    2]" 1 
        423 1 22 GLU H    1 22 GLU HB2  . . 2.990 2.106 2.065 2.139     .  0 0 "[    .    1    .    2]" 1 
        424 1 22 GLU H    1 22 GLU HB3  . . 3.420 2.949 2.897 3.026     .  0 0 "[    .    1    .    2]" 1 
        425 1 22 GLU H    1 22 GLU HG3  . . 4.010 4.120 3.983 4.172 0.162 13 0 "[    .    1    .    2]" 1 
        426 1 22 GLU H    1 23 LEU H    . . 3.620 2.669 2.626 2.769     .  0 0 "[    .    1    .    2]" 1 
        427 1 22 GLU H    1 23 LEU HG   . . 4.640 4.748 4.724 4.869 0.229 18 0 "[    .    1    .    2]" 1 
        428 1 22 GLU HA   1 22 GLU HG2  . . 3.830 3.129 2.044 3.340     .  0 0 "[    .    1    .    2]" 1 
        429 1 22 GLU HA   1 22 GLU HG3  . . 3.150 2.196 2.038 3.045     .  0 0 "[    .    1    .    2]" 1 
        430 1 22 GLU HB2  1 23 LEU H    . . 3.930 3.504 3.427 3.584     .  0 0 "[    .    1    .    2]" 1 
        431 1 22 GLU HB3  1 23 LEU H    . . 3.670 2.732 2.518 2.793     .  0 0 "[    .    1    .    2]" 1 
        432 1 22 GLU HB3  1 23 LEU HB2  . . 4.850 4.773 4.700 4.820     .  0 0 "[    .    1    .    2]" 1 
        433 1 22 GLU HB3  1 23 LEU MD1  . . 3.990 4.041 4.009 4.116 0.126 18 0 "[    .    1    .    2]" 1 
        434 1 22 GLU HB3  1 23 LEU HG   . . 4.250 3.147 3.112 3.232     .  0 0 "[    .    1    .    2]" 1 
        435 1 22 GLU HB3  1 26 ASN HD21 . . 4.910 3.278 3.161 3.768     .  0 0 "[    .    1    .    2]" 1 
        436 1 22 GLU HB3  1 26 ASN HD22 . . 4.910 2.677 2.277 2.838     .  0 0 "[    .    1    .    2]" 1 
        437 1 22 GLU HB3  1 56 TYR QE   . . 4.850 4.640 4.159 4.876 0.026 13 0 "[    .    1    .    2]" 1 
        438 1 22 GLU HG2  1 23 LEU H    . . 5.340 4.741 4.475 4.800     .  0 0 "[    .    1    .    2]" 1 
        439 1 22 GLU HG2  1 26 ASN HD21 . . 5.350 3.690 3.533 4.338     .  0 0 "[    .    1    .    2]" 1 
        440 1 22 GLU HG2  1 26 ASN HD22 . . 5.350 2.163 1.949 3.114     .  0 0 "[    .    1    .    2]" 1 
        441 1 22 GLU HG2  1 56 TYR QE   . . 5.350 4.783 4.064 5.342     .  0 0 "[    .    1    .    2]" 1 
        442 1 22 GLU HG3  1 23 LEU H    . . 4.690 4.862 4.740 5.291 0.601  8 3 "[  * .  + 1 -  .    2]" 1 
        443 1 23 LEU H    1 23 LEU HB2  . . 3.310 2.344 2.319 2.373     .  0 0 "[    .    1    .    2]" 1 
        444 1 23 LEU H    1 23 LEU HB3  . . 3.900 3.530 3.520 3.535     .  0 0 "[    .    1    .    2]" 1 
        445 1 23 LEU H    1 23 LEU MD1  . . 4.090 3.065 2.999 3.144     .  0 0 "[    .    1    .    2]" 1 
        446 1 23 LEU H    1 23 LEU MD2  . . 4.150 3.936 3.865 3.974     .  0 0 "[    .    1    .    2]" 1 
        447 1 23 LEU H    1 23 LEU HG   . . 3.770 2.549 2.448 2.619     .  0 0 "[    .    1    .    2]" 1 
        448 1 23 LEU H    1 24 LEU H    . . 3.750 2.503 2.463 2.672     .  0 0 "[    .    1    .    2]" 1 
        449 1 23 LEU H    1 24 LEU HB2  . . 5.500 4.605 4.541 4.924     .  0 0 "[    .    1    .    2]" 1 
        450 1 23 LEU H    1 24 LEU HG   . . 5.090 4.328 4.173 4.465     .  0 0 "[    .    1    .    2]" 1 
        451 1 23 LEU H    1 25 SER H    . . 4.990 3.916 3.816 4.020     .  0 0 "[    .    1    .    2]" 1 
        452 1 23 LEU H    1 41 ILE MD   . . 4.760 4.632 4.505 4.760 0.000  7 0 "[    .    1    .    2]" 1 
        453 1 23 LEU H    1 41 ILE MG   . . 4.410 4.271 4.129 4.357     .  0 0 "[    .    1    .    2]" 1 
        454 1 23 LEU HA   1 23 LEU MD1  . . 4.150 3.859 3.852 3.868     .  0 0 "[    .    1    .    2]" 1 
        455 1 23 LEU HA   1 23 LEU MD2  . . 3.190 2.554 2.453 2.619     .  0 0 "[    .    1    .    2]" 1 
        456 1 23 LEU HA   1 23 LEU HG   . . 3.330 2.622 2.606 2.654     .  0 0 "[    .    1    .    2]" 1 
        457 1 23 LEU HA   1 25 SER H    . . 4.210 4.019 3.919 4.088     .  0 0 "[    .    1    .    2]" 1 
        458 1 23 LEU HA   1 26 ASN H    . . 3.880 3.058 2.976 3.249     .  0 0 "[    .    1    .    2]" 1 
        459 1 23 LEU HA   1 26 ASN HB2  . . 4.090 2.113 1.987 3.064     .  0 0 "[    .    1    .    2]" 1 
        460 1 23 LEU HA   1 26 ASN HB3  . . 4.450 3.703 3.584 4.567 0.117 18 0 "[    .    1    .    2]" 1 
        461 1 23 LEU HA   1 26 ASN HD21 . . 4.450 1.992 1.940 2.355     .  0 0 "[    .    1    .    2]" 1 
        462 1 23 LEU HA   1 26 ASN HD22 . . 4.620 3.506 2.975 3.590     .  0 0 "[    .    1    .    2]" 1 
        463 1 23 LEU HA   1 27 GLY H    . . 5.090 3.368 3.209 4.155     .  0 0 "[    .    1    .    2]" 1 
        464 1 23 LEU HA   1 28 GLU H    . . 5.150 3.583 3.234 3.661     .  0 0 "[    .    1    .    2]" 1 
        465 1 23 LEU HA   1 29 LEU MD1  . . 4.560 4.393 4.198 4.540     .  0 0 "[    .    1    .    2]" 1 
        466 1 23 LEU HB2  1 23 LEU MD1  . . 3.450 2.012 1.965 2.122     .  0 0 "[    .    1    .    2]" 1 
        467 1 23 LEU HB2  1 24 LEU H    . . 3.720 3.121 2.929 3.427     .  0 0 "[    .    1    .    2]" 1 
        468 1 23 LEU HB2  1 29 LEU MD1  . . 4.250 3.131 2.926 3.297     .  0 0 "[    .    1    .    2]" 1 
        469 1 23 LEU HB2  1 29 LEU HG   . . 4.770 4.589 4.419 4.713     .  0 0 "[    .    1    .    2]" 1 
        470 1 23 LEU HB2  1 41 ILE MD   . . 3.800 3.016 2.838 3.179     .  0 0 "[    .    1    .    2]" 1 
        471 1 23 LEU HB2  1 41 ILE HG12 . . 3.670 2.432 2.141 2.625     .  0 0 "[    .    1    .    2]" 1 
        472 1 23 LEU HB2  1 41 ILE HG13 . . 4.770 4.046 3.772 4.255     .  0 0 "[    .    1    .    2]" 1 
        473 1 23 LEU HB2  1 41 ILE MG   . . 4.040 3.036 2.978 3.079     .  0 0 "[    .    1    .    2]" 1 
        474 1 23 LEU HB3  1 23 LEU MD2  . . 3.580 2.128 2.085 2.211     .  0 0 "[    .    1    .    2]" 1 
        475 1 23 LEU HB3  1 24 LEU H    . . 4.350 3.995 3.848 4.187     .  0 0 "[    .    1    .    2]" 1 
        476 1 23 LEU HB3  1 24 LEU MD2  . . 3.950 3.782 3.449 3.891     .  0 0 "[    .    1    .    2]" 1 
        477 1 23 LEU HB3  1 29 LEU MD1  . . 3.950 2.181 1.972 2.370     .  0 0 "[    .    1    .    2]" 1 
        478 1 23 LEU HB3  1 29 LEU MD2  . . 4.280 3.779 3.430 3.914     .  0 0 "[    .    1    .    2]" 1 
        479 1 23 LEU HB3  1 41 ILE HA   . . 5.350 4.838 4.520 4.969     .  0 0 "[    .    1    .    2]" 1 
        480 1 23 LEU HB3  1 41 ILE MD   . . 3.950 3.616 3.303 3.801     .  0 0 "[    .    1    .    2]" 1 
        481 1 23 LEU HB3  1 41 ILE HG12 . . 4.850 2.845 2.646 2.931     .  0 0 "[    .    1    .    2]" 1 
        482 1 23 LEU HB3  1 41 ILE MG   . . 4.090 4.120 4.046 4.147 0.057  1 0 "[    .    1    .    2]" 1 
        483 1 23 LEU MD1  1 24 LEU H    . . 5.060 4.565 4.423 4.874     .  0 0 "[    .    1    .    2]" 1 
        484 1 23 LEU MD1  1 26 ASN HD21 . . 5.500 4.520 4.468 4.866     .  0 0 "[    .    1    .    2]" 1 
        485 1 23 LEU MD1  1 26 ASN HD22 . . 5.190 5.223 4.863 5.265 0.075  8 0 "[    .    1    .    2]" 1 
        486 1 23 LEU MD1  1 28 GLU QG   . . 5.500 4.761 4.621 4.865     .  0 0 "[    .    1    .    2]" 1 
        487 1 23 LEU MD1  1 29 LEU MD1  . . 4.120 2.886 2.719 3.032     .  0 0 "[    .    1    .    2]" 1 
        488 1 23 LEU MD1  1 29 LEU MD2  . . 4.120 4.004 3.752 4.155 0.035 18 0 "[    .    1    .    2]" 1 
        489 1 23 LEU MD1  1 29 LEU HG   . . 4.850 4.569 4.395 4.686     .  0 0 "[    .    1    .    2]" 1 
        490 1 23 LEU MD1  1 41 ILE H    . . 5.190 4.704 4.472 4.819     .  0 0 "[    .    1    .    2]" 1 
        491 1 23 LEU MD1  1 41 ILE HA   . . 4.090 2.787 2.489 2.928     .  0 0 "[    .    1    .    2]" 1 
        492 1 23 LEU MD1  1 41 ILE MD   . . 3.910 3.307 3.106 3.469     .  0 0 "[    .    1    .    2]" 1 
        493 1 23 LEU MD1  1 41 ILE HG12 . . 3.310 1.972 1.930 2.035     .  0 0 "[    .    1    .    2]" 1 
        494 1 23 LEU MD1  1 41 ILE HG13 . . 4.120 3.412 3.194 3.508     .  0 0 "[    .    1    .    2]" 1 
        495 1 23 LEU MD1  1 41 ILE MG   . . 3.380 1.879 1.830 1.936     .  0 0 "[    .    1    .    2]" 1 
        496 1 23 LEU MD1  1 44 ARG H    . . 5.500 4.541 4.120 4.698     .  0 0 "[    .    1    .    2]" 1 
        497 1 23 LEU MD1  1 44 ARG HB2  . . 4.320 2.619 2.324 2.749     .  0 0 "[    .    1    .    2]" 1 
        498 1 23 LEU MD1  1 44 ARG HB3  . . 3.970 3.183 2.633 3.341     .  0 0 "[    .    1    .    2]" 1 
        499 1 23 LEU MD1  1 44 ARG HD2  . . 4.180 3.855 3.204 4.136     .  0 0 "[    .    1    .    2]" 1 
        500 1 23 LEU MD1  1 44 ARG HD3  . . 3.970 2.717 2.452 3.127     .  0 0 "[    .    1    .    2]" 1 
        501 1 23 LEU MD1  1 44 ARG QG   . . 3.910 3.582 2.736 3.752     .  0 0 "[    .    1    .    2]" 1 
        502 1 23 LEU MD1  1 45 TRP H    . . 5.190 4.246 3.862 4.422     .  0 0 "[    .    1    .    2]" 1 
        503 1 23 LEU MD2  1 24 LEU H    . . 5.060 5.101 5.045 5.136 0.076  2 0 "[    .    1    .    2]" 1 
        504 1 23 LEU MD2  1 26 ASN H    . . 5.500 5.108 5.020 5.180     .  0 0 "[    .    1    .    2]" 1 
        505 1 23 LEU MD2  1 26 ASN HD21 . . 3.990 2.799 2.664 2.934     .  0 0 "[    .    1    .    2]" 1 
        506 1 23 LEU MD2  1 26 ASN HD22 . . 4.210 4.062 3.873 4.193     .  0 0 "[    .    1    .    2]" 1 
        507 1 23 LEU MD2  1 28 GLU H    . . 4.850 3.745 3.642 3.919     .  0 0 "[    .    1    .    2]" 1 
        508 1 23 LEU MD2  1 28 GLU HB2  . . 3.700 2.611 2.144 2.686     .  0 0 "[    .    1    .    2]" 1 
        509 1 23 LEU MD2  1 28 GLU HB3  . . 4.180 3.641 2.142 3.737     .  0 0 "[    .    1    .    2]" 1 
        510 1 23 LEU MD2  1 28 GLU QG   . . 3.950 2.225 2.156 2.328     .  0 0 "[    .    1    .    2]" 1 
        511 1 23 LEU MD2  1 29 LEU H    . . 5.190 4.304 4.076 4.503     .  0 0 "[    .    1    .    2]" 1 
        512 1 23 LEU MD2  1 29 LEU QB   . . 4.450 4.476 4.439 4.513 0.063 18 0 "[    .    1    .    2]" 1 
        513 1 23 LEU MD2  1 29 LEU MD1  . . 3.150 2.405 2.221 2.527     .  0 0 "[    .    1    .    2]" 1 
        514 1 23 LEU MD2  1 29 LEU MD2  . . 3.970 2.503 2.167 2.817     .  0 0 "[    .    1    .    2]" 1 
        515 1 23 LEU MD2  1 29 LEU HG   . . 4.280 2.863 2.778 2.969     .  0 0 "[    .    1    .    2]" 1 
        516 1 23 LEU MD2  1 41 ILE HA   . . 4.250 4.045 3.788 4.207     .  0 0 "[    .    1    .    2]" 1 
        517 1 23 LEU MD2  1 41 ILE HG12 . . 4.510 3.570 3.403 3.694     .  0 0 "[    .    1    .    2]" 1 
        518 1 23 LEU MD2  1 41 ILE HG13 . . 4.360 4.338 4.211 4.439 0.079 18 0 "[    .    1    .    2]" 1 
        519 1 23 LEU MD2  1 41 ILE MG   . . 4.250 4.062 3.952 4.218     .  0 0 "[    .    1    .    2]" 1 
        520 1 23 LEU MD2  1 44 ARG HD2  . . 4.120 3.054 2.666 3.977     .  0 0 "[    .    1    .    2]" 1 
        521 1 23 LEU MD2  1 44 ARG HD3  . . 3.970 2.133 1.932 2.931     .  0 0 "[    .    1    .    2]" 1 
        522 1 23 LEU MD2  1 44 ARG QG   . . 4.850 3.646 2.460 4.013     .  0 0 "[    .    1    .    2]" 1 
        523 1 23 LEU HG   1 24 LEU H    . . 4.950 4.656 4.609 4.721     .  0 0 "[    .    1    .    2]" 1 
        524 1 23 LEU HG   1 26 ASN HD21 . . 4.850 2.964 2.895 3.405     .  0 0 "[    .    1    .    2]" 1 
        525 1 23 LEU HG   1 41 ILE HG12 . . 5.400 4.443 4.304 4.503     .  0 0 "[    .    1    .    2]" 1 
        526 1 23 LEU HG   1 41 ILE MG   . . 5.060 4.284 4.130 4.415     .  0 0 "[    .    1    .    2]" 1 
        527 1 24 LEU H    1 24 LEU HB2  . . 3.660 2.322 2.272 2.460     .  0 0 "[    .    1    .    2]" 1 
        528 1 24 LEU H    1 24 LEU MD1  . . 4.120 3.974 3.788 4.134 0.014 19 0 "[    .    1    .    2]" 1 
        529 1 24 LEU H    1 24 LEU MD2  . . 3.920 3.202 3.076 3.371     .  0 0 "[    .    1    .    2]" 1 
        530 1 24 LEU H    1 24 LEU HG   . . 3.460 2.676 2.388 2.915     .  0 0 "[    .    1    .    2]" 1 
        531 1 24 LEU H    1 25 SER H    . . 3.610 2.350 2.138 2.464     .  0 0 "[    .    1    .    2]" 1 
        532 1 24 LEU H    1 26 ASN H    . . 4.870 3.611 3.427 3.723     .  0 0 "[    .    1    .    2]" 1 
        533 1 24 LEU H    1 41 ILE MD   . . 4.280 4.145 3.923 4.313 0.033 18 0 "[    .    1    .    2]" 1 
        534 1 24 LEU H    1 41 ILE MG   . . 5.500 5.130 4.908 5.348     .  0 0 "[    .    1    .    2]" 1 
        535 1 24 LEU HA   1 24 LEU MD1  . . 3.780 3.718 3.680 3.798 0.018  7 0 "[    .    1    .    2]" 1 
        536 1 24 LEU HA   1 24 LEU MD2  . . 3.150 1.929 1.880 2.059     .  0 0 "[    .    1    .    2]" 1 
        537 1 24 LEU HA   1 24 LEU HG   . . 3.820 3.240 3.181 3.314     .  0 0 "[    .    1    .    2]" 1 
        538 1 24 LEU HA   1 27 GLY H    . . 5.190 4.079 3.567 4.192     .  0 0 "[    .    1    .    2]" 1 
        539 1 24 LEU HA   1 27 GLY HA2  . . 4.510 4.505 3.850 4.552 0.042 15 0 "[    .    1    .    2]" 1 
        540 1 24 LEU HA   1 37 ARG QD   . . 5.060 3.684 3.260 3.972     .  0 0 "[    .    1    .    2]" 1 
        541 1 24 LEU HA   1 41 ILE MD   . . 4.450 4.156 3.905 4.316     .  0 0 "[    .    1    .    2]" 1 
        542 1 24 LEU HB2  1 25 SER H    . . 4.030 3.097 3.056 3.251     .  0 0 "[    .    1    .    2]" 1 
        543 1 24 LEU HB2  1 25 SER HA   . . 4.950 4.620 4.510 4.675     .  0 0 "[    .    1    .    2]" 1 
        544 1 24 LEU HB3  1 25 SER H    . . 4.490 3.955 3.904 4.183     .  0 0 "[    .    1    .    2]" 1 
        545 1 24 LEU MD1  1 25 SER H    . . 5.350 5.072 5.011 5.146     .  0 0 "[    .    1    .    2]" 1 
        546 1 24 LEU MD1  1 37 ARG QD   . . 4.620 4.167 3.391 4.321     .  0 0 "[    .    1    .    2]" 1 
        547 1 24 LEU MD1  1 38 MET ME   . . 3.620 2.517 1.923 3.259     .  0 0 "[    .    1    .    2]" 1 
        548 1 24 LEU MD2  1 25 SER H    . . 4.790 4.568 4.520 4.650     .  0 0 "[    .    1    .    2]" 1 
        549 1 24 LEU MD2  1 37 ARG H    . . 5.500 5.420 5.022 5.517 0.017  1 0 "[    .    1    .    2]" 1 
        550 1 24 LEU MD2  1 37 ARG QB   . . 3.970 2.547 2.139 2.686     .  0 0 "[    .    1    .    2]" 1 
        551 1 24 LEU MD2  1 37 ARG QD   . . 3.700 2.464 2.040 2.631     .  0 0 "[    .    1    .    2]" 1 
        552 1 24 LEU MD2  1 37 ARG HE   . . 5.060 4.906 4.432 5.078 0.018 14 0 "[    .    1    .    2]" 1 
        553 1 24 LEU MD2  1 38 MET HA   . . 4.950 4.093 3.849 4.547     .  0 0 "[    .    1    .    2]" 1 
        554 1 24 LEU MD2  1 38 MET QG   . . 5.060 3.780 3.410 4.458     .  0 0 "[    .    1    .    2]" 1 
        555 1 24 LEU HG   1 41 ILE MD   . . 3.300 2.730 2.570 2.944     .  0 0 "[    .    1    .    2]" 1 
        556 1 24 LEU HG   1 41 ILE HG12 . . 5.190 4.606 4.374 4.867     .  0 0 "[    .    1    .    2]" 1 
        557 1 25 SER H    1 25 SER QB   . . 3.260 2.240 2.154 2.316     .  0 0 "[    .    1    .    2]" 1 
        558 1 25 SER H    1 26 ASN H    . . 3.390 2.145 2.130 2.154     .  0 0 "[    .    1    .    2]" 1 
        559 1 25 SER H    1 26 ASN HA   . . 5.500 4.696 4.688 4.754     .  0 0 "[    .    1    .    2]" 1 
        560 1 25 SER H    1 26 ASN HB2  . . 5.060 4.227 4.156 4.825     .  0 0 "[    .    1    .    2]" 1 
        561 1 25 SER H    1 26 ASN HB3  . . 5.500 5.623 5.609 5.638 0.138 19 0 "[    .    1    .    2]" 1 
        562 1 25 SER H    1 27 GLY H    . . 5.210 4.267 3.424 4.349     .  0 0 "[    .    1    .    2]" 1 
        563 1 25 SER HA   1 26 ASN HA   . . 4.950 4.719 4.671 4.736     .  0 0 "[    .    1    .    2]" 1 
        564 1 25 SER HA   1 27 GLY H    . . 5.090 4.923 3.697 5.076     .  0 0 "[    .    1    .    2]" 1 
        565 1 25 SER QB   1 26 ASN H    . . 3.670 3.082 2.912 3.143     .  0 0 "[    .    1    .    2]" 1 
        566 1 26 ASN H    1 26 ASN HB2  . . 3.660 2.311 2.254 2.853     .  0 0 "[    .    1    .    2]" 1 
        567 1 26 ASN H    1 26 ASN HB3  . . 3.760 3.523 3.510 3.546     .  0 0 "[    .    1    .    2]" 1 
        568 1 26 ASN H    1 26 ASN HD21 . . 5.090 3.557 3.531 3.598     .  0 0 "[    .    1    .    2]" 1 
        569 1 26 ASN H    1 26 ASN HD22 . . 5.340 4.245 3.654 4.323     .  0 0 "[    .    1    .    2]" 1 
        570 1 26 ASN H    1 27 GLY H    . . 3.580 2.645 2.381 2.706     .  0 0 "[    .    1    .    2]" 1 
        571 1 26 ASN H    1 27 GLY HA2  . . 5.340 4.682 4.605 4.712     .  0 0 "[    .    1    .    2]" 1 
        572 1 26 ASN H    1 27 GLY HA3  . . 4.990 5.013 4.992 5.043 0.053  7 0 "[    .    1    .    2]" 1 
        573 1 26 ASN H    1 28 GLU H    . . 4.910 4.327 3.572 4.444     .  0 0 "[    .    1    .    2]" 1 
        574 1 26 ASN HA   1 26 ASN HD22 . . 5.500 4.620 4.573 5.035     .  0 0 "[    .    1    .    2]" 1 
        575 1 26 ASN HA   1 28 GLU H    . . 5.500 4.842 4.259 4.930     .  0 0 "[    .    1    .    2]" 1 
        576 1 26 ASN HB2  1 27 GLY H    . . 5.150 2.279 2.156 3.446     .  0 0 "[    .    1    .    2]" 1 
        577 1 26 ASN HB2  1 28 GLU H    . . 5.060 2.745 2.280 2.853     .  0 0 "[    .    1    .    2]" 1 
        578 1 26 ASN HB2  1 28 GLU QG   . . 4.690 2.275 2.186 3.033     .  0 0 "[    .    1    .    2]" 1 
        579 1 26 ASN HB2  1 29 LEU H    . . 5.500 4.964 4.865 5.083     .  0 0 "[    .    1    .    2]" 1 
        580 1 26 ASN HB3  1 27 GLY H    . . 5.040 3.135 3.009 4.463     .  0 0 "[    .    1    .    2]" 1 
        581 1 26 ASN HB3  1 28 GLU H    . . 5.060 3.112 2.951 3.840     .  0 0 "[    .    1    .    2]" 1 
        582 1 26 ASN HB3  1 28 GLU QG   . . 4.560 2.072 1.940 3.853     .  0 0 "[    .    1    .    2]" 1 
        583 1 26 ASN HD21 1 28 GLU HB3  . . 5.500 5.587 4.468 5.710 0.210 20 0 "[    .    1    .    2]" 1 
        584 1 26 ASN HD21 1 28 GLU QG   . . 4.850 2.827 2.633 3.206     .  0 0 "[    .    1    .    2]" 1 
        585 1 26 ASN HD22 1 28 GLU QG   . . 4.620 4.227 4.111 4.695 0.075 18 0 "[    .    1    .    2]" 1 
        586 1 27 GLY H    1 28 GLU H    . . 3.760 2.099 2.048 2.645     .  0 0 "[    .    1    .    2]" 1 
        587 1 27 GLY H    1 28 GLU HB2  . . 5.500 4.761 4.376 4.826     .  0 0 "[    .    1    .    2]" 1 
        588 1 27 GLY H    1 28 GLU QG   . . 5.500 3.143 2.983 5.576 0.076 18 0 "[    .    1    .    2]" 1 
        589 1 27 GLY H    1 29 LEU H    . . 5.210 3.693 3.588 4.251     .  0 0 "[    .    1    .    2]" 1 
        590 1 27 GLY H    1 30 ASN QD   . . 5.420 4.216 3.647 5.036     .  0 0 "[    .    1    .    2]" 1 
        591 1 27 GLY HA2  1 29 LEU H    . . 5.270 3.247 3.070 3.492     .  0 0 "[    .    1    .    2]" 1 
        592 1 27 GLY HA2  1 30 ASN H    . . 4.950 3.598 3.011 3.794     .  0 0 "[    .    1    .    2]" 1 
        593 1 27 GLY HA2  1 30 ASN QB   . . 4.280 2.924 1.975 3.521     .  0 0 "[    .    1    .    2]" 1 
        594 1 27 GLY HA2  1 30 ASN QD   . . 4.640 2.425 1.926 3.114     .  0 0 "[    .    1    .    2]" 1 
        595 1 27 GLY HA3  1 29 LEU H    . . 5.270 4.436 4.250 4.704     .  0 0 "[    .    1    .    2]" 1 
        596 1 27 GLY HA3  1 30 ASN H    . . 4.700 4.326 3.668 4.493     .  0 0 "[    .    1    .    2]" 1 
        597 1 27 GLY HA3  1 30 ASN QB   . . 4.770 3.206 2.404 3.641     .  0 0 "[    .    1    .    2]" 1 
        598 1 27 GLY HA3  1 30 ASN QD   . . 4.450 2.622 1.982 3.619     .  0 0 "[    .    1    .    2]" 1 
        599 1 28 GLU H    1 28 GLU HB2  . . 3.420 2.817 2.040 2.873     .  0 0 "[    .    1    .    2]" 1 
        600 1 28 GLU H    1 28 GLU HB3  . . 3.580 3.511 3.261 3.536     .  0 0 "[    .    1    .    2]" 1 
        601 1 28 GLU H    1 28 GLU QG   . . 3.630 1.942 1.851 3.339     .  0 0 "[    .    1    .    2]" 1 
        602 1 28 GLU H    1 29 LEU H    . . 3.740 2.499 2.430 2.913     .  0 0 "[    .    1    .    2]" 1 
        603 1 28 GLU H    1 29 LEU MD1  . . 5.190 4.743 4.606 5.272 0.082 18 0 "[    .    1    .    2]" 1 
        604 1 28 GLU H    1 29 LEU MD2  . . 4.850 4.193 4.008 4.942 0.092 18 0 "[    .    1    .    2]" 1 
        605 1 28 GLU H    1 29 LEU HG   . . 5.420 3.506 3.367 4.225     .  0 0 "[    .    1    .    2]" 1 
        606 1 28 GLU H    1 30 ASN H    . . 4.990 4.342 4.243 4.447     .  0 0 "[    .    1    .    2]" 1 
        607 1 28 GLU HA   1 28 GLU HB2  . . 2.760 2.999 2.840 3.016 0.256  5 0 "[    .    1    .    2]" 1 
        608 1 28 GLU HA   1 28 GLU QG   . . 2.800 2.668 2.595 2.692     .  0 0 "[    .    1    .    2]" 1 
        609 1 28 GLU HA   1 30 ASN H    . . 4.700 3.991 3.882 4.382     .  0 0 "[    .    1    .    2]" 1 
        610 1 28 GLU HB2  1 29 LEU H    . . 4.670 3.289 3.036 3.533     .  0 0 "[    .    1    .    2]" 1 
        611 1 28 GLU HB2  1 29 LEU MD2  . . 3.870 2.116 1.963 3.910 0.040 18 0 "[    .    1    .    2]" 1 
        612 1 28 GLU HB2  1 29 LEU HG   . . 4.620 2.759 2.596 3.378     .  0 0 "[    .    1    .    2]" 1 
        613 1 28 GLU HB3  1 29 LEU H    . . 4.700 4.309 3.055 4.500     .  0 0 "[    .    1    .    2]" 1 
        614 1 28 GLU HB3  1 29 LEU MD2  . . 3.500 3.177 2.325 3.349     .  0 0 "[    .    1    .    2]" 1 
        615 1 28 GLU HB3  1 29 LEU HG   . . 4.410 4.252 2.119 4.503 0.093 20 0 "[    .    1    .    2]" 1 
        616 1 28 GLU QG   1 29 LEU H    . . 4.560 3.739 3.551 4.682 0.122 18 0 "[    .    1    .    2]" 1 
        617 1 28 GLU QG   1 29 LEU MD1  . . 4.450 4.492 4.449 4.708 0.258 18 0 "[    .    1    .    2]" 1 
        618 1 28 GLU QG   1 29 LEU MD2  . . 3.850 3.713 3.504 3.864 0.014  4 0 "[    .    1    .    2]" 1 
        619 1 28 GLU QG   1 29 LEU HG   . . 4.180 3.755 3.695 4.172     .  0 0 "[    .    1    .    2]" 1 
        620 1 29 LEU H    1 29 LEU QB   . . 3.730 2.996 2.903 3.051     .  0 0 "[    .    1    .    2]" 1 
        621 1 29 LEU H    1 29 LEU MD1  . . 4.210 3.663 3.499 3.804     .  0 0 "[    .    1    .    2]" 1 
        622 1 29 LEU H    1 29 LEU MD2  . . 4.180 3.345 3.191 3.604     .  0 0 "[    .    1    .    2]" 1 
        623 1 29 LEU H    1 29 LEU HG   . . 3.950 2.176 1.979 2.387     .  0 0 "[    .    1    .    2]" 1 
        624 1 29 LEU H    1 30 ASN H    . . 3.470 2.665 2.549 2.858     .  0 0 "[    .    1    .    2]" 1 
        625 1 29 LEU H    1 30 ASN HA   . . 5.060 4.246 4.158 4.405     .  0 0 "[    .    1    .    2]" 1 
        626 1 29 LEU H    1 30 ASN QB   . . 5.350 4.012 3.755 4.342     .  0 0 "[    .    1    .    2]" 1 
        627 1 29 LEU H    1 31 HIS HE1  . . 5.190 4.864 4.665 5.169     .  0 0 "[    .    1    .    2]" 1 
        628 1 29 LEU H    1 37 ARG QD   . . 5.340 4.502 4.225 4.688     .  0 0 "[    .    1    .    2]" 1 
        629 1 29 LEU H    1 37 ARG QG   . . 5.500 4.379 3.797 5.165     .  0 0 "[    .    1    .    2]" 1 
        630 1 29 LEU HA   1 29 LEU MD1  . . 4.410 4.085 4.065 4.103     .  0 0 "[    .    1    .    2]" 1 
        631 1 29 LEU HA   1 29 LEU MD2  . . 3.200 2.628 2.535 2.883     .  0 0 "[    .    1    .    2]" 1 
        632 1 29 LEU HA   1 31 HIS HE1  . . 3.440 2.176 2.041 2.416     .  0 0 "[    .    1    .    2]" 1 
        633 1 29 LEU QB   1 29 LEU MD1  . . 3.000 2.001 1.961 2.097     .  0 0 "[    .    1    .    2]" 1 
        634 1 29 LEU QB   1 29 LEU MD2  . . 3.100 2.168 2.008 2.226     .  0 0 "[    .    1    .    2]" 1 
        635 1 29 LEU QB   1 30 ASN H    . . 4.700 3.994 3.980 4.004     .  0 0 "[    .    1    .    2]" 1 
        636 1 29 LEU QB   1 31 HIS HE1  . . 4.700 3.025 2.691 3.271     .  0 0 "[    .    1    .    2]" 1 
        637 1 29 LEU QB   1 37 ARG HA   . . 3.870 2.648 2.494 2.878     .  0 0 "[    .    1    .    2]" 1 
        638 1 29 LEU QB   1 37 ARG QD   . . 4.850 3.517 3.083 3.807     .  0 0 "[    .    1    .    2]" 1 
        639 1 29 LEU MD1  1 30 ASN H    . . 5.500 5.433 5.346 5.483     .  0 0 "[    .    1    .    2]" 1 
        640 1 29 LEU MD1  1 31 HIS HE1  . . 5.500 4.907 4.678 5.177     .  0 0 "[    .    1    .    2]" 1 
        641 1 29 LEU MD1  1 37 ARG HA   . . 4.280 2.698 2.448 3.038     .  0 0 "[    .    1    .    2]" 1 
        642 1 29 LEU MD1  1 37 ARG QD   . . 5.060 3.962 3.648 4.300     .  0 0 "[    .    1    .    2]" 1 
        643 1 29 LEU MD1  1 40 GLU HA   . . 4.850 4.496 4.342 4.696     .  0 0 "[    .    1    .    2]" 1 
        644 1 29 LEU MD1  1 40 GLU HB2  . . 3.580 3.538 3.334 3.625 0.045  5 0 "[    .    1    .    2]" 1 
        645 1 29 LEU MD1  1 40 GLU HB3  . . 3.890 2.107 1.961 2.262     .  0 0 "[    .    1    .    2]" 1 
        646 1 29 LEU MD1  1 40 GLU HG2  . . 4.180 3.636 3.271 4.152     .  0 0 "[    .    1    .    2]" 1 
        647 1 29 LEU MD1  1 40 GLU HG3  . . 4.680 3.478 3.053 3.978     .  0 0 "[    .    1    .    2]" 1 
        648 1 29 LEU MD1  1 41 ILE H    . . 3.510 3.118 2.835 3.348     .  0 0 "[    .    1    .    2]" 1 
        649 1 29 LEU MD1  1 41 ILE HA   . . 4.560 2.884 2.701 3.098     .  0 0 "[    .    1    .    2]" 1 
        650 1 29 LEU MD1  1 41 ILE HG13 . . 3.620 1.896 1.830 2.012     .  0 0 "[    .    1    .    2]" 1 
        651 1 29 LEU MD1  1 41 ILE MG   . . 4.280 3.626 3.471 3.771     .  0 0 "[    .    1    .    2]" 1 
        652 1 29 LEU MD1  1 44 ARG HD2  . . 5.060 3.535 3.169 3.849     .  0 0 "[    .    1    .    2]" 1 
        653 1 29 LEU MD1  1 44 ARG HD3  . . 4.510 3.777 2.575 4.062     .  0 0 "[    .    1    .    2]" 1 
        654 1 29 LEU MD2  1 30 ASN H    . . 5.190 4.708 4.646 4.913     .  0 0 "[    .    1    .    2]" 1 
        655 1 29 LEU MD2  1 31 HIS HE1  . . 3.560 2.623 2.411 2.949     .  0 0 "[    .    1    .    2]" 1 
        656 1 29 LEU MD2  1 37 ARG HA   . . 4.620 4.610 4.440 4.683 0.063  8 0 "[    .    1    .    2]" 1 
        657 1 29 LEU MD2  1 40 GLU HG2  . . 3.580 3.233 2.727 4.094 0.514  1 1 "[+   .    1    .    2]" 1 
        658 1 29 LEU MD2  1 40 GLU HG3  . . 4.180 3.120 2.574 3.544     .  0 0 "[    .    1    .    2]" 1 
        659 1 29 LEU MD2  1 41 ILE H    . . 5.150 4.924 4.470 5.172 0.022  5 0 "[    .    1    .    2]" 1 
        660 1 29 LEU MD2  1 41 ILE HA   . . 4.360 4.163 3.945 4.367 0.007  6 0 "[    .    1    .    2]" 1 
        661 1 29 LEU MD2  1 41 ILE HG13 . . 4.210 4.081 3.914 4.215 0.005 10 0 "[    .    1    .    2]" 1 
        662 1 29 LEU MD2  1 44 ARG HD2  . . 5.190 2.455 2.057 3.643     .  0 0 "[    .    1    .    2]" 1 
        663 1 29 LEU MD2  1 44 ARG HD3  . . 4.690 3.240 2.291 3.758     .  0 0 "[    .    1    .    2]" 1 
        664 1 29 LEU HG   1 30 ASN H    . . 5.340 4.584 4.521 4.654     .  0 0 "[    .    1    .    2]" 1 
        665 1 29 LEU HG   1 31 HIS HE1  . . 5.030 4.798 4.649 5.037 0.007 19 0 "[    .    1    .    2]" 1 
        666 1 29 LEU HG   1 41 ILE MD   . . 4.770 4.736 4.445 4.803 0.033  1 0 "[    .    1    .    2]" 1 
        667 1 30 ASN H    1 30 ASN QB   . . 3.410 2.184 2.048 2.642     .  0 0 "[    .    1    .    2]" 1 
        668 1 30 ASN H    1 30 ASN QD   . . 5.040 3.657 2.529 4.408     .  0 0 "[    .    1    .    2]" 1 
        669 1 30 ASN H    1 31 HIS HE1  . . 5.270 4.664 4.432 4.923     .  0 0 "[    .    1    .    2]" 1 
        670 1 30 ASN HA   1 32 LEU H    . . 4.410 3.630 3.370 3.823     .  0 0 "[    .    1    .    2]" 1 
        671 1 30 ASN HA   1 32 LEU MD1  . . 4.950 3.975 3.765 4.120     .  0 0 "[    .    1    .    2]" 1 
        672 1 30 ASN HA   1 37 ARG QD   . . 3.800 3.395 2.920 3.649     .  0 0 "[    .    1    .    2]" 1 
        673 1 30 ASN HA   1 37 ARG HE   . . 4.210 2.821 2.377 3.483     .  0 0 "[    .    1    .    2]" 1 
        674 1 30 ASN HA   1 37 ARG QG   . . 5.190 3.659 3.322 3.984     .  0 0 "[    .    1    .    2]" 1 
        675 1 30 ASN QB   1 31 HIS HA   . . 4.770 4.098 3.920 4.652     .  0 0 "[    .    1    .    2]" 1 
        676 1 31 HIS HB2  1 31 HIS HD2  . . 3.620 2.778 2.734 2.846     .  0 0 "[    .    1    .    2]" 1 
        677 1 31 HIS HB2  1 32 LEU H    . . 5.090 4.118 4.024 4.306     .  0 0 "[    .    1    .    2]" 1 
        678 1 31 HIS HB2  1 32 LEU HA   . . 5.060 4.755 4.663 4.882     .  0 0 "[    .    1    .    2]" 1 
        679 1 31 HIS HB3  1 32 LEU H    . . 5.210 4.292 4.173 4.422     .  0 0 "[    .    1    .    2]" 1 
        680 1 31 HIS HD2  1 32 LEU H    . . 5.500 4.115 3.905 4.516     .  0 0 "[    .    1    .    2]" 1 
        681 1 31 HIS HD2  1 32 LEU MD1  . . 4.850 4.379 4.138 4.680     .  0 0 "[    .    1    .    2]" 1 
        682 1 31 HIS HD2  1 32 LEU MD2  . . 3.410 2.708 2.509 3.150     .  0 0 "[    .    1    .    2]" 1 
        683 1 31 HIS HD2  1 32 LEU HG   . . 4.420 2.839 2.528 3.150     .  0 0 "[    .    1    .    2]" 1 
        684 1 31 HIS HE1  1 32 LEU MD1  . . 3.920 3.560 3.202 3.884     .  0 0 "[    .    1    .    2]" 1 
        685 1 31 HIS HE1  1 32 LEU MD2  . . 4.770 3.502 3.230 3.766     .  0 0 "[    .    1    .    2]" 1 
        686 1 31 HIS HE1  1 32 LEU HG   . . 4.620 3.771 3.454 4.019     .  0 0 "[    .    1    .    2]" 1 
        687 1 32 LEU H    1 32 LEU QB   . . 3.570 3.096 3.044 3.192     .  0 0 "[    .    1    .    2]" 1 
        688 1 32 LEU H    1 32 LEU MD1  . . 3.620 2.291 2.103 2.435     .  0 0 "[    .    1    .    2]" 1 
        689 1 32 LEU H    1 32 LEU MD2  . . 4.040 3.713 3.636 3.858     .  0 0 "[    .    1    .    2]" 1 
        690 1 32 LEU H    1 32 LEU HG   . . 4.620 2.040 1.935 2.211     .  0 0 "[    .    1    .    2]" 1 
        691 1 32 LEU H    1 33 PRO HD2  . . 5.500 4.857 4.807 4.918     .  0 0 "[    .    1    .    2]" 1 
        692 1 32 LEU H    1 33 PRO HD3  . . 5.150 4.810 4.780 4.823     .  0 0 "[    .    1    .    2]" 1 
        693 1 32 LEU H    1 36 GLU HB3  . . 5.160 5.334 5.151 5.456 0.296  8 0 "[    .    1    .    2]" 1 
        694 1 32 LEU H    1 37 ARG HE   . . 4.470 3.716 3.329 4.430     .  0 0 "[    .    1    .    2]" 1 
        695 1 32 LEU H    1 37 ARG QG   . . 5.040 3.703 3.526 3.862     .  0 0 "[    .    1    .    2]" 1 
        696 1 32 LEU HA   1 32 LEU MD1  . . 3.830 3.693 3.591 3.734     .  0 0 "[    .    1    .    2]" 1 
        697 1 32 LEU HA   1 33 PRO HD2  . . 3.250 2.951 2.848 3.012     .  0 0 "[    .    1    .    2]" 1 
        698 1 32 LEU HA   1 33 PRO HD3  . . 3.060 2.149 2.074 2.198     .  0 0 "[    .    1    .    2]" 1 
        699 1 32 LEU HA   1 33 PRO QG   . . 4.150 4.073 4.010 4.113     .  0 0 "[    .    1    .    2]" 1 
        700 1 32 LEU HA   1 36 GLU HB2  . . 5.060 4.323 4.130 4.409     .  0 0 "[    .    1    .    2]" 1 
        701 1 32 LEU QB   1 32 LEU MD1  . . 3.200 2.201 2.106 2.319     .  0 0 "[    .    1    .    2]" 1 
        702 1 32 LEU QB   1 33 PRO HD2  . . 3.890 1.905 1.868 1.955     .  0 0 "[    .    1    .    2]" 1 
        703 1 32 LEU QB   1 33 PRO HD3  . . 4.210 2.699 2.606 2.831     .  0 0 "[    .    1    .    2]" 1 
        704 1 32 LEU QB   1 36 GLU HB2  . . 4.040 1.949 1.894 1.994     .  0 0 "[    .    1    .    2]" 1 
        705 1 32 LEU QB   1 36 GLU HB3  . . 3.910 2.290 2.125 2.408     .  0 0 "[    .    1    .    2]" 1 
        706 1 32 LEU QB   1 36 GLU HG3  . . 4.850 3.272 2.817 3.536     .  0 0 "[    .    1    .    2]" 1 
        707 1 32 LEU QB   1 37 ARG H    . . 4.560 3.615 3.355 3.961     .  0 0 "[    .    1    .    2]" 1 
        708 1 32 LEU QB   1 37 ARG HA   . . 4.620 4.496 4.417 4.578     .  0 0 "[    .    1    .    2]" 1 
        709 1 32 LEU QB   1 37 ARG HE   . . 5.190 4.681 4.324 4.956     .  0 0 "[    .    1    .    2]" 1 
        710 1 32 LEU QB   1 37 ARG QG   . . 4.450 3.878 3.593 4.111     .  0 0 "[    .    1    .    2]" 1 
        711 1 32 LEU MD1  1 33 PRO HD2  . . 3.700 3.764 3.652 3.795 0.095 14 0 "[    .    1    .    2]" 1 
        712 1 32 LEU MD1  1 33 PRO HD3  . . 4.850 4.563 4.411 4.606     .  0 0 "[    .    1    .    2]" 1 
        713 1 32 LEU MD1  1 36 GLU H    . . 4.950 4.316 3.882 4.574     .  0 0 "[    .    1    .    2]" 1 
        714 1 32 LEU MD1  1 36 GLU HA   . . 4.850 4.429 4.200 4.666     .  0 0 "[    .    1    .    2]" 1 
        715 1 32 LEU MD1  1 36 GLU HB2  . . 3.740 3.021 2.766 3.145     .  0 0 "[    .    1    .    2]" 1 
        716 1 32 LEU MD1  1 36 GLU HB3  . . 3.540 2.571 2.313 2.807     .  0 0 "[    .    1    .    2]" 1 
        717 1 32 LEU MD1  1 36 GLU HG3  . . 4.850 4.742 4.425 4.874 0.024 18 0 "[    .    1    .    2]" 1 
        718 1 32 LEU MD1  1 37 ARG H    . . 4.350 2.769 2.422 3.112     .  0 0 "[    .    1    .    2]" 1 
        719 1 32 LEU MD1  1 37 ARG HA   . . 3.340 2.263 1.943 2.524     .  0 0 "[    .    1    .    2]" 1 
        720 1 32 LEU MD1  1 37 ARG HE   . . 5.500 3.154 2.739 3.722     .  0 0 "[    .    1    .    2]" 1 
        721 1 32 LEU MD1  1 37 ARG QG   . . 3.610 1.984 1.761 2.325     .  0 0 "[    .    1    .    2]" 1 
        722 1 32 LEU MD1  1 40 GLU H    . . 5.190 4.327 3.656 4.605     .  0 0 "[    .    1    .    2]" 1 
        723 1 32 LEU MD1  1 40 GLU HG2  . . 3.970 3.242 2.589 4.805 0.835  1 1 "[+   .    1    .    2]" 1 
        724 1 32 LEU MD2  1 36 GLU HB2  . . 3.600 3.438 3.175 3.662 0.062  9 0 "[    .    1    .    2]" 1 
        725 1 32 LEU MD2  1 36 GLU HB3  . . 3.650 2.298 2.051 2.702     .  0 0 "[    .    1    .    2]" 1 
        726 1 32 LEU MD2  1 36 GLU HG2  . . 4.510 4.319 3.951 4.586 0.076  4 0 "[    .    1    .    2]" 1 
        727 1 32 LEU MD2  1 36 GLU HG3  . . 4.510 4.094 3.699 4.516 0.006 19 0 "[    .    1    .    2]" 1 
        728 1 32 LEU MD2  1 37 ARG H    . . 4.950 4.579 4.024 4.990 0.040 18 0 "[    .    1    .    2]" 1 
        729 1 32 LEU MD2  1 37 ARG HA   . . 4.690 4.097 3.491 4.362     .  0 0 "[    .    1    .    2]" 1 
        730 1 32 LEU MD2  1 40 GLU HG2  . . 3.700 2.617 2.175 4.306 0.606  1 1 "[+   .    1    .    2]" 1 
        731 1 32 LEU HG   1 36 GLU HB3  . . 4.950 4.366 4.216 4.558     .  0 0 "[    .    1    .    2]" 1 
        732 1 33 PRO HA   1 34 LEU H    . . 3.110 2.359 2.281 2.451     .  0 0 "[    .    1    .    2]" 1 
        733 1 33 PRO HA   1 34 LEU HA   . . 4.850 4.197 4.195 4.202     .  0 0 "[    .    1    .    2]" 1 
        734 1 33 PRO HA   1 34 LEU HB2  . . 4.850 4.519 4.436 4.604     .  0 0 "[    .    1    .    2]" 1 
        735 1 33 PRO HA   1 35 LYS H    . . 4.950 4.573 4.465 4.727     .  0 0 "[    .    1    .    2]" 1 
        736 1 33 PRO HB2  1 34 LEU H    . . 4.040 2.911 2.675 3.132     .  0 0 "[    .    1    .    2]" 1 
        737 1 33 PRO HB2  1 35 LYS H    . . 4.850 2.962 2.901 3.123     .  0 0 "[    .    1    .    2]" 1 
        738 1 33 PRO HB2  1 36 GLU H    . . 4.950 3.493 3.248 3.757     .  0 0 "[    .    1    .    2]" 1 
        739 1 33 PRO HB3  1 34 LEU H    . . 3.960 3.503 3.380 3.628     .  0 0 "[    .    1    .    2]" 1 
        740 1 33 PRO HD2  1 36 GLU H    . . 4.950 3.497 3.315 3.679     .  0 0 "[    .    1    .    2]" 1 
        741 1 33 PRO HD2  1 36 GLU HB2  . . 4.060 1.980 1.942 2.026     .  0 0 "[    .    1    .    2]" 1 
        742 1 33 PRO HD2  1 36 GLU HB3  . . 4.010 3.243 3.077 3.432     .  0 0 "[    .    1    .    2]" 1 
        743 1 33 PRO HD2  1 36 GLU HG2  . . 4.850 3.907 3.314 4.242     .  0 0 "[    .    1    .    2]" 1 
        744 1 33 PRO HD2  1 36 GLU HG3  . . 4.250 2.459 1.990 2.814     .  0 0 "[    .    1    .    2]" 1 
        745 1 33 PRO HD2  1 37 ARG H    . . 5.500 4.330 4.102 4.590     .  0 0 "[    .    1    .    2]" 1 
        746 1 33 PRO QG   1 35 LYS H    . . 4.420 4.214 4.072 4.391     .  0 0 "[    .    1    .    2]" 1 
        747 1 33 PRO QG   1 35 LYS HG2  . . 4.850 4.642 3.608 4.871 0.021 11 0 "[    .    1    .    2]" 1 
        748 1 33 PRO QG   1 36 GLU H    . . 4.410 3.086 2.873 3.340     .  0 0 "[    .    1    .    2]" 1 
        749 1 33 PRO QG   1 36 GLU HG3  . . 3.200 2.755 2.123 3.206 0.006  3 0 "[    .    1    .    2]" 1 
        750 1 34 LEU H    1 34 LEU HB2  . . 3.480 2.282 2.218 2.391     .  0 0 "[    .    1    .    2]" 1 
        751 1 34 LEU H    1 34 LEU HB3  . . 3.210 2.618 2.498 2.691     .  0 0 "[    .    1    .    2]" 1 
        752 1 34 LEU H    1 34 LEU QD   . . 4.120 3.543 3.478 3.618     .  0 0 "[    .    1    .    2]" 1 
        753 1 34 LEU H    1 35 LYS H    . . 4.170 3.044 2.917 3.110     .  0 0 "[    .    1    .    2]" 1 
        754 1 34 LEU H    1 36 GLU H    . . 5.420 4.434 3.956 4.990     .  0 0 "[    .    1    .    2]" 1 
        755 1 34 LEU H    1 37 ARG H    . . 4.950 4.489 4.235 4.718     .  0 0 "[    .    1    .    2]" 1 
        756 1 34 LEU H    1 37 ARG HE   . . 5.270 4.172 3.163 4.794     .  0 0 "[    .    1    .    2]" 1 
        757 1 34 LEU H    1 37 ARG QG   . . 5.420 4.361 3.295 5.236     .  0 0 "[    .    1    .    2]" 1 
        758 1 34 LEU HA   1 34 LEU QD   . . 3.120 2.113 1.981 2.462     .  0 0 "[    .    1    .    2]" 1 
        759 1 34 LEU HA   1 34 LEU HG   . . 3.970 3.619 2.632 3.796     .  0 0 "[    .    1    .    2]" 1 
        760 1 34 LEU HA   1 36 GLU H    . . 5.060 4.286 3.695 4.976     .  0 0 "[    .    1    .    2]" 1 
        761 1 34 LEU HA   1 37 ARG H    . . 4.360 3.083 2.659 3.457     .  0 0 "[    .    1    .    2]" 1 
        762 1 34 LEU HA   1 37 ARG QB   . . 3.450 1.958 1.925 2.039     .  0 0 "[    .    1    .    2]" 1 
        763 1 34 LEU HA   1 37 ARG QD   . . 4.280 2.521 2.225 2.828     .  0 0 "[    .    1    .    2]" 1 
        764 1 34 LEU HA   1 37 ARG HE   . . 5.060 3.667 2.693 4.274     .  0 0 "[    .    1    .    2]" 1 
        765 1 34 LEU HA   1 37 ARG QG   . . 4.090 2.938 1.987 3.718     .  0 0 "[    .    1    .    2]" 1 
        766 1 34 LEU HA   1 38 MET H    . . 4.850 3.621 3.213 3.861     .  0 0 "[    .    1    .    2]" 1 
        767 1 34 LEU HB2  1 34 LEU QD   . . 3.120 2.244 2.127 2.434     .  0 0 "[    .    1    .    2]" 1 
        768 1 34 LEU HB2  1 35 LYS H    . . 3.710 3.744 3.705 3.786 0.076  8 0 "[    .    1    .    2]" 1 
        769 1 34 LEU HB3  1 35 LYS H    . . 3.830 2.377 2.318 2.409     .  0 0 "[    .    1    .    2]" 1 
        770 1 34 LEU HB3  1 35 LYS HA   . . 4.450 4.151 4.091 4.270     .  0 0 "[    .    1    .    2]" 1 
        771 1 34 LEU QD   1 35 LYS H    . . 4.470 2.990 2.568 3.678     .  0 0 "[    .    1    .    2]" 1 
        772 1 34 LEU QD   1 35 LYS HA   . . 4.620 2.850 2.488 4.069     .  0 0 "[    .    1    .    2]" 1 
        773 1 34 LEU QD   1 37 ARG H    . . 4.950 3.919 3.575 4.443     .  0 0 "[    .    1    .    2]" 1 
        774 1 34 LEU QD   1 37 ARG QB   . . 3.750 2.455 1.966 2.782     .  0 0 "[    .    1    .    2]" 1 
        775 1 34 LEU QD   1 37 ARG QD   . . 3.930 2.363 1.962 2.663     .  0 0 "[    .    1    .    2]" 1 
        776 1 34 LEU QD   1 38 MET H    . . 4.560 2.631 2.269 3.780     .  0 0 "[    .    1    .    2]" 1 
        777 1 34 LEU QD   1 38 MET ME   . . 3.590 3.128 2.862 3.424     .  0 0 "[    .    1    .    2]" 1 
        778 1 34 LEU QD   1 38 MET QG   . . 3.770 1.894 1.691 2.589     .  0 0 "[    .    1    .    2]" 1 
        779 1 34 LEU HG   1 35 LYS H    . . 4.410 4.355 3.876 4.462 0.052  8 0 "[    .    1    .    2]" 1 
        780 1 34 LEU HG   1 38 MET H    . . 5.500 5.133 3.002 5.574 0.074 13 0 "[    .    1    .    2]" 1 
        781 1 34 LEU HG   1 38 MET QG   . . 4.360 3.738 1.954 4.184     .  0 0 "[    .    1    .    2]" 1 
        782 1 35 LYS H    1 35 LYS HB2  . . 3.400 2.487 2.383 2.795     .  0 0 "[    .    1    .    2]" 1 
        783 1 35 LYS H    1 35 LYS HB3  . . 3.320 2.486 2.226 2.579     .  0 0 "[    .    1    .    2]" 1 
        784 1 35 LYS H    1 35 LYS QD   . . 4.690 4.187 4.043 4.515     .  0 0 "[    .    1    .    2]" 1 
        785 1 35 LYS H    1 35 LYS HG2  . . 4.770 4.554 4.230 4.613     .  0 0 "[    .    1    .    2]" 1 
        786 1 35 LYS H    1 35 LYS HG3  . . 4.560 4.394 4.368 4.493     .  0 0 "[    .    1    .    2]" 1 
        787 1 35 LYS H    1 36 GLU H    . . 3.720 3.080 2.872 3.342     .  0 0 "[    .    1    .    2]" 1 
        788 1 35 LYS H    1 37 ARG H    . . 4.430 4.360 4.135 4.483 0.053 12 0 "[    .    1    .    2]" 1 
        789 1 35 LYS H    1 38 MET H    . . 5.500 5.050 4.896 5.289     .  0 0 "[    .    1    .    2]" 1 
        790 1 35 LYS HA   1 35 LYS QD   . . 4.320 2.742 2.220 4.152     .  0 0 "[    .    1    .    2]" 1 
        791 1 35 LYS HA   1 35 LYS HG2  . . 4.150 3.742 3.002 3.861     .  0 0 "[    .    1    .    2]" 1 
        792 1 35 LYS HA   1 35 LYS HG3  . . 4.040 2.890 2.723 3.144     .  0 0 "[    .    1    .    2]" 1 
        793 1 35 LYS HA   1 37 ARG H    . . 5.150 4.824 4.626 4.993     .  0 0 "[    .    1    .    2]" 1 
        794 1 35 LYS HA   1 38 MET H    . . 4.670 4.225 3.961 4.564     .  0 0 "[    .    1    .    2]" 1 
        795 1 35 LYS HA   1 38 MET HB2  . . 4.320 3.605 3.315 3.885     .  0 0 "[    .    1    .    2]" 1 
        796 1 35 LYS HA   1 38 MET HB3  . . 5.360 5.188 4.920 5.429 0.069  6 0 "[    .    1    .    2]" 1 
        797 1 35 LYS HA   1 38 MET QG   . . 4.360 3.874 3.334 4.372 0.012 18 0 "[    .    1    .    2]" 1 
        798 1 35 LYS HA   1 39 VAL H    . . 5.340 4.627 4.376 5.365 0.025 17 0 "[    .    1    .    2]" 1 
        799 1 35 LYS HA   1 39 VAL QG   . . 5.060 4.159 3.866 4.317     .  0 0 "[    .    1    .    2]" 1 
        800 1 35 LYS HB2  1 36 GLU H    . . 4.260 3.992 3.701 4.234     .  0 0 "[    .    1    .    2]" 1 
        801 1 35 LYS HB3  1 35 LYS QE   . . 4.950 4.113 3.235 4.437     .  0 0 "[    .    1    .    2]" 1 
        802 1 35 LYS HB3  1 36 GLU H    . . 3.720 2.687 2.195 3.088     .  0 0 "[    .    1    .    2]" 1 
        803 1 35 LYS HB3  1 36 GLU HG2  . . 4.850 4.518 3.709 4.869 0.019  5 0 "[    .    1    .    2]" 1 
        804 1 35 LYS HB3  1 36 GLU HG3  . . 4.850 4.342 3.969 4.881 0.031 17 0 "[    .    1    .    2]" 1 
        805 1 35 LYS HB3  1 39 VAL QG   . . 5.410 4.875 4.687 5.165     .  0 0 "[    .    1    .    2]" 1 
        806 1 35 LYS QD   1 35 LYS HG3  . . 2.500 2.364 2.182 2.570 0.070 18 0 "[    .    1    .    2]" 1 
        807 1 35 LYS QD   1 39 VAL QG   . . 4.620 4.337 3.741 4.538     .  0 0 "[    .    1    .    2]" 1 
        808 1 35 LYS QE   1 35 LYS HG2  . . 3.260 2.509 1.986 3.279 0.019 10 0 "[    .    1    .    2]" 1 
        809 1 35 LYS QE   1 39 VAL QG   . . 4.850 4.122 2.848 4.695     .  0 0 "[    .    1    .    2]" 1 
        810 1 35 LYS HG2  1 36 GLU H    . . 5.060 4.136 2.811 4.915     .  0 0 "[    .    1    .    2]" 1 
        811 1 35 LYS HG2  1 36 GLU HA   . . 5.350 4.628 3.097 5.288     .  0 0 "[    .    1    .    2]" 1 
        812 1 35 LYS HG2  1 36 GLU HG3  . . 5.060 4.827 3.603 5.804 0.744 17 3 "[   *.    1    - +  2]" 1 
        813 1 35 LYS HG3  1 39 VAL QG   . . 4.450 3.464 3.079 4.358     .  0 0 "[    .    1    .    2]" 1 
        814 1 36 GLU H    1 36 GLU HB2  . . 3.680 2.209 2.157 2.267     .  0 0 "[    .    1    .    2]" 1 
        815 1 36 GLU H    1 36 GLU HB3  . . 3.220 3.483 3.453 3.519 0.299 18 0 "[    .    1    .    2]" 1 
        816 1 36 GLU H    1 36 GLU HG2  . . 3.990 3.365 3.150 3.593     .  0 0 "[    .    1    .    2]" 1 
        817 1 36 GLU H    1 36 GLU HG3  . . 3.890 3.214 2.729 3.888     .  0 0 "[    .    1    .    2]" 1 
        818 1 36 GLU H    1 37 ARG H    . . 3.440 2.580 2.174 2.926     .  0 0 "[    .    1    .    2]" 1 
        819 1 36 GLU H    1 37 ARG QB   . . 5.350 4.337 4.037 4.538     .  0 0 "[    .    1    .    2]" 1 
        820 1 36 GLU H    1 38 MET H    . . 5.040 4.533 4.084 4.905     .  0 0 "[    .    1    .    2]" 1 
        821 1 36 GLU H    1 39 VAL H    . . 5.270 5.172 4.748 5.301 0.031 20 0 "[    .    1    .    2]" 1 
        822 1 36 GLU H    1 39 VAL QG   . . 4.990 3.754 3.697 3.836     .  0 0 "[    .    1    .    2]" 1 
        823 1 36 GLU HA   1 36 GLU HG2  . . 3.590 2.122 2.027 2.445     .  0 0 "[    .    1    .    2]" 1 
        824 1 36 GLU HA   1 36 GLU HG3  . . 3.540 3.314 3.064 3.614 0.074  4 0 "[    .    1    .    2]" 1 
        825 1 36 GLU HA   1 38 MET H    . . 5.270 4.774 4.575 5.120     .  0 0 "[    .    1    .    2]" 1 
        826 1 36 GLU HA   1 39 VAL H    . . 3.930 3.762 3.390 4.027 0.097 18 0 "[    .    1    .    2]" 1 
        827 1 36 GLU HA   1 39 VAL QG   . . 3.460 1.824 1.795 1.896     .  0 0 "[    .    1    .    2]" 1 
        828 1 36 GLU HA   1 40 GLU H    . . 4.540 3.690 3.569 4.163     .  0 0 "[    .    1    .    2]" 1 
        829 1 36 GLU HB2  1 37 ARG H    . . 4.040 2.741 2.629 2.937     .  0 0 "[    .    1    .    2]" 1 
        830 1 36 GLU HB3  1 37 ARG H    . . 3.300 3.275 3.078 3.609 0.309 18 0 "[    .    1    .    2]" 1 
        831 1 36 GLU HB3  1 39 VAL QG   . . 4.510 3.525 3.376 3.920     .  0 0 "[    .    1    .    2]" 1 
        832 1 36 GLU HG2  1 37 ARG H    . . 5.060 4.862 4.734 4.936     .  0 0 "[    .    1    .    2]" 1 
        833 1 36 GLU HG2  1 39 VAL QG   . . 4.850 3.088 2.910 3.653     .  0 0 "[    .    1    .    2]" 1 
        834 1 36 GLU HG3  1 37 ARG H    . . 5.210 4.844 4.707 5.117     .  0 0 "[    .    1    .    2]" 1 
        835 1 36 GLU HG3  1 39 VAL QG   . . 4.510 4.312 4.133 4.711 0.201 17 0 "[    .    1    .    2]" 1 
        836 1 37 ARG H    1 37 ARG QB   . . 3.580 2.316 2.107 2.517     .  0 0 "[    .    1    .    2]" 1 
        837 1 37 ARG H    1 37 ARG QD   . . 5.190 4.059 3.911 4.212     .  0 0 "[    .    1    .    2]" 1 
        838 1 37 ARG H    1 37 ARG QG   . . 3.840 2.482 2.007 2.989     .  0 0 "[    .    1    .    2]" 1 
        839 1 37 ARG H    1 38 MET H    . . 3.750 3.147 2.898 3.246     .  0 0 "[    .    1    .    2]" 1 
        840 1 37 ARG H    1 38 MET QG   . . 5.210 4.891 4.102 5.215 0.005  8 0 "[    .    1    .    2]" 1 
        841 1 37 ARG H    1 39 VAL H    . . 5.150 4.763 3.870 4.969     .  0 0 "[    .    1    .    2]" 1 
        842 1 37 ARG HA   1 37 ARG QG   . . 3.930 2.254 2.190 2.357     .  0 0 "[    .    1    .    2]" 1 
        843 1 37 ARG HA   1 40 GLU H    . . 4.360 3.736 3.326 3.998     .  0 0 "[    .    1    .    2]" 1 
        844 1 37 ARG HA   1 40 GLU HB2  . . 4.210 3.041 2.887 3.417     .  0 0 "[    .    1    .    2]" 1 
        845 1 37 ARG HA   1 40 GLU HB3  . . 4.090 3.023 2.731 3.551     .  0 0 "[    .    1    .    2]" 1 
        846 1 37 ARG HA   1 40 GLU HG2  . . 4.950 4.485 4.205 5.481 0.531  1 1 "[+   .    1    .    2]" 1 
        847 1 37 ARG HA   1 41 ILE H    . . 4.790 4.045 3.791 4.234     .  0 0 "[    .    1    .    2]" 1 
        848 1 37 ARG HA   1 41 ILE MD   . . 4.620 3.612 3.458 3.790     .  0 0 "[    .    1    .    2]" 1 
        849 1 37 ARG HA   1 41 ILE HG13 . . 5.350 3.700 3.421 3.944     .  0 0 "[    .    1    .    2]" 1 
        850 1 37 ARG QB   1 37 ARG HE   . . 4.410 3.587 3.197 4.006     .  0 0 "[    .    1    .    2]" 1 
        851 1 37 ARG QB   1 38 MET H    . . 3.890 2.249 1.973 2.349     .  0 0 "[    .    1    .    2]" 1 
        852 1 37 ARG QB   1 38 MET QG   . . 4.690 3.237 3.076 3.446     .  0 0 "[    .    1    .    2]" 1 
        853 1 37 ARG QB   1 41 ILE MD   . . 3.780 2.380 2.213 2.667     .  0 0 "[    .    1    .    2]" 1 
        854 1 37 ARG QD   1 41 ILE MD   . . 5.190 3.839 3.209 4.180     .  0 0 "[    .    1    .    2]" 1 
        855 1 37 ARG QG   1 38 MET H    . . 4.990 4.093 3.784 4.251     .  0 0 "[    .    1    .    2]" 1 
        856 1 38 MET H    1 38 MET HB2  . . 3.650 2.383 2.171 2.683     .  0 0 "[    .    1    .    2]" 1 
        857 1 38 MET H    1 38 MET HB3  . . 3.930 3.512 3.455 3.536     .  0 0 "[    .    1    .    2]" 1 
        858 1 38 MET H    1 38 MET ME   . . 4.620 3.780 3.315 4.185     .  0 0 "[    .    1    .    2]" 1 
        859 1 38 MET H    1 38 MET QG   . . 3.430 2.253 1.886 2.638     .  0 0 "[    .    1    .    2]" 1 
        860 1 38 MET H    1 39 VAL H    . . 3.620 3.135 2.762 3.223     .  0 0 "[    .    1    .    2]" 1 
        861 1 38 MET H    1 39 VAL QG   . . 4.560 3.717 3.416 3.798     .  0 0 "[    .    1    .    2]" 1 
        862 1 38 MET H    1 40 GLU H    . . 4.870 4.358 4.211 4.802     .  0 0 "[    .    1    .    2]" 1 
        863 1 38 MET H    1 41 ILE H    . . 5.500 4.580 4.448 4.916     .  0 0 "[    .    1    .    2]" 1 
        864 1 38 MET H    1 41 ILE MD   . . 4.760 3.181 2.806 3.505     .  0 0 "[    .    1    .    2]" 1 
        865 1 38 MET HA   1 38 MET ME   . . 3.560 2.089 1.973 2.511     .  0 0 "[    .    1    .    2]" 1 
        866 1 38 MET HA   1 38 MET QG   . . 3.990 2.538 2.308 3.182     .  0 0 "[    .    1    .    2]" 1 
        867 1 38 MET HA   1 41 ILE H    . . 3.990 3.426 3.290 3.830     .  0 0 "[    .    1    .    2]" 1 
        868 1 38 MET HA   1 41 ILE MD   . . 3.660 1.950 1.833 2.136     .  0 0 "[    .    1    .    2]" 1 
        869 1 38 MET HA   1 41 ILE HG12 . . 5.190 4.550 4.364 4.884     .  0 0 "[    .    1    .    2]" 1 
        870 1 38 MET HA   1 41 ILE MG   . . 4.560 3.953 3.559 4.112     .  0 0 "[    .    1    .    2]" 1 
        871 1 38 MET HA   1 42 GLY H    . . 4.260 4.087 3.830 4.196     .  0 0 "[    .    1    .    2]" 1 
        872 1 38 MET HB2  1 39 VAL H    . . 4.060 2.297 1.965 3.319     .  0 0 "[    .    1    .    2]" 1 
        873 1 38 MET HB2  1 41 ILE MD   . . 5.060 4.400 4.251 4.671     .  0 0 "[    .    1    .    2]" 1 
        874 1 38 MET ME   1 38 MET QG   . . 3.580 2.170 2.035 2.391     .  0 0 "[    .    1    .    2]" 1 
        875 1 38 MET ME   1 39 VAL H    . . 5.060 4.982 4.646 5.062 0.002  9 0 "[    .    1    .    2]" 1 
        876 1 38 MET ME   1 41 ILE H    . . 5.060 4.736 4.558 5.071 0.011  4 0 "[    .    1    .    2]" 1 
        877 1 38 MET ME   1 41 ILE MD   . . 3.380 2.102 1.837 2.753     .  0 0 "[    .    1    .    2]" 1 
        878 1 38 MET ME   1 41 ILE MG   . . 3.830 3.350 2.949 3.841 0.011 19 0 "[    .    1    .    2]" 1 
        879 1 38 MET QG   1 39 VAL H    . . 4.700 4.014 3.636 4.536     .  0 0 "[    .    1    .    2]" 1 
        880 1 38 MET QG   1 39 VAL QG   . . 4.950 4.648 4.023 4.799     .  0 0 "[    .    1    .    2]" 1 
        881 1 38 MET QG   1 41 ILE MD   . . 5.060 3.257 3.042 4.022     .  0 0 "[    .    1    .    2]" 1 
        882 1 39 VAL H    1 39 VAL HB   . . 3.080 2.520 2.463 2.746     .  0 0 "[    .    1    .    2]" 1 
        883 1 39 VAL H    1 39 VAL QG   . . 3.060 1.864 1.815 1.888     .  0 0 "[    .    1    .    2]" 1 
        884 1 39 VAL H    1 40 GLU H    . . 3.530 2.892 2.428 3.144     .  0 0 "[    .    1    .    2]" 1 
        885 1 39 VAL H    1 41 ILE H    . . 4.990 4.121 3.552 4.296     .  0 0 "[    .    1    .    2]" 1 
        886 1 39 VAL H    1 41 ILE HB   . . 5.210 5.056 4.702 5.200     .  0 0 "[    .    1    .    2]" 1 
        887 1 39 VAL H    1 41 ILE MD   . . 5.150 4.662 4.240 4.801     .  0 0 "[    .    1    .    2]" 1 
        888 1 39 VAL H    1 42 GLY H    . . 5.500 4.809 4.632 4.924     .  0 0 "[    .    1    .    2]" 1 
        889 1 39 VAL HA   1 39 VAL QG   . . 3.030 2.343 2.089 2.414     .  0 0 "[    .    1    .    2]" 1 
        890 1 39 VAL HA   1 40 GLU HA   . . 4.850 4.789 4.759 4.807     .  0 0 "[    .    1    .    2]" 1 
        891 1 39 VAL HA   1 41 ILE H    . . 5.350 4.297 4.159 4.467     .  0 0 "[    .    1    .    2]" 1 
        892 1 39 VAL HA   1 41 ILE HB   . . 4.950 5.029 4.956 5.127 0.177 18 0 "[    .    1    .    2]" 1 
        893 1 39 VAL HA   1 42 GLY H    . . 4.410 3.506 3.401 3.621     .  0 0 "[    .    1    .    2]" 1 
        894 1 39 VAL HA   1 42 GLY HA3  . . 4.360 3.868 3.778 4.043     .  0 0 "[    .    1    .    2]" 1 
        895 1 39 VAL HA   1 43 SER H    . . 4.760 4.592 4.162 4.786 0.026 19 0 "[    .    1    .    2]" 1 
        896 1 39 VAL QG   1 40 GLU H    . . 3.910 2.038 1.799 3.058     .  0 0 "[    .    1    .    2]" 1 
        897 1 39 VAL QG   1 40 GLU HA   . . 4.040 3.192 3.051 3.939     .  0 0 "[    .    1    .    2]" 1 
        898 1 39 VAL QG   1 43 SER H    . . 4.790 4.229 4.018 4.666     .  0 0 "[    .    1    .    2]" 1 
        899 1 39 VAL QG   1 43 SER QB   . . 4.450 3.927 3.558 4.372     .  0 0 "[    .    1    .    2]" 1 
        900 1 40 GLU H    1 40 GLU HB2  . . 3.440 2.089 2.034 2.213     .  0 0 "[    .    1    .    2]" 1 
        901 1 40 GLU H    1 40 GLU HB3  . . 3.210 2.975 2.768 3.109     .  0 0 "[    .    1    .    2]" 1 
        902 1 40 GLU H    1 40 GLU HG2  . . 4.410 4.433 4.208 4.549 0.139 18 0 "[    .    1    .    2]" 1 
        903 1 40 GLU H    1 40 GLU HG3  . . 4.560 4.474 4.398 4.533     .  0 0 "[    .    1    .    2]" 1 
        904 1 40 GLU H    1 41 ILE H    . . 3.730 2.795 2.683 2.887     .  0 0 "[    .    1    .    2]" 1 
        905 1 40 GLU H    1 41 ILE HA   . . 5.500 5.316 5.227 5.388     .  0 0 "[    .    1    .    2]" 1 
        906 1 40 GLU H    1 41 ILE HB   . . 4.950 4.888 4.740 4.995 0.045 17 0 "[    .    1    .    2]" 1 
        907 1 40 GLU H    1 41 ILE MD   . . 5.060 4.698 4.573 4.913     .  0 0 "[    .    1    .    2]" 1 
        908 1 40 GLU H    1 42 GLY H    . . 5.210 4.586 4.448 4.697     .  0 0 "[    .    1    .    2]" 1 
        909 1 40 GLU H    1 43 SER H    . . 5.270 5.012 4.917 5.074     .  0 0 "[    .    1    .    2]" 1 
        910 1 40 GLU HA   1 40 GLU HG2  . . 4.060 3.515 2.181 3.622     .  0 0 "[    .    1    .    2]" 1 
        911 1 40 GLU HA   1 40 GLU HG3  . . 4.280 2.760 2.534 3.389     .  0 0 "[    .    1    .    2]" 1 
        912 1 40 GLU HA   1 41 ILE HA   . . 4.850 4.803 4.760 4.832     .  0 0 "[    .    1    .    2]" 1 
        913 1 40 GLU HA   1 42 GLY H    . . 5.060 4.876 4.690 5.056     .  0 0 "[    .    1    .    2]" 1 
        914 1 40 GLU HA   1 43 SER H    . . 4.180 3.616 3.518 3.697     .  0 0 "[    .    1    .    2]" 1 
        915 1 40 GLU HA   1 43 SER QB   . . 2.850 2.883 2.848 2.915 0.065 15 0 "[    .    1    .    2]" 1 
        916 1 40 GLU HB2  1 41 ILE H    . . 3.720 3.574 3.447 3.763 0.043  1 0 "[    .    1    .    2]" 1 
        917 1 40 GLU HB2  1 41 ILE HA   . . 5.500 5.404 5.290 5.533 0.033  1 0 "[    .    1    .    2]" 1 
        918 1 40 GLU HB3  1 41 ILE H    . . 3.910 2.803 2.667 3.023     .  0 0 "[    .    1    .    2]" 1 
        919 1 40 GLU HB3  1 41 ILE MD   . . 5.150 4.385 4.179 4.697     .  0 0 "[    .    1    .    2]" 1 
        920 1 40 GLU HB3  1 42 GLY H    . . 5.500 5.424 5.305 5.520 0.020 17 0 "[    .    1    .    2]" 1 
        921 1 40 GLU HG3  1 41 ILE H    . . 4.950 4.663 4.361 5.241 0.291  1 0 "[    .    1    .    2]" 1 
        922 1 40 GLU HG3  1 43 SER QB   . . 4.950 4.053 3.629 5.270 0.320  1 0 "[    .    1    .    2]" 1 
        923 1 40 GLU HG3  1 44 ARG HD2  . . 4.510 4.345 3.809 4.957 0.447  1 0 "[    .    1    .    2]" 1 
        924 1 41 ILE H    1 41 ILE HB   . . 3.200 2.356 2.273 2.442     .  0 0 "[    .    1    .    2]" 1 
        925 1 41 ILE H    1 41 ILE MD   . . 3.450 3.078 2.997 3.172     .  0 0 "[    .    1    .    2]" 1 
        926 1 41 ILE H    1 41 ILE HG12 . . 4.280 3.653 3.453 3.833     .  0 0 "[    .    1    .    2]" 1 
        927 1 41 ILE H    1 41 ILE HG13 . . 3.040 2.216 1.981 2.460     .  0 0 "[    .    1    .    2]" 1 
        928 1 41 ILE H    1 41 ILE MG   . . 3.780 3.694 3.671 3.706     .  0 0 "[    .    1    .    2]" 1 
        929 1 41 ILE H    1 42 GLY H    . . 3.840 2.824 2.665 2.899     .  0 0 "[    .    1    .    2]" 1 
        930 1 41 ILE H    1 42 GLY HA3  . . 5.220 4.935 4.809 5.007     .  0 0 "[    .    1    .    2]" 1 
        931 1 41 ILE H    1 43 SER H    . . 4.560 4.022 3.929 4.160     .  0 0 "[    .    1    .    2]" 1 
        932 1 41 ILE H    1 44 ARG H    . . 4.870 4.853 4.772 4.924 0.054 18 0 "[    .    1    .    2]" 1 
        933 1 41 ILE HA   1 41 ILE MD   . . 3.880 3.845 3.820 3.876     .  0 0 "[    .    1    .    2]" 1 
        934 1 41 ILE HA   1 41 ILE HG12 . . 3.380 2.763 2.671 2.826     .  0 0 "[    .    1    .    2]" 1 
        935 1 41 ILE HA   1 41 ILE HG13 . . 3.540 2.629 2.560 2.781     .  0 0 "[    .    1    .    2]" 1 
        936 1 41 ILE HA   1 41 ILE MG   . . 3.160 2.433 2.352 2.512     .  0 0 "[    .    1    .    2]" 1 
        937 1 41 ILE HA   1 43 SER H    . . 5.270 3.954 3.796 4.338     .  0 0 "[    .    1    .    2]" 1 
        938 1 41 ILE HA   1 44 ARG H    . . 4.360 3.170 3.080 3.368     .  0 0 "[    .    1    .    2]" 1 
        939 1 41 ILE HA   1 44 ARG HB2  . . 4.320 2.727 2.626 2.776     .  0 0 "[    .    1    .    2]" 1 
        940 1 41 ILE HA   1 44 ARG HB3  . . 4.360 4.383 4.283 4.420 0.060  7 0 "[    .    1    .    2]" 1 
        941 1 41 ILE HA   1 44 ARG HD2  . . 4.560 4.190 2.037 4.568 0.008 12 0 "[    .    1    .    2]" 1 
        942 1 41 ILE HA   1 44 ARG HD3  . . 4.280 3.991 2.594 4.262     .  0 0 "[    .    1    .    2]" 1 
        943 1 41 ILE HA   1 45 TRP H    . . 4.830 3.978 3.821 4.193     .  0 0 "[    .    1    .    2]" 1 
        944 1 41 ILE HB   1 41 ILE MD   . . 3.340 2.128 2.017 2.273     .  0 0 "[    .    1    .    2]" 1 
        945 1 41 ILE HB   1 42 GLY H    . . 3.660 2.407 2.320 2.525     .  0 0 "[    .    1    .    2]" 1 
        946 1 41 ILE HB   1 42 GLY HA2  . . 4.950 4.353 4.275 4.448     .  0 0 "[    .    1    .    2]" 1 
        947 1 41 ILE HB   1 43 SER H    . . 4.950 4.821 4.712 4.962 0.012 18 0 "[    .    1    .    2]" 1 
        948 1 41 ILE MD   1 41 ILE MG   . . 2.850 2.385 2.151 2.483     .  0 0 "[    .    1    .    2]" 1 
        949 1 41 ILE MD   1 42 GLY H    . . 4.610 4.125 4.010 4.305     .  0 0 "[    .    1    .    2]" 1 
        950 1 41 ILE MG   1 42 GLY H    . . 4.010 3.138 3.022 3.209     .  0 0 "[    .    1    .    2]" 1 
        951 1 41 ILE MG   1 42 GLY HA2  . . 4.210 3.472 3.381 3.573     .  0 0 "[    .    1    .    2]" 1 
        952 1 41 ILE MG   1 43 SER H    . . 5.060 4.603 4.441 4.828     .  0 0 "[    .    1    .    2]" 1 
        953 1 41 ILE MG   1 44 ARG H    . . 5.210 4.285 4.043 4.499     .  0 0 "[    .    1    .    2]" 1 
        954 1 41 ILE MG   1 44 ARG HD3  . . 4.950 4.837 4.112 4.957 0.007  3 0 "[    .    1    .    2]" 1 
        955 1 41 ILE MG   1 45 TRP H    . . 4.560 3.411 3.234 3.550     .  0 0 "[    .    1    .    2]" 1 
        956 1 41 ILE MG   1 45 TRP HB2  . . 4.690 3.137 2.952 3.457     .  0 0 "[    .    1    .    2]" 1 
        957 1 41 ILE MG   1 45 TRP HB3  . . 5.350 3.660 3.431 3.865     .  0 0 "[    .    1    .    2]" 1 
        958 1 41 ILE MG   1 45 TRP HE3  . . 5.030 4.646 4.384 4.960     .  0 0 "[    .    1    .    2]" 1 
        959 1 42 GLY H    1 43 SER H    . . 3.440 2.963 2.910 2.990     .  0 0 "[    .    1    .    2]" 1 
        960 1 42 GLY H    1 43 SER QB   . . 4.850 4.632 4.562 4.671     .  0 0 "[    .    1    .    2]" 1 
        961 1 42 GLY H    1 44 ARG H    . . 4.990 4.627 4.416 4.729     .  0 0 "[    .    1    .    2]" 1 
        962 1 42 GLY HA2  1 45 TRP H    . . 4.370 3.605 3.476 3.706     .  0 0 "[    .    1    .    2]" 1 
        963 1 42 GLY HA2  1 45 TRP HB2  . . 5.060 3.845 3.652 4.078     .  0 0 "[    .    1    .    2]" 1 
        964 1 42 GLY HA2  1 45 TRP HB3  . . 4.690 2.592 2.447 2.741     .  0 0 "[    .    1    .    2]" 1 
        965 1 42 GLY HA2  1 45 TRP HD1  . . 5.030 4.002 3.786 4.261     .  0 0 "[    .    1    .    2]" 1 
        966 1 43 SER H    1 43 SER QB   . . 2.850 2.061 2.000 2.152     .  0 0 "[    .    1    .    2]" 1 
        967 1 43 SER H    1 44 ARG H    . . 3.440 2.679 2.603 2.816     .  0 0 "[    .    1    .    2]" 1 
        968 1 43 SER HA   1 45 TRP H    . . 5.500 4.366 4.118 4.790     .  0 0 "[    .    1    .    2]" 1 
        969 1 43 SER HA   1 46 GLN H    . . 4.120 3.262 3.128 3.429     .  0 0 "[    .    1    .    2]" 1 
        970 1 43 SER HA   1 46 GLN HA   . . 5.500 5.261 5.096 5.434     .  0 0 "[    .    1    .    2]" 1 
        971 1 43 SER HA   1 46 GLN QB   . . 3.610 2.387 2.174 2.595     .  0 0 "[    .    1    .    2]" 1 
        972 1 43 SER HA   1 46 GLN HG3  . . 4.410 3.562 3.200 4.143     .  0 0 "[    .    1    .    2]" 1 
        973 1 43 SER QB   1 44 ARG H    . . 3.250 2.422 2.303 2.693     .  0 0 "[    .    1    .    2]" 1 
        974 1 43 SER QB   1 44 ARG HB2  . . 4.510 4.557 4.502 4.593 0.083 12 0 "[    .    1    .    2]" 1 
        975 1 43 SER QB   1 44 ARG QG   . . 4.410 3.273 3.117 3.940     .  0 0 "[    .    1    .    2]" 1 
        976 1 44 ARG H    1 44 ARG HB2  . . 3.640 2.440 2.234 2.534     .  0 0 "[    .    1    .    2]" 1 
        977 1 44 ARG H    1 44 ARG HB3  . . 4.060 3.544 3.496 3.554     .  0 0 "[    .    1    .    2]" 1 
        978 1 44 ARG H    1 44 ARG HD2  . . 4.610 4.367 1.979 4.653 0.043 13 0 "[    .    1    .    2]" 1 
        979 1 44 ARG H    1 44 ARG HD3  . . 4.560 4.444 3.651 4.566 0.006  9 0 "[    .    1    .    2]" 1 
        980 1 44 ARG H    1 44 ARG QG   . . 3.500 2.346 2.147 3.158     .  0 0 "[    .    1    .    2]" 1 
        981 1 44 ARG H    1 45 TRP HA   . . 5.310 5.289 5.204 5.339 0.029  6 0 "[    .    1    .    2]" 1 
        982 1 44 ARG HA   1 44 ARG HD2  . . 4.690 4.630 3.582 4.774 0.084  1 0 "[    .    1    .    2]" 1 
        983 1 44 ARG HA   1 44 ARG HD3  . . 4.360 4.374 4.276 4.551 0.191 19 0 "[    .    1    .    2]" 1 
        984 1 44 ARG HA   1 44 ARG QG   . . 3.440 2.241 2.102 2.292     .  0 0 "[    .    1    .    2]" 1 
        985 1 44 ARG HA   1 46 GLN H    . . 4.640 4.022 3.909 4.147     .  0 0 "[    .    1    .    2]" 1 
        986 1 44 ARG HA   1 47 ARG H    . . 4.560 3.228 3.005 3.444     .  0 0 "[    .    1    .    2]" 1 
        987 1 44 ARG HA   1 47 ARG HD2  . . 4.280 2.540 1.992 3.303     .  0 0 "[    .    1    .    2]" 1 
        988 1 44 ARG HA   1 47 ARG HD3  . . 4.040 2.454 2.008 3.987     .  0 0 "[    .    1    .    2]" 1 
        989 1 44 ARG HB2  1 44 ARG HD2  . . 4.060 3.567 2.125 3.802     .  0 0 "[    .    1    .    2]" 1 
        990 1 44 ARG HB2  1 44 ARG HD3  . . 3.890 2.777 2.687 3.112     .  0 0 "[    .    1    .    2]" 1 
        991 1 44 ARG HB2  1 45 TRP H    . . 4.110 2.693 2.490 2.898     .  0 0 "[    .    1    .    2]" 1 
        992 1 44 ARG HB3  1 44 ARG HD3  . . 3.580 2.506 2.247 3.911 0.331 19 0 "[    .    1    .    2]" 1 
        993 1 44 ARG HB3  1 45 TRP H    . . 4.470 3.663 3.177 3.918     .  0 0 "[    .    1    .    2]" 1 
        994 1 44 ARG QG   1 47 ARG HD3  . . 4.950 3.241 2.776 4.412     .  0 0 "[    .    1    .    2]" 1 
        995 1 45 TRP H    1 45 TRP HB2  . . 3.610 2.674 2.592 2.739     .  0 0 "[    .    1    .    2]" 1 
        996 1 45 TRP H    1 45 TRP HB3  . . 3.580 2.278 2.249 2.331     .  0 0 "[    .    1    .    2]" 1 
        997 1 45 TRP H    1 45 TRP HD1  . . 4.700 4.708 4.653 4.798 0.098 18 0 "[    .    1    .    2]" 1 
        998 1 45 TRP H    1 45 TRP HE3  . . 5.500 4.857 4.755 4.925     .  0 0 "[    .    1    .    2]" 1 
        999 1 45 TRP H    1 46 GLN H    . . 3.860 2.532 2.437 2.649     .  0 0 "[    .    1    .    2]" 1 
       1000 1 45 TRP H    1 46 GLN QB   . . 5.060 4.362 4.208 4.500     .  0 0 "[    .    1    .    2]" 1 
       1001 1 45 TRP H    1 47 ARG H    . . 5.340 3.814 3.732 3.906     .  0 0 "[    .    1    .    2]" 1 
       1002 1 45 TRP HA   1 45 TRP HE3  . . 3.990 2.851 2.731 3.049     .  0 0 "[    .    1    .    2]" 1 
       1003 1 45 TRP HA   1 48 ILE H    . . 4.510 3.545 3.394 3.737     .  0 0 "[    .    1    .    2]" 1 
       1004 1 45 TRP HA   1 48 ILE MD   . . 4.060 2.190 1.969 2.389     .  0 0 "[    .    1    .    2]" 1 
       1005 1 45 TRP HA   1 48 ILE HG12 . . 4.120 2.221 1.973 2.609     .  0 0 "[    .    1    .    2]" 1 
       1006 1 45 TRP HA   1 48 ILE MG   . . 3.910 3.374 3.096 3.604     .  0 0 "[    .    1    .    2]" 1 
       1007 1 45 TRP HB2  1 45 TRP HD1  . . 3.920 3.808 3.782 3.846     .  0 0 "[    .    1    .    2]" 1 
       1008 1 45 TRP HB2  1 46 GLN H    . . 4.160 4.193 4.161 4.235 0.075 16 0 "[    .    1    .    2]" 1 
       1009 1 45 TRP HB2  1 48 ILE MD   . . 5.350 3.566 3.240 3.883     .  0 0 "[    .    1    .    2]" 1 
       1010 1 45 TRP HB3  1 45 TRP HD1  . . 3.610 2.685 2.661 2.730     .  0 0 "[    .    1    .    2]" 1 
       1011 1 45 TRP HB3  1 45 TRP HE1  . . 5.210 4.936 4.928 4.952     .  0 0 "[    .    1    .    2]" 1 
       1012 1 45 TRP HB3  1 46 GLN H    . . 3.890 3.003 2.956 3.087     .  0 0 "[    .    1    .    2]" 1 
       1013 1 45 TRP HB3  1 46 GLN QB   . . 4.850 4.583 4.439 4.755     .  0 0 "[    .    1    .    2]" 1 
       1014 1 45 TRP HD1  1 46 GLN H    . . 4.320 3.977 3.875 4.060     .  0 0 "[    .    1    .    2]" 1 
       1015 1 45 TRP HD1  1 46 GLN HA   . . 4.120 3.705 3.479 3.867     .  0 0 "[    .    1    .    2]" 1 
       1016 1 45 TRP HD1  1 46 GLN QB   . . 4.850 4.628 4.463 4.779     .  0 0 "[    .    1    .    2]" 1 
       1017 1 45 TRP HD1  1 46 GLN HG2  . . 4.420 3.032 2.664 3.590     .  0 0 "[    .    1    .    2]" 1 
       1018 1 45 TRP HD1  1 46 GLN HG3  . . 4.420 3.942 3.200 4.430 0.010  7 0 "[    .    1    .    2]" 1 
       1019 1 45 TRP HD1  1 53 LYS QE   . . 4.230 3.196 2.599 3.604     .  0 0 "[    .    1    .    2]" 1 
       1020 1 45 TRP HE1  1 46 GLN HA   . . 5.210 5.199 5.102 5.238 0.028 18 0 "[    .    1    .    2]" 1 
       1021 1 45 TRP HE1  1 53 LYS HB3  . . 5.500 4.885 4.300 5.255     .  0 0 "[    .    1    .    2]" 1 
       1022 1 45 TRP HE1  1 53 LYS QD   . . 4.390 3.669 2.389 4.308     .  0 0 "[    .    1    .    2]" 1 
       1023 1 45 TRP HE1  1 53 LYS QE   . . 4.230 2.584 2.080 3.214     .  0 0 "[    .    1    .    2]" 1 
       1024 1 45 TRP HE1  1 53 LYS HG2  . . 5.500 4.030 3.643 5.952 0.452 10 0 "[    .    1    .    2]" 1 
       1025 1 45 TRP HE3  1 48 ILE MD   . . 4.150 2.203 1.953 2.471     .  0 0 "[    .    1    .    2]" 1 
       1026 1 45 TRP HE3  1 48 ILE MG   . . 4.950 4.334 3.998 4.702     .  0 0 "[    .    1    .    2]" 1 
       1027 1 45 TRP HH2  1 48 ILE MD   . . 5.190 3.947 3.586 4.396     .  0 0 "[    .    1    .    2]" 1 
       1028 1 45 TRP HH2  1 53 LYS H    . . 5.500 4.722 4.600 4.862     .  0 0 "[    .    1    .    2]" 1 
       1029 1 45 TRP HH2  1 53 LYS HA   . . 3.750 2.107 1.993 2.328     .  0 0 "[    .    1    .    2]" 1 
       1030 1 45 TRP HH2  1 53 LYS HB2  . . 5.380 4.530 4.295 4.772     .  0 0 "[    .    1    .    2]" 1 
       1031 1 45 TRP HH2  1 53 LYS HB3  . . 4.480 3.209 2.793 3.543     .  0 0 "[    .    1    .    2]" 1 
       1032 1 45 TRP HH2  1 53 LYS QD   . . 5.190 4.508 2.714 5.029     .  0 0 "[    .    1    .    2]" 1 
       1033 1 45 TRP HH2  1 53 LYS QE   . . 5.500 4.684 4.104 5.086     .  0 0 "[    .    1    .    2]" 1 
       1034 1 45 TRP HH2  1 53 LYS HG2  . . 5.190 3.209 2.799 5.243 0.053 10 0 "[    .    1    .    2]" 1 
       1035 1 45 TRP HH2  1 53 LYS HG3  . . 5.380 4.412 4.178 4.849     .  0 0 "[    .    1    .    2]" 1 
       1036 1 45 TRP HH2  1 56 TYR H    . . 5.030 4.852 4.464 5.038 0.008 14 0 "[    .    1    .    2]" 1 
       1037 1 45 TRP HH2  1 56 TYR HB2  . . 4.370 2.825 2.486 3.035     .  0 0 "[    .    1    .    2]" 1 
       1038 1 45 TRP HH2  1 56 TYR HB3  . . 3.420 3.370 3.126 3.445 0.025 12 0 "[    .    1    .    2]" 1 
       1039 1 45 TRP HH2  1 56 TYR QD   . . 4.800 3.616 3.192 4.170     .  0 0 "[    .    1    .    2]" 1 
       1040 1 45 TRP HH2  1 57 LYS H    . . 5.150 3.807 3.027 4.570     .  0 0 "[    .    1    .    2]" 1 
       1041 1 45 TRP HZ2  1 53 LYS HA   . . 4.700 3.625 3.336 4.033     .  0 0 "[    .    1    .    2]" 1 
       1042 1 45 TRP HZ2  1 53 LYS HB2  . . 4.700 4.463 4.000 4.707 0.007 15 0 "[    .    1    .    2]" 1 
       1043 1 45 TRP HZ2  1 53 LYS HB3  . . 4.370 2.842 2.354 3.130     .  0 0 "[    .    1    .    2]" 1 
       1044 1 45 TRP HZ2  1 53 LYS QD   . . 3.920 3.276 2.307 3.862     .  0 0 "[    .    1    .    2]" 1 
       1045 1 45 TRP HZ2  1 53 LYS QE   . . 4.900 3.472 3.015 3.984     .  0 0 "[    .    1    .    2]" 1 
       1046 1 45 TRP HZ2  1 53 LYS HG2  . . 5.030 2.927 2.587 4.939     .  0 0 "[    .    1    .    2]" 1 
       1047 1 45 TRP HZ2  1 53 LYS HG3  . . 5.030 4.398 3.743 4.579     .  0 0 "[    .    1    .    2]" 1 
       1048 1 45 TRP HZ3  1 48 ILE MD   . . 4.180 2.923 2.631 3.234     .  0 0 "[    .    1    .    2]" 1 
       1049 1 45 TRP HZ3  1 53 LYS HA   . . 4.770 3.017 2.705 3.378     .  0 0 "[    .    1    .    2]" 1 
       1050 1 45 TRP HZ3  1 56 TYR HB2  . . 4.950 2.855 2.519 3.096     .  0 0 "[    .    1    .    2]" 1 
       1051 1 45 TRP HZ3  1 56 TYR HB3  . . 4.800 3.017 2.797 3.294     .  0 0 "[    .    1    .    2]" 1 
       1052 1 45 TRP HZ3  1 56 TYR QD   . . 4.700 2.255 1.978 2.923     .  0 0 "[    .    1    .    2]" 1 
       1053 1 45 TRP HZ3  1 56 TYR QE   . . 4.900 3.886 3.575 4.389     .  0 0 "[    .    1    .    2]" 1 
       1054 1 46 GLN H    1 46 GLN QB   . . 3.140 2.161 2.077 2.266     .  0 0 "[    .    1    .    2]" 1 
       1055 1 46 GLN H    1 46 GLN HG2  . . 4.030 3.314 2.658 3.760     .  0 0 "[    .    1    .    2]" 1 
       1056 1 46 GLN H    1 46 GLN HG3  . . 4.040 3.408 2.881 3.694     .  0 0 "[    .    1    .    2]" 1 
       1057 1 46 GLN H    1 47 ARG H    . . 3.750 2.468 2.337 2.558     .  0 0 "[    .    1    .    2]" 1 
       1058 1 46 GLN H    1 47 ARG HA   . . 5.420 4.893 4.824 4.958     .  0 0 "[    .    1    .    2]" 1 
       1059 1 46 GLN H    1 47 ARG HG3  . . 4.910 4.008 3.575 4.439     .  0 0 "[    .    1    .    2]" 1 
       1060 1 46 GLN H    1 48 ILE H    . . 5.210 4.478 4.252 4.683     .  0 0 "[    .    1    .    2]" 1 
       1061 1 46 GLN HA   1 46 GLN HG2  . . 3.830 2.175 2.007 2.550     .  0 0 "[    .    1    .    2]" 1 
       1062 1 46 GLN HA   1 46 GLN HG3  . . 4.040 3.406 2.967 3.676     .  0 0 "[    .    1    .    2]" 1 
       1063 1 46 GLN HA   1 53 LYS QE   . . 4.690 3.227 2.632 3.930     .  0 0 "[    .    1    .    2]" 1 
       1064 1 46 GLN QB   1 47 ARG H    . . 3.720 3.329 3.105 3.459     .  0 0 "[    .    1    .    2]" 1 
       1065 1 46 GLN QB   1 47 ARG HA   . . 4.360 4.024 3.949 4.079     .  0 0 "[    .    1    .    2]" 1 
       1066 1 46 GLN QB   1 47 ARG HG3  . . 3.990 3.717 3.491 3.975     .  0 0 "[    .    1    .    2]" 1 
       1067 1 46 GLN HG2  1 47 ARG H    . . 5.270 4.951 4.690 5.197     .  0 0 "[    .    1    .    2]" 1 
       1068 1 47 ARG H    1 47 ARG HB2  . . 3.910 2.320 2.175 2.455     .  0 0 "[    .    1    .    2]" 1 
       1069 1 47 ARG H    1 47 ARG HB3  . . 3.680 3.550 3.464 3.613     .  0 0 "[    .    1    .    2]" 1 
       1070 1 47 ARG H    1 47 ARG HD2  . . 4.850 4.493 3.946 4.844     .  0 0 "[    .    1    .    2]" 1 
       1071 1 47 ARG H    1 47 ARG HD3  . . 4.850 4.262 3.862 4.875 0.025  7 0 "[    .    1    .    2]" 1 
       1072 1 47 ARG H    1 47 ARG HG2  . . 3.970 3.856 3.383 4.008 0.038 19 0 "[    .    1    .    2]" 1 
       1073 1 47 ARG H    1 47 ARG HG3  . . 3.350 2.711 2.354 2.905     .  0 0 "[    .    1    .    2]" 1 
       1074 1 47 ARG H    1 48 ILE H    . . 3.660 2.404 2.212 2.584     .  0 0 "[    .    1    .    2]" 1 
       1075 1 47 ARG H    1 48 ILE HA   . . 5.090 4.962 4.806 5.120 0.030 19 0 "[    .    1    .    2]" 1 
       1076 1 47 ARG H    1 48 ILE HG12 . . 5.340 3.282 3.134 3.503     .  0 0 "[    .    1    .    2]" 1 
       1077 1 47 ARG H    1 48 ILE MG   . . 4.620 4.158 3.946 4.420     .  0 0 "[    .    1    .    2]" 1 
       1078 1 47 ARG HA   1 47 ARG HD3  . . 4.560 4.496 4.147 4.577 0.017 11 0 "[    .    1    .    2]" 1 
       1079 1 47 ARG HA   1 47 ARG HG2  . . 3.410 2.489 2.190 2.703     .  0 0 "[    .    1    .    2]" 1 
       1080 1 47 ARG HA   1 47 ARG HG3  . . 3.220 2.832 2.627 3.158     .  0 0 "[    .    1    .    2]" 1 
       1081 1 47 ARG HB2  1 47 ARG HD3  . . 3.720 2.410 2.145 3.007     .  0 0 "[    .    1    .    2]" 1 
       1082 1 47 ARG HB2  1 48 ILE H    . . 4.770 2.471 2.223 2.688     .  0 0 "[    .    1    .    2]" 1 
       1083 1 47 ARG HB2  1 48 ILE MG   . . 4.690 3.478 3.368 3.692     .  0 0 "[    .    1    .    2]" 1 
       1084 1 47 ARG HB3  1 47 ARG HD3  . . 4.150 2.703 2.132 2.924     .  0 0 "[    .    1    .    2]" 1 
       1085 1 47 ARG HB3  1 48 ILE H    . . 4.390 3.349 3.066 3.591     .  0 0 "[    .    1    .    2]" 1 
       1086 1 47 ARG HD3  1 47 ARG HG3  . . 3.030 2.783 2.610 3.059 0.029  7 0 "[    .    1    .    2]" 1 
       1087 1 47 ARG HG2  1 48 ILE H    . . 5.500 4.989 4.855 5.112     .  0 0 "[    .    1    .    2]" 1 
       1088 1 48 ILE H    1 48 ILE HB   . . 4.050 3.533 3.520 3.543     .  0 0 "[    .    1    .    2]" 1 
       1089 1 48 ILE H    1 48 ILE MD   . . 4.410 3.559 3.473 3.622     .  0 0 "[    .    1    .    2]" 1 
       1090 1 48 ILE H    1 48 ILE HG12 . . 3.590 1.941 1.923 2.009     .  0 0 "[    .    1    .    2]" 1 
       1091 1 48 ILE H    1 48 ILE HG13 . . 4.850 3.021 2.723 3.233     .  0 0 "[    .    1    .    2]" 1 
       1092 1 48 ILE H    1 48 ILE MG   . . 3.340 2.295 2.171 2.457     .  0 0 "[    .    1    .    2]" 1 
       1093 1 48 ILE H    1 49 SER H    . . 4.870 4.644 4.592 4.675     .  0 0 "[    .    1    .    2]" 1 
       1094 1 48 ILE HA   1 48 ILE MD   . . 4.120 4.120 4.112 4.137 0.017 18 0 "[    .    1    .    2]" 1 
       1095 1 48 ILE HA   1 48 ILE HG13 . . 4.010 3.739 3.686 3.781     .  0 0 "[    .    1    .    2]" 1 
       1096 1 48 ILE HA   1 48 ILE MG   . . 3.170 2.246 2.072 2.301     .  0 0 "[    .    1    .    2]" 1 
       1097 1 48 ILE HA   1 49 SER H    . . 3.050 2.555 2.427 2.686     .  0 0 "[    .    1    .    2]" 1 
       1098 1 48 ILE HB   1 48 ILE MD   . . 3.480 2.274 2.138 2.389     .  0 0 "[    .    1    .    2]" 1 
       1099 1 48 ILE HB   1 49 SER H    . . 3.480 2.307 2.057 2.575     .  0 0 "[    .    1    .    2]" 1 
       1100 1 48 ILE HB   1 52 GLN H    . . 5.210 3.996 3.844 4.267     .  0 0 "[    .    1    .    2]" 1 
       1101 1 48 ILE HB   1 52 GLN HB2  . . 3.950 2.086 1.977 2.562     .  0 0 "[    .    1    .    2]" 1 
       1102 1 48 ILE HB   1 52 GLN HB3  . . 4.040 2.476 1.989 2.817     .  0 0 "[    .    1    .    2]" 1 
       1103 1 48 ILE HB   1 52 GLN QG   . . 4.620 2.592 2.036 3.723     .  0 0 "[    .    1    .    2]" 1 
       1104 1 48 ILE MD   1 48 ILE MG   . . 2.960 2.001 1.879 2.174     .  0 0 "[    .    1    .    2]" 1 
       1105 1 48 ILE MD   1 49 SER H    . . 4.590 4.152 3.711 4.507     .  0 0 "[    .    1    .    2]" 1 
       1106 1 48 ILE MD   1 52 GLN H    . . 5.270 4.560 4.267 4.952     .  0 0 "[    .    1    .    2]" 1 
       1107 1 48 ILE MD   1 52 GLN HB2  . . 3.610 2.896 2.043 3.414     .  0 0 "[    .    1    .    2]" 1 
       1108 1 48 ILE MD   1 52 GLN HB3  . . 3.890 1.932 1.784 2.135     .  0 0 "[    .    1    .    2]" 1 
       1109 1 48 ILE MD   1 52 GLN HE21 . . 5.500 4.634 4.011 5.320     .  0 0 "[    .    1    .    2]" 1 
       1110 1 48 ILE MD   1 52 GLN QG   . . 4.620 2.761 1.903 3.659     .  0 0 "[    .    1    .    2]" 1 
       1111 1 48 ILE MD   1 53 LYS H    . . 4.180 2.924 2.722 3.475     .  0 0 "[    .    1    .    2]" 1 
       1112 1 48 ILE MD   1 53 LYS HA   . . 3.870 3.141 2.878 3.586     .  0 0 "[    .    1    .    2]" 1 
       1113 1 48 ILE MD   1 53 LYS HB3  . . 4.950 4.366 4.085 4.758     .  0 0 "[    .    1    .    2]" 1 
       1114 1 48 ILE MD   1 53 LYS QE   . . 4.950 2.914 1.941 3.452     .  0 0 "[    .    1    .    2]" 1 
       1115 1 48 ILE MD   1 53 LYS HG3  . . 4.320 2.404 1.967 4.292     .  0 0 "[    .    1    .    2]" 1 
       1116 1 48 ILE MD   1 56 TYR QD   . . 4.040 2.732 2.533 3.049     .  0 0 "[    .    1    .    2]" 1 
       1117 1 48 ILE MD   1 56 TYR QE   . . 3.570 2.562 2.139 3.140     .  0 0 "[    .    1    .    2]" 1 
       1118 1 48 ILE HG12 1 48 ILE MG   . . 3.470 2.455 2.329 2.529     .  0 0 "[    .    1    .    2]" 1 
       1119 1 48 ILE HG12 1 49 SER H    . . 4.830 4.757 4.509 4.987 0.157 13 0 "[    .    1    .    2]" 1 
       1120 1 48 ILE HG12 1 53 LYS H    . . 5.340 5.228 4.922 5.839 0.499 10 0 "[    .    1    .    2]" 1 
       1121 1 48 ILE MG   1 49 SER H    . . 3.630 3.515 3.404 3.604     .  0 0 "[    .    1    .    2]" 1 
       1122 1 48 ILE MG   1 52 GLN H    . . 5.060 5.003 4.899 5.102 0.042  5 0 "[    .    1    .    2]" 1 
       1123 1 48 ILE MG   1 52 GLN HB2  . . 3.750 3.321 3.217 3.401     .  0 0 "[    .    1    .    2]" 1 
       1124 1 48 ILE MG   1 52 GLN HB3  . . 3.890 3.189 2.907 3.432     .  0 0 "[    .    1    .    2]" 1 
       1125 1 48 ILE MG   1 52 GLN HE21 . . 5.340 3.636 2.018 4.707     .  0 0 "[    .    1    .    2]" 1 
       1126 1 48 ILE MG   1 52 GLN HE22 . . 4.990 4.233 2.320 5.137 0.147 20 0 "[    .    1    .    2]" 1 
       1127 1 48 ILE MG   1 52 GLN QG   . . 4.690 2.260 1.908 3.171     .  0 0 "[    .    1    .    2]" 1 
       1128 1 48 ILE MG   1 56 TYR QD   . . 4.850 4.523 4.147 4.863 0.013  1 0 "[    .    1    .    2]" 1 
       1129 1 48 ILE MG   1 56 TYR QE   . . 4.550 3.134 2.746 3.599     .  0 0 "[    .    1    .    2]" 1 
       1130 1 49 SER H    1 49 SER HB2  . . 4.090 2.411 2.202 3.699     .  0 0 "[    .    1    .    2]" 1 
       1131 1 49 SER H    1 49 SER HB3  . . 3.560 3.358 2.839 3.689 0.129  9 0 "[    .    1    .    2]" 1 
       1132 1 49 SER H    1 50 GLN H    . . 5.090 4.438 4.361 4.563     .  0 0 "[    .    1    .    2]" 1 
       1133 1 49 SER H    1 52 GLN H    . . 4.950 3.395 3.209 3.610     .  0 0 "[    .    1    .    2]" 1 
       1134 1 49 SER H    1 52 GLN HB2  . . 3.870 2.605 2.131 2.743     .  0 0 "[    .    1    .    2]" 1 
       1135 1 49 SER H    1 52 GLN HB3  . . 4.040 3.977 3.468 4.087 0.047 16 0 "[    .    1    .    2]" 1 
       1136 1 49 SER H    1 52 GLN QG   . . 4.450 3.629 2.033 4.317     .  0 0 "[    .    1    .    2]" 1 
       1137 1 49 SER HA   1 50 GLN H    . . 3.510 2.727 2.518 2.857     .  0 0 "[    .    1    .    2]" 1 
       1138 1 49 SER HA   1 52 GLN H    . . 5.350 5.006 4.581 5.357 0.007  2 0 "[    .    1    .    2]" 1 
       1139 1 49 SER HB2  1 50 GLN H    . . 4.120 3.520 2.485 4.012     .  0 0 "[    .    1    .    2]" 1 
       1140 1 49 SER HB2  1 51 SER H    . . 4.370 3.934 3.266 4.562 0.192  6 0 "[    .    1    .    2]" 1 
       1141 1 49 SER HB3  1 50 GLN H    . . 4.510 2.245 1.942 3.882     .  0 0 "[    .    1    .    2]" 1 
       1142 1 49 SER HB3  1 51 SER H    . . 5.040 3.003 2.701 4.913     .  0 0 "[    .    1    .    2]" 1 
       1143 1 49 SER HB3  1 52 GLN H    . . 5.040 4.065 3.512 4.778     .  0 0 "[    .    1    .    2]" 1 
       1144 1 50 GLN H    1 50 GLN HB2  . . 3.840 2.405 2.274 2.523     .  0 0 "[    .    1    .    2]" 1 
       1145 1 50 GLN H    1 50 GLN HB3  . . 3.960 2.556 2.425 2.758     .  0 0 "[    .    1    .    2]" 1 
       1146 1 50 GLN H    1 50 GLN QG   . . 4.510 4.026 3.977 4.056     .  0 0 "[    .    1    .    2]" 1 
       1147 1 50 GLN H    1 51 SER H    . . 4.320 2.889 2.637 3.152     .  0 0 "[    .    1    .    2]" 1 
       1148 1 50 GLN H    1 52 GLN H    . . 5.500 4.576 4.224 4.920     .  0 0 "[    .    1    .    2]" 1 
       1149 1 50 GLN HA   1 50 GLN HE21 . . 5.420 2.414 2.264 2.701     .  0 0 "[    .    1    .    2]" 1 
       1150 1 50 GLN HA   1 50 GLN HE22 . . 5.500 3.002 2.853 3.384     .  0 0 "[    .    1    .    2]" 1 
       1151 1 50 GLN HA   1 50 GLN QG   . . 3.670 2.984 2.893 3.031     .  0 0 "[    .    1    .    2]" 1 
       1152 1 50 GLN HA   1 53 LYS H    . . 4.150 3.674 3.265 3.950     .  0 0 "[    .    1    .    2]" 1 
       1153 1 50 GLN HA   1 53 LYS HB3  . . 4.320 4.341 4.141 4.617 0.297 13 0 "[    .    1    .    2]" 1 
       1154 1 50 GLN HA   1 53 LYS QD   . . 3.910 3.215 2.778 4.032 0.122 10 0 "[    .    1    .    2]" 1 
       1155 1 50 GLN HA   1 54 GLU H    . . 4.540 3.684 3.412 3.995     .  0 0 "[    .    1    .    2]" 1 
       1156 1 50 GLN HB2  1 50 GLN HE22 . . 5.500 4.442 4.354 4.496     .  0 0 "[    .    1    .    2]" 1 
       1157 1 50 GLN HB2  1 51 SER H    . . 4.470 3.787 3.645 3.853     .  0 0 "[    .    1    .    2]" 1 
       1158 1 50 GLN HB3  1 51 SER H    . . 4.210 2.417 2.259 2.503     .  0 0 "[    .    1    .    2]" 1 
       1159 1 50 GLN HB3  1 54 GLU H    . . 5.270 5.242 5.084 5.345 0.075 10 0 "[    .    1    .    2]" 1 
       1160 1 50 GLN HE21 1 52 GLN H    . . 5.340 5.178 4.916 5.359 0.019 10 0 "[    .    1    .    2]" 1 
       1161 1 50 GLN HE21 1 54 GLU HG2  . . 4.950 2.244 1.987 2.638     .  0 0 "[    .    1    .    2]" 1 
       1162 1 50 GLN HE21 1 54 GLU HG3  . . 4.950 2.742 2.396 3.138     .  0 0 "[    .    1    .    2]" 1 
       1163 1 50 GLN HE22 1 53 LYS HB2  . . 5.150 2.382 2.172 2.666     .  0 0 "[    .    1    .    2]" 1 
       1164 1 50 GLN HE22 1 53 LYS QD   . . 5.500 3.530 3.175 5.088     .  0 0 "[    .    1    .    2]" 1 
       1165 1 50 GLN QG   1 51 SER H    . . 4.620 3.500 3.235 3.547     .  0 0 "[    .    1    .    2]" 1 
       1166 1 50 GLN QG   1 51 SER HA   . . 4.040 3.586 3.332 3.698     .  0 0 "[    .    1    .    2]" 1 
       1167 1 50 GLN QG   1 51 SER QB   . . 4.690 4.675 4.451 4.712 0.022 15 0 "[    .    1    .    2]" 1 
       1168 1 50 GLN QG   1 54 GLU H    . . 5.060 3.735 3.423 3.989     .  0 0 "[    .    1    .    2]" 1 
       1169 1 51 SER H    1 51 SER QB   . . 3.640 2.206 2.069 2.247     .  0 0 "[    .    1    .    2]" 1 
       1170 1 51 SER H    1 52 GLN H    . . 4.070 3.144 2.982 3.288     .  0 0 "[    .    1    .    2]" 1 
       1171 1 51 SER HA   1 54 GLU H    . . 4.100 3.783 3.527 3.944     .  0 0 "[    .    1    .    2]" 1 
       1172 1 51 SER HA   1 54 GLU HB2  . . 3.630 2.554 2.379 2.811     .  0 0 "[    .    1    .    2]" 1 
       1173 1 51 SER HA   1 54 GLU HB3  . . 3.910 3.797 3.560 4.009 0.099 10 0 "[    .    1    .    2]" 1 
       1174 1 51 SER HA   1 54 GLU HG3  . . 4.510 3.781 3.348 4.370     .  0 0 "[    .    1    .    2]" 1 
       1175 1 51 SER QB   1 52 GLN H    . . 3.880 2.385 2.050 2.756     .  0 0 "[    .    1    .    2]" 1 
       1176 1 51 SER QB   1 52 GLN HB2  . . 4.620 4.172 3.864 4.634 0.014  4 0 "[    .    1    .    2]" 1 
       1177 1 52 GLN H    1 52 GLN HB2  . . 3.890 2.124 2.021 2.463     .  0 0 "[    .    1    .    2]" 1 
       1178 1 52 GLN H    1 52 GLN HB3  . . 3.520 3.333 3.159 3.554 0.034  4 0 "[    .    1    .    2]" 1 
       1179 1 52 GLN H    1 52 GLN QG   . . 3.950 3.386 2.205 3.863     .  0 0 "[    .    1    .    2]" 1 
       1180 1 52 GLN H    1 53 LYS H    . . 3.290 3.086 2.803 3.293 0.003  1 0 "[    .    1    .    2]" 1 
       1181 1 52 GLN H    1 54 GLU H    . . 4.790 4.087 3.750 4.366     .  0 0 "[    .    1    .    2]" 1 
       1182 1 52 GLN H    1 55 HIS HB2  . . 5.500 5.299 5.016 5.527 0.027 18 0 "[    .    1    .    2]" 1 
       1183 1 52 GLN H    1 55 HIS HB3  . . 5.500 5.193 4.909 5.511 0.011 18 0 "[    .    1    .    2]" 1 
       1184 1 52 GLN HA   1 52 GLN HE21 . . 5.340 3.731 2.074 5.060     .  0 0 "[    .    1    .    2]" 1 
       1185 1 52 GLN HA   1 52 GLN QG   . . 3.600 2.450 1.964 2.604     .  0 0 "[    .    1    .    2]" 1 
       1186 1 52 GLN HA   1 55 HIS H    . . 3.830 3.416 3.265 3.627     .  0 0 "[    .    1    .    2]" 1 
       1187 1 52 GLN HA   1 55 HIS HB2  . . 3.580 3.513 3.257 3.732 0.152 16 0 "[    .    1    .    2]" 1 
       1188 1 52 GLN HA   1 55 HIS HB3  . . 3.720 2.786 2.589 3.033     .  0 0 "[    .    1    .    2]" 1 
       1189 1 52 GLN HA   1 56 TYR H    . . 4.730 3.670 3.339 4.031     .  0 0 "[    .    1    .    2]" 1 
       1190 1 52 GLN HB2  1 53 LYS H    . . 4.180 2.707 2.165 3.117     .  0 0 "[    .    1    .    2]" 1 
       1191 1 52 GLN HB2  1 56 TYR QD   . . 4.800 4.460 3.459 4.824 0.024 18 0 "[    .    1    .    2]" 1 
       1192 1 52 GLN HB2  1 56 TYR QE   . . 5.250 4.388 3.728 4.873     .  0 0 "[    .    1    .    2]" 1 
       1193 1 52 GLN HB3  1 53 LYS H    . . 3.890 2.459 2.144 3.363     .  0 0 "[    .    1    .    2]" 1 
       1194 1 52 GLN HE21 1 56 TYR QE   . . 5.420 4.134 3.272 5.434 0.014 17 0 "[    .    1    .    2]" 1 
       1195 1 52 GLN QG   1 53 LYS H    . . 4.360 4.036 3.888 4.220     .  0 0 "[    .    1    .    2]" 1 
       1196 1 52 GLN QG   1 56 TYR QD   . . 4.800 3.490 2.750 4.367     .  0 0 "[    .    1    .    2]" 1 
       1197 1 52 GLN QG   1 56 TYR QE   . . 4.320 2.488 1.956 3.768     .  0 0 "[    .    1    .    2]" 1 
       1198 1 53 LYS H    1 53 LYS HB2  . . 3.780 2.545 2.452 2.838     .  0 0 "[    .    1    .    2]" 1 
       1199 1 53 LYS H    1 53 LYS HB3  . . 4.160 3.547 3.486 3.556     .  0 0 "[    .    1    .    2]" 1 
       1200 1 53 LYS H    1 53 LYS QD   . . 4.390 3.520 1.907 3.926     .  0 0 "[    .    1    .    2]" 1 
       1201 1 53 LYS H    1 53 LYS HG2  . . 3.830 3.160 1.897 3.399     .  0 0 "[    .    1    .    2]" 1 
       1202 1 53 LYS H    1 53 LYS HG3  . . 4.470 2.064 1.931 3.304     .  0 0 "[    .    1    .    2]" 1 
       1203 1 53 LYS H    1 54 GLU H    . . 3.610 2.961 2.834 3.064     .  0 0 "[    .    1    .    2]" 1 
       1204 1 53 LYS H    1 54 GLU HB2  . . 4.950 4.822 4.709 4.873     .  0 0 "[    .    1    .    2]" 1 
       1205 1 53 LYS H    1 55 HIS H    . . 4.790 4.591 4.304 4.789     .  0 0 "[    .    1    .    2]" 1 
       1206 1 53 LYS HA   1 53 LYS QD   . . 4.360 3.879 1.888 4.071     .  0 0 "[    .    1    .    2]" 1 
       1207 1 53 LYS HA   1 53 LYS QE   . . 4.850 4.412 3.819 4.542     .  0 0 "[    .    1    .    2]" 1 
       1208 1 53 LYS HA   1 53 LYS HG2  . . 4.060 2.528 2.291 3.560     .  0 0 "[    .    1    .    2]" 1 
       1209 1 53 LYS HA   1 53 LYS HG3  . . 3.990 2.963 2.735 3.723     .  0 0 "[    .    1    .    2]" 1 
       1210 1 53 LYS HA   1 56 TYR H    . . 4.450 3.975 3.616 4.199     .  0 0 "[    .    1    .    2]" 1 
       1211 1 53 LYS HA   1 56 TYR HB2  . . 3.910 2.729 2.556 2.990     .  0 0 "[    .    1    .    2]" 1 
       1212 1 53 LYS HA   1 56 TYR HB3  . . 4.410 4.146 3.957 4.413 0.003 10 0 "[    .    1    .    2]" 1 
       1213 1 53 LYS HA   1 56 TYR QD   . . 4.180 2.853 2.316 3.277     .  0 0 "[    .    1    .    2]" 1 
       1214 1 53 LYS HB2  1 53 LYS QD   . . 3.820 2.465 2.278 3.301     .  0 0 "[    .    1    .    2]" 1 
       1215 1 53 LYS HB2  1 53 LYS QE   . . 4.950 4.131 3.960 4.433     .  0 0 "[    .    1    .    2]" 1 
       1216 1 53 LYS HB2  1 54 GLU H    . . 3.870 2.700 2.510 2.847     .  0 0 "[    .    1    .    2]" 1 
       1217 1 53 LYS HB2  1 54 GLU HG2  . . 4.950 4.214 3.505 4.460     .  0 0 "[    .    1    .    2]" 1 
       1218 1 53 LYS HB3  1 53 LYS QD   . . 3.830 2.416 2.275 2.629     .  0 0 "[    .    1    .    2]" 1 
       1219 1 53 LYS HB3  1 54 GLU H    . . 4.290 3.695 3.509 4.012     .  0 0 "[    .    1    .    2]" 1 
       1220 1 53 LYS HB3  1 54 GLU HG2  . . 4.850 4.844 4.723 4.961 0.111 13 0 "[    .    1    .    2]" 1 
       1221 1 53 LYS QD   1 54 GLU H    . . 5.090 4.728 4.236 4.964     .  0 0 "[    .    1    .    2]" 1 
       1222 1 53 LYS HG2  1 54 GLU H    . . 5.210 5.011 3.810 5.221 0.011 11 0 "[    .    1    .    2]" 1 
       1223 1 53 LYS HG3  1 54 GLU H    . . 5.500 4.432 4.266 4.942     .  0 0 "[    .    1    .    2]" 1 
       1224 1 54 GLU H    1 54 GLU HB2  . . 3.350 2.130 2.091 2.246     .  0 0 "[    .    1    .    2]" 1 
       1225 1 54 GLU H    1 54 GLU HB3  . . 3.490 3.430 3.394 3.502 0.012 10 0 "[    .    1    .    2]" 1 
       1226 1 54 GLU H    1 54 GLU HG2  . . 3.770 3.040 2.685 3.196     .  0 0 "[    .    1    .    2]" 1 
       1227 1 54 GLU H    1 54 GLU HG3  . . 3.630 3.566 3.306 3.647 0.017 17 0 "[    .    1    .    2]" 1 
       1228 1 54 GLU H    1 55 HIS H    . . 3.610 2.843 2.740 2.909     .  0 0 "[    .    1    .    2]" 1 
       1229 1 54 GLU H    1 55 HIS HA   . . 5.340 5.327 5.245 5.375 0.035 20 0 "[    .    1    .    2]" 1 
       1230 1 54 GLU H    1 55 HIS HB2  . . 5.420 5.074 4.891 5.160     .  0 0 "[    .    1    .    2]" 1 
       1231 1 54 GLU H    1 55 HIS HB3  . . 5.190 4.975 4.802 5.132     .  0 0 "[    .    1    .    2]" 1 
       1232 1 54 GLU H    1 56 TYR H    . . 4.590 4.592 4.487 4.639 0.049 20 0 "[    .    1    .    2]" 1 
       1233 1 54 GLU HA   1 54 GLU HG2  . . 3.850 2.224 2.098 2.421     .  0 0 "[    .    1    .    2]" 1 
       1234 1 54 GLU HA   1 56 TYR H    . . 5.210 5.082 4.917 5.250 0.040 14 0 "[    .    1    .    2]" 1 
       1235 1 54 GLU HA   1 57 LYS H    . . 3.990 3.658 3.427 4.020 0.030 19 0 "[    .    1    .    2]" 1 
       1236 1 54 GLU HA   1 57 LYS HB3  . . 3.630 2.576 2.243 3.529     .  0 0 "[    .    1    .    2]" 1 
       1237 1 54 GLU HA   1 57 LYS QE   . . 4.250 3.120 2.568 4.248     .  0 0 "[    .    1    .    2]" 1 
       1238 1 54 GLU HB2  1 55 HIS H    . . 4.180 2.678 2.518 2.918     .  0 0 "[    .    1    .    2]" 1 
       1239 1 55 HIS H    1 55 HIS HB2  . . 3.430 2.350 2.243 2.423     .  0 0 "[    .    1    .    2]" 1 
       1240 1 55 HIS H    1 55 HIS HB3  . . 3.400 2.566 2.486 2.686     .  0 0 "[    .    1    .    2]" 1 
       1241 1 55 HIS H    1 55 HIS HD2  . . 5.190 5.237 5.157 5.329 0.139 15 0 "[    .    1    .    2]" 1 
       1242 1 55 HIS H    1 56 TYR H    . . 3.600 3.048 2.862 3.183     .  0 0 "[    .    1    .    2]" 1 
       1243 1 55 HIS H    1 56 TYR QD   . . 5.420 5.111 4.856 5.427 0.007 12 0 "[    .    1    .    2]" 1 
       1244 1 55 HIS H    1 57 LYS H    . . 5.090 4.162 3.810 4.520     .  0 0 "[    .    1    .    2]" 1 
       1245 1 55 HIS HA   1 57 LYS H    . . 5.500 4.435 3.796 5.134     .  0 0 "[    .    1    .    2]" 1 
       1246 1 55 HIS HA   1 58 LYS H    . . 4.210 3.364 3.031 3.695     .  0 0 "[    .    1    .    2]" 1 
       1247 1 55 HIS HA   1 58 LYS HB2  . . 4.180 3.940 3.728 4.278 0.098 15 0 "[    .    1    .    2]" 1 
       1248 1 55 HIS HA   1 58 LYS HB3  . . 3.850 2.646 2.322 3.129     .  0 0 "[    .    1    .    2]" 1 
       1249 1 55 HIS HA   1 58 LYS QD   . . 4.560 3.828 2.800 4.336     .  0 0 "[    .    1    .    2]" 1 
       1250 1 55 HIS HA   1 58 LYS HG2  . . 5.500 4.942 2.157 5.587 0.087 11 0 "[    .    1    .    2]" 1 
       1251 1 55 HIS HB2  1 56 TYR H    . . 3.700 3.661 3.529 3.747 0.047  1 0 "[    .    1    .    2]" 1 
       1252 1 55 HIS HB3  1 56 TYR H    . . 4.090 2.200 2.081 2.323     .  0 0 "[    .    1    .    2]" 1 
       1253 1 55 HIS HD2  1 56 TYR H    . . 4.700 3.870 3.420 4.267     .  0 0 "[    .    1    .    2]" 1 
       1254 1 55 HIS HD2  1 56 TYR HA   . . 4.900 4.217 3.287 4.933 0.033 12 0 "[    .    1    .    2]" 1 
       1255 1 55 HIS HD2  1 56 TYR QD   . . 4.620 4.271 3.741 4.613     .  0 0 "[    .    1    .    2]" 1 
       1256 1 55 HIS HD2  1 56 TYR QE   . . 4.620 4.403 4.045 4.611     .  0 0 "[    .    1    .    2]" 1 
       1257 1 55 HIS HD2  1 59 LEU QD   . . 4.150 2.494 1.831 2.883     .  0 0 "[    .    1    .    2]" 1 
       1258 1 55 HIS HD2  1 59 LEU HG   . . 4.900 4.217 3.100 4.902 0.002 10 0 "[    .    1    .    2]" 1 
       1259 1 55 HIS HE1  1 59 LEU QD   . . 3.770 2.634 2.064 3.310     .  0 0 "[    .    1    .    2]" 1 
       1260 1 55 HIS HE1  1 59 LEU HG   . . 4.800 4.116 3.465 4.800     .  0 0 "[    .    1    .    2]" 1 
       1261 1 56 TYR H    1 56 TYR HB2  . . 3.670 2.230 2.168 2.311     .  0 0 "[    .    1    .    2]" 1 
       1262 1 56 TYR H    1 56 TYR HB3  . . 3.530 3.440 3.422 3.474     .  0 0 "[    .    1    .    2]" 1 
       1263 1 56 TYR H    1 56 TYR QD   . . 3.830 3.036 2.843 3.158     .  0 0 "[    .    1    .    2]" 1 
       1264 1 56 TYR H    1 56 TYR QE   . . 4.550 4.606 4.550 4.660 0.110 10 0 "[    .    1    .    2]" 1 
       1265 1 56 TYR H    1 57 LYS H    . . 3.420 2.932 2.754 3.039     .  0 0 "[    .    1    .    2]" 1 
       1266 1 56 TYR H    1 57 LYS HB3  . . 5.500 5.015 4.781 5.212     .  0 0 "[    .    1    .    2]" 1 
       1267 1 56 TYR H    1 59 LEU HB2  . . 5.210 5.012 4.762 5.185     .  0 0 "[    .    1    .    2]" 1 
       1268 1 56 TYR H    1 59 LEU QD   . . 5.500 3.704 3.107 4.283     .  0 0 "[    .    1    .    2]" 1 
       1269 1 56 TYR H    1 59 LEU HG   . . 5.500 4.841 4.464 5.610 0.110 13 0 "[    .    1    .    2]" 1 
       1270 1 56 TYR HA   1 56 TYR QD   . . 3.640 2.156 1.949 2.434     .  0 0 "[    .    1    .    2]" 1 
       1271 1 56 TYR HA   1 56 TYR QE   . . 4.320 4.373 4.300 4.444 0.124  3 0 "[    .    1    .    2]" 1 
       1272 1 56 TYR HA   1 59 LEU H    . . 4.450 3.332 2.955 3.669     .  0 0 "[    .    1    .    2]" 1 
       1273 1 56 TYR HA   1 59 LEU HB2  . . 3.780 2.566 2.183 2.714     .  0 0 "[    .    1    .    2]" 1 
       1274 1 56 TYR HA   1 59 LEU HB3  . . 4.210 4.159 3.798 4.288 0.078 15 0 "[    .    1    .    2]" 1 
       1275 1 56 TYR HA   1 59 LEU QD   . . 3.890 2.245 1.885 2.938     .  0 0 "[    .    1    .    2]" 1 
       1276 1 56 TYR HA   1 59 LEU HG   . . 3.780 3.431 3.077 3.804 0.024 14 0 "[    .    1    .    2]" 1 
       1277 1 56 TYR HB2  1 57 LYS H    . . 4.540 2.533 2.136 2.911     .  0 0 "[    .    1    .    2]" 1 
       1278 1 56 TYR HB2  1 58 LYS H    . . 5.500 4.852 4.547 5.176     .  0 0 "[    .    1    .    2]" 1 
       1279 1 56 TYR HB3  1 57 LYS H    . . 3.870 3.316 2.859 3.769     .  0 0 "[    .    1    .    2]" 1 
       1280 1 56 TYR HB3  1 60 ALA H    . . 5.500 4.876 4.556 5.355     .  0 0 "[    .    1    .    2]" 1 
       1281 1 56 TYR HB3  1 60 ALA MB   . . 4.950 4.544 4.171 4.970 0.020 17 0 "[    .    1    .    2]" 1 
       1282 1 56 TYR QD   1 57 LYS H    . . 5.270 4.389 4.116 4.634     .  0 0 "[    .    1    .    2]" 1 
       1283 1 56 TYR QD   1 59 LEU QD   . . 4.410 2.823 2.420 3.193     .  0 0 "[    .    1    .    2]" 1 
       1284 1 56 TYR QD   1 59 LEU HG   . . 4.900 4.664 3.508 5.023 0.123 17 0 "[    .    1    .    2]" 1 
       1285 1 56 TYR QE   1 59 LEU QD   . . 4.230 3.897 3.621 4.312 0.082 12 0 "[    .    1    .    2]" 1 
       1286 1 57 LYS H    1 57 LYS HB2  . . 3.700 2.632 2.380 3.387     .  0 0 "[    .    1    .    2]" 1 
       1287 1 57 LYS H    1 57 LYS HB3  . . 3.280 2.370 2.080 2.540     .  0 0 "[    .    1    .    2]" 1 
       1288 1 57 LYS H    1 57 LYS QE   . . 4.850 4.554 4.373 4.834     .  0 0 "[    .    1    .    2]" 1 
       1289 1 57 LYS H    1 57 LYS HG2  . . 4.450 4.299 3.049 4.528 0.078  6 0 "[    .    1    .    2]" 1 
       1290 1 57 LYS H    1 57 LYS HG3  . . 4.670 4.388 4.093 4.550     .  0 0 "[    .    1    .    2]" 1 
       1291 1 57 LYS HA   1 57 LYS QE   . . 4.690 4.496 3.516 4.692 0.002  2 0 "[    .    1    .    2]" 1 
       1292 1 57 LYS HA   1 57 LYS HG2  . . 3.870 3.416 3.103 3.740     .  0 0 "[    .    1    .    2]" 1 
       1293 1 57 LYS HA   1 57 LYS HG3  . . 3.930 2.533 2.305 3.527     .  0 0 "[    .    1    .    2]" 1 
       1294 1 57 LYS HA   1 60 ALA H    . . 4.200 3.585 3.199 3.994     .  0 0 "[    .    1    .    2]" 1 
       1295 1 57 LYS HA   1 60 ALA MB   . . 3.570 2.703 2.307 3.246     .  0 0 "[    .    1    .    2]" 1 
       1296 1 57 LYS HB2  1 57 LYS QE   . . 3.990 2.910 2.053 3.548     .  0 0 "[    .    1    .    2]" 1 
       1297 1 57 LYS HB2  1 58 LYS H    . . 4.090 4.088 3.924 4.243 0.153 20 0 "[    .    1    .    2]" 1 
       1298 1 57 LYS HB3  1 57 LYS QE   . . 3.930 2.625 2.301 3.304     .  0 0 "[    .    1    .    2]" 1 
       1299 1 57 LYS HB3  1 58 LYS H    . . 3.910 2.907 2.603 3.662     .  0 0 "[    .    1    .    2]" 1 
       1300 1 57 LYS QE   1 57 LYS HG3  . . 3.620 3.160 2.187 3.436     .  0 0 "[    .    1    .    2]" 1 
       1301 1 57 LYS HG2  1 61 GLU QG   . . 4.950 3.895 3.273 4.673     .  0 0 "[    .    1    .    2]" 1 
       1302 1 57 LYS HG3  1 61 GLU QG   . . 4.510 3.977 3.293 4.627 0.117 17 0 "[    .    1    .    2]" 1 
       1303 1 58 LYS H    1 58 LYS HB2  . . 3.370 2.948 2.640 3.487 0.117 14 0 "[    .    1    .    2]" 1 
       1304 1 58 LYS H    1 58 LYS HB3  . . 3.290 2.198 2.075 2.309     .  0 0 "[    .    1    .    2]" 1 
       1305 1 58 LYS H    1 58 LYS HG2  . . 4.170 4.245 3.558 4.382 0.212 19 0 "[    .    1    .    2]" 1 
       1306 1 58 LYS H    1 58 LYS HG3  . . 4.560 4.315 2.617 4.649 0.089 12 0 "[    .    1    .    2]" 1 
       1307 1 58 LYS HA   1 58 LYS HB2  . . 2.750 2.315 2.256 2.384     .  0 0 "[    .    1    .    2]" 1 
       1308 1 58 LYS HA   1 58 LYS QD   . . 3.800 3.667 3.362 3.775     .  0 0 "[    .    1    .    2]" 1 
       1309 1 58 LYS HA   1 58 LYS HG2  . . 3.680 2.910 2.497 4.247 0.567 14 3 "[    .    1   +- *  2]" 1 
       1310 1 58 LYS HA   1 58 LYS HG3  . . 3.740 3.643 3.503 3.823 0.083  7 0 "[    .    1    .    2]" 1 
       1311 1 58 LYS HA   1 60 ALA MB   . . 4.770 4.630 4.459 4.801 0.031  7 0 "[    .    1    .    2]" 1 
       1312 1 58 LYS HA   1 61 GLU H    . . 4.000 3.484 3.341 3.900     .  0 0 "[    .    1    .    2]" 1 
       1313 1 58 LYS HA   1 61 GLU HB2  . . 3.950 3.635 3.368 4.817 0.867  2 2 "[ +  . -  1    .    2]" 1 
       1314 1 58 LYS HA   1 61 GLU QG   . . 3.870 2.005 1.894 2.147     .  0 0 "[    .    1    .    2]" 1 
       1315 1 58 LYS QD   1 59 LEU H    . . 4.280 2.493 2.003 3.003     .  0 0 "[    .    1    .    2]" 1 
       1316 1 58 LYS QD   1 59 LEU HA   . . 3.740 2.279 2.148 2.439     .  0 0 "[    .    1    .    2]" 1 
       1317 1 58 LYS QD   1 59 LEU HG   . . 4.360 2.937 1.994 4.025     .  0 0 "[    .    1    .    2]" 1 
       1318 1 58 LYS QD   1 61 GLU QG   . . 5.060 4.556 4.200 4.678     .  0 0 "[    .    1    .    2]" 1 
       1319 1 58 LYS QE   1 58 LYS HG3  . . 3.780 2.569 2.309 2.867     .  0 0 "[    .    1    .    2]" 1 
       1320 1 58 LYS QE   1 59 LEU H    . . 4.620 3.663 2.915 4.378     .  0 0 "[    .    1    .    2]" 1 
       1321 1 58 LYS QE   1 59 LEU HA   . . 4.150 3.800 3.396 4.165 0.015  2 0 "[    .    1    .    2]" 1 
       1322 1 58 LYS QE   1 59 LEU QD   . . 3.620 2.169 1.863 2.563     .  0 0 "[    .    1    .    2]" 1 
       1323 1 58 LYS QE   1 59 LEU HG   . . 4.620 3.022 2.350 4.724 0.104 12 0 "[    .    1    .    2]" 1 
       1324 1 58 LYS HG2  1 59 LEU H    . . 3.890 3.930 3.669 4.019 0.129 14 0 "[    .    1    .    2]" 1 
       1325 1 58 LYS HG3  1 59 LEU H    . . 5.420 4.260 1.933 4.725     .  0 0 "[    .    1    .    2]" 1 
       1326 1 59 LEU H    1 59 LEU HB2  . . 3.620 2.424 2.248 2.573     .  0 0 "[    .    1    .    2]" 1 
       1327 1 59 LEU H    1 59 LEU QD   . . 3.780 2.813 1.839 3.236     .  0 0 "[    .    1    .    2]" 1 
       1328 1 59 LEU H    1 59 LEU HG   . . 3.470 2.529 1.957 3.936 0.466 11 0 "[    .    1    .    2]" 1 
       1329 1 59 LEU HA   1 59 LEU QD   . . 2.950 1.991 1.885 2.226     .  0 0 "[    .    1    .    2]" 1 
       1330 1 59 LEU HA   1 59 LEU HG   . . 3.970 3.124 2.891 3.647     .  0 0 "[    .    1    .    2]" 1 
       1331 1 59 LEU HA   1 62 GLU H    . . 4.210 3.106 2.876 3.668     .  0 0 "[    .    1    .    2]" 1 
       1332 1 59 LEU HA   1 62 GLU HB2  . . 3.830 3.356 2.496 3.836 0.006  7 0 "[    .    1    .    2]" 1 
       1333 1 59 LEU HA   1 62 GLU HB3  . . 3.560 2.693 2.367 3.863 0.303 11 0 "[    .    1    .    2]" 1 
       1334 1 59 LEU HA   1 62 GLU QG   . . 4.120 4.110 3.622 4.191 0.071 20 0 "[    .    1    .    2]" 1 
       1335 1 59 LEU HA   1 63 GLN H    . . 4.560 4.021 3.756 4.355     .  0 0 "[    .    1    .    2]" 1 
       1336 1 59 LEU HB2  1 60 ALA H    . . 3.800 2.562 2.395 2.796     .  0 0 "[    .    1    .    2]" 1 
       1337 1 59 LEU HB2  1 60 ALA HA   . . 4.690 4.329 4.195 4.526     .  0 0 "[    .    1    .    2]" 1 
       1338 1 59 LEU HB3  1 60 ALA H    . . 3.740 3.523 3.079 3.692     .  0 0 "[    .    1    .    2]" 1 
       1339 1 59 LEU HB3  1 62 GLU HB3  . . 4.850 4.196 3.709 5.087 0.237 11 0 "[    .    1    .    2]" 1 
       1340 1 59 LEU QD   1 60 ALA H    . . 4.990 3.976 3.666 4.216     .  0 0 "[    .    1    .    2]" 1 
       1341 1 59 LEU QD   1 62 GLU H    . . 5.500 4.438 4.102 4.887     .  0 0 "[    .    1    .    2]" 1 
       1342 1 59 LEU QD   1 62 GLU HB2  . . 4.360 3.906 3.136 4.336     .  0 0 "[    .    1    .    2]" 1 
       1343 1 59 LEU QD   1 62 GLU HB3  . . 4.770 3.374 2.912 4.163     .  0 0 "[    .    1    .    2]" 1 
       1344 1 59 LEU QD   1 62 GLU QG   . . 4.510 3.795 3.474 4.016     .  0 0 "[    .    1    .    2]" 1 
       1345 1 60 ALA H    1 60 ALA MB   . . 3.070 2.118 2.000 2.181     .  0 0 "[    .    1    .    2]" 1 
       1346 1 60 ALA H    1 61 GLU QG   . . 5.270 4.039 3.774 4.217     .  0 0 "[    .    1    .    2]" 1 
       1347 1 60 ALA H    1 63 GLN HB2  . . 5.190 4.712 4.390 5.205 0.015 19 0 "[    .    1    .    2]" 1 
       1348 1 60 ALA HA   1 63 GLN H    . . 4.090 3.374 3.174 3.641     .  0 0 "[    .    1    .    2]" 1 
       1349 1 60 ALA HA   1 63 GLN HB2  . . 3.970 2.534 2.256 3.445     .  0 0 "[    .    1    .    2]" 1 
       1350 1 60 ALA HA   1 63 GLN HB3  . . 4.210 3.652 1.998 4.057     .  0 0 "[    .    1    .    2]" 1 
       1351 1 60 ALA HA   1 63 GLN HG2  . . 4.850 4.694 3.445 4.865 0.015  3 0 "[    .    1    .    2]" 1 
       1352 1 60 ALA HA   1 63 GLN HG3  . . 4.620 4.083 3.488 4.705 0.085 19 0 "[    .    1    .    2]" 1 
       1353 1 60 ALA HA   1 64 GLN HG3  . . 4.690 4.058 3.443 4.644     .  0 0 "[    .    1    .    2]" 1 
       1354 1 60 ALA MB   1 61 GLU H    . . 3.860 2.552 1.930 2.799     .  0 0 "[    .    1    .    2]" 1 
       1355 1 60 ALA MB   1 61 GLU QG   . . 4.320 3.256 2.940 3.896     .  0 0 "[    .    1    .    2]" 1 
       1356 1 60 ALA MB   1 62 GLU H    . . 4.830 4.511 4.145 4.666     .  0 0 "[    .    1    .    2]" 1 
       1357 1 60 ALA MB   1 63 GLN H    . . 4.950 4.582 4.345 4.861     .  0 0 "[    .    1    .    2]" 1 
       1358 1 60 ALA MB   1 63 GLN HB2  . . 5.190 4.139 3.812 4.938     .  0 0 "[    .    1    .    2]" 1 
       1359 1 60 ALA MB   1 63 GLN HB3  . . 4.950 4.823 3.710 4.974 0.024  8 0 "[    .    1    .    2]" 1 
       1360 1 60 ALA MB   1 64 GLN HE21 . . 4.210 2.739 1.928 3.278     .  0 0 "[    .    1    .    2]" 1 
       1361 1 60 ALA MB   1 64 GLN HE22 . . 4.690 3.244 2.027 4.019     .  0 0 "[    .    1    .    2]" 1 
       1362 1 60 ALA MB   1 64 GLN HG3  . . 5.350 3.944 3.514 4.485     .  0 0 "[    .    1    .    2]" 1 
       1363 1 61 GLU H    1 61 GLU HB2  . . 3.470 2.837 2.701 3.557 0.087  7 0 "[    .    1    .    2]" 1 
       1364 1 61 GLU H    1 61 GLU HB3  . . 3.710 3.411 2.299 3.555     .  0 0 "[    .    1    .    2]" 1 
       1365 1 61 GLU H    1 61 GLU QG   . . 3.660 1.974 1.872 2.473     .  0 0 "[    .    1    .    2]" 1 
       1366 1 61 GLU H    1 62 GLU H    . . 3.460 2.720 2.492 2.982     .  0 0 "[    .    1    .    2]" 1 
       1367 1 61 GLU HA   1 61 GLU QG   . . 3.620 2.825 2.479 3.333     .  0 0 "[    .    1    .    2]" 1 
       1368 1 61 GLU HA   1 64 GLN H    . . 4.690 3.603 3.507 3.764     .  0 0 "[    .    1    .    2]" 1 
       1369 1 61 GLU HA   1 64 GLN HB2  . . 3.560 3.113 2.860 3.341     .  0 0 "[    .    1    .    2]" 1 
       1370 1 61 GLU HA   1 64 GLN HE21 . . 5.060 2.714 1.963 4.111     .  0 0 "[    .    1    .    2]" 1 
       1371 1 61 GLU HA   1 64 GLN HE22 . . 5.190 3.459 2.643 4.172     .  0 0 "[    .    1    .    2]" 1 
       1372 1 61 GLU HA   1 64 GLN HG3  . . 4.850 3.971 3.548 4.322     .  0 0 "[    .    1    .    2]" 1 
       1373 1 61 GLU HA   1 65 ARG H    . . 4.760 4.393 4.120 4.736     .  0 0 "[    .    1    .    2]" 1 
       1374 1 61 GLU HB2  1 62 GLU H    . . 3.720 2.821 2.462 3.944 0.224  2 0 "[    .    1    .    2]" 1 
       1375 1 61 GLU HB3  1 61 GLU QG   . . 2.780 2.434 2.267 2.554     .  0 0 "[    .    1    .    2]" 1 
       1376 1 61 GLU QG   1 62 GLU H    . . 4.620 3.529 1.880 3.869     .  0 0 "[    .    1    .    2]" 1 
       1377 1 62 GLU H    1 62 GLU HB2  . . 3.450 2.601 2.017 2.881     .  0 0 "[    .    1    .    2]" 1 
       1378 1 62 GLU H    1 62 GLU HB3  . . 3.320 2.438 2.205 3.232     .  0 0 "[    .    1    .    2]" 1 
       1379 1 62 GLU H    1 62 GLU QG   . . 3.780 3.871 3.793 3.933 0.153 16 0 "[    .    1    .    2]" 1 
       1380 1 62 GLU H    1 63 GLN H    . . 3.600 2.644 2.487 2.987     .  0 0 "[    .    1    .    2]" 1 
       1381 1 62 GLU H    1 64 GLN H    . . 4.640 4.206 4.014 4.480     .  0 0 "[    .    1    .    2]" 1 
       1382 1 62 GLU HA   1 62 GLU QG   . . 3.460 2.633 2.446 2.903     .  0 0 "[    .    1    .    2]" 1 
       1383 1 62 GLU HA   1 65 ARG H    . . 3.820 3.155 2.990 3.334     .  0 0 "[    .    1    .    2]" 1 
       1384 1 62 GLU HA   1 65 ARG HB2  . . 3.580 3.305 3.130 3.482     .  0 0 "[    .    1    .    2]" 1 
       1385 1 62 GLU HA   1 65 ARG HB3  . . 3.910 2.049 1.987 2.132     .  0 0 "[    .    1    .    2]" 1 
       1386 1 62 GLU HA   1 65 ARG QD   . . 4.210 2.987 2.774 3.272     .  0 0 "[    .    1    .    2]" 1 
       1387 1 62 GLU HA   1 65 ARG HG2  . . 4.560 3.940 3.805 4.072     .  0 0 "[    .    1    .    2]" 1 
       1388 1 62 GLU HA   1 65 ARG HG3  . . 4.850 4.855 4.796 4.900 0.050 20 0 "[    .    1    .    2]" 1 
       1389 1 62 GLU HA   1 66 GLN H    . . 4.910 4.172 3.966 4.583     .  0 0 "[    .    1    .    2]" 1 
       1390 1 62 GLU HB2  1 62 GLU QG   . . 2.760 2.524 2.343 2.572     .  0 0 "[    .    1    .    2]" 1 
       1391 1 62 GLU HB2  1 63 GLN H    . . 4.040 3.901 2.985 4.110 0.070 19 0 "[    .    1    .    2]" 1 
       1392 1 62 GLU HB2  1 65 ARG QD   . . 4.950 4.362 3.972 5.192 0.242  4 0 "[    .    1    .    2]" 1 
       1393 1 62 GLU HB3  1 63 GLN H    . . 3.540 2.718 2.505 2.882     .  0 0 "[    .    1    .    2]" 1 
       1394 1 62 GLU QG   1 63 GLN H    . . 4.180 3.562 2.927 4.248 0.068 11 0 "[    .    1    .    2]" 1 
       1395 1 62 GLU QG   1 66 GLN HE21 . . 4.210 2.544 1.941 3.705     .  0 0 "[    .    1    .    2]" 1 
       1396 1 62 GLU QG   1 66 GLN HE22 . . 4.690 3.104 1.953 4.696 0.006 17 0 "[    .    1    .    2]" 1 
       1397 1 63 GLN H    1 63 GLN HB2  . . 3.550 2.094 2.022 2.931     .  0 0 "[    .    1    .    2]" 1 
       1398 1 63 GLN H    1 63 GLN HB3  . . 3.680 3.258 2.110 3.420     .  0 0 "[    .    1    .    2]" 1 
       1399 1 63 GLN H    1 63 GLN HG2  . . 3.960 3.375 3.165 4.032 0.072 19 0 "[    .    1    .    2]" 1 
       1400 1 63 GLN H    1 63 GLN HG3  . . 4.090 3.969 3.154 4.320 0.230 19 0 "[    .    1    .    2]" 1 
       1401 1 63 GLN H    1 64 GLN H    . . 3.730 2.817 2.691 2.969     .  0 0 "[    .    1    .    2]" 1 
       1402 1 63 GLN HA   1 63 GLN HG2  . . 4.060 2.369 1.998 3.781     .  0 0 "[    .    1    .    2]" 1 
       1403 1 63 GLN HA   1 63 GLN HG3  . . 3.910 3.457 2.857 3.555     .  0 0 "[    .    1    .    2]" 1 
       1404 1 63 GLN HA   1 67 TYR H    . . 4.790 4.101 3.646 4.747     .  0 0 "[    .    1    .    2]" 1 
       1405 1 63 GLN HB2  1 64 GLN H    . . 4.450 3.114 2.809 4.179     .  0 0 "[    .    1    .    2]" 1 
       1406 1 63 GLN HB3  1 63 GLN HE22 . . 5.210 3.970 3.308 5.019     .  0 0 "[    .    1    .    2]" 1 
       1407 1 64 GLN H    1 64 GLN HB3  . . 4.120 3.559 3.549 3.575     .  0 0 "[    .    1    .    2]" 1 
       1408 1 64 GLN H    1 64 GLN HG2  . . 4.360 3.447 3.224 3.643     .  0 0 "[    .    1    .    2]" 1 
       1409 1 64 GLN H    1 64 GLN HG3  . . 4.060 2.144 1.971 2.386     .  0 0 "[    .    1    .    2]" 1 
       1410 1 64 GLN H    1 65 ARG H    . . 3.640 2.536 2.435 2.639     .  0 0 "[    .    1    .    2]" 1 
       1411 1 64 GLN H    1 66 GLN H    . . 4.410 4.283 4.139 4.418 0.008 16 0 "[    .    1    .    2]" 1 
       1412 1 64 GLN HA   1 64 GLN HG2  . . 3.540 2.587 2.451 2.826     .  0 0 "[    .    1    .    2]" 1 
       1413 1 64 GLN HA   1 64 GLN HG3  . . 3.910 2.934 2.732 3.077     .  0 0 "[    .    1    .    2]" 1 
       1414 1 64 GLN HA   1 67 TYR H    . . 4.280 3.364 2.987 3.531     .  0 0 "[    .    1    .    2]" 1 
       1415 1 64 GLN HA   1 67 TYR QB   . . 3.780 2.247 1.987 2.498     .  0 0 "[    .    1    .    2]" 1 
       1416 1 64 GLN HA   1 67 TYR QD   . . 4.120 3.878 3.070 4.142 0.022 17 0 "[    .    1    .    2]" 1 
       1417 1 64 GLN HB2  1 65 ARG H    . . 3.980 3.052 2.682 3.329     .  0 0 "[    .    1    .    2]" 1 
       1418 1 64 GLN HB2  1 65 ARG HA   . . 4.360 4.277 4.085 4.383 0.023 10 0 "[    .    1    .    2]" 1 
       1419 1 64 GLN HB2  1 65 ARG HB2  . . 5.190 4.942 4.829 5.206 0.016 16 0 "[    .    1    .    2]" 1 
       1420 1 64 GLN HB3  1 65 ARG H    . . 4.200 4.032 3.766 4.224 0.024 15 0 "[    .    1    .    2]" 1 
       1421 1 64 GLN HG3  1 65 ARG H    . . 4.950 4.380 4.170 4.483     .  0 0 "[    .    1    .    2]" 1 
       1422 1 64 GLN HG3  1 67 TYR QB   . . 5.190 4.803 4.641 5.000     .  0 0 "[    .    1    .    2]" 1 
       1423 1 65 ARG H    1 65 ARG HB2  . . 3.430 3.002 2.970 3.067     .  0 0 "[    .    1    .    2]" 1 
       1424 1 65 ARG H    1 65 ARG HB3  . . 3.490 2.106 2.080 2.138     .  0 0 "[    .    1    .    2]" 1 
       1425 1 65 ARG H    1 65 ARG QD   . . 4.510 4.376 4.301 4.494     .  0 0 "[    .    1    .    2]" 1 
       1426 1 65 ARG H    1 65 ARG HG2  . . 3.860 3.936 3.890 3.960 0.100 15 0 "[    .    1    .    2]" 1 
       1427 1 65 ARG HA   1 65 ARG HB3  . . 3.060 2.979 2.936 2.999     .  0 0 "[    .    1    .    2]" 1 
       1428 1 65 ARG HA   1 65 ARG QD   . . 4.180 4.040 3.874 4.172     .  0 0 "[    .    1    .    2]" 1 
       1429 1 65 ARG HA   1 65 ARG HG2  . . 3.710 3.630 3.549 3.724 0.014  7 0 "[    .    1    .    2]" 1 
       1430 1 65 ARG HA   1 65 ARG HG3  . . 3.560 2.928 2.841 3.063     .  0 0 "[    .    1    .    2]" 1 
       1431 1 65 ARG HA   1 67 TYR H    . . 4.700 4.711 4.665 4.753 0.053  3 0 "[    .    1    .    2]" 1 
       1432 1 65 ARG HA   1 68 LYS H    . . 4.320 3.823 3.612 4.091     .  0 0 "[    .    1    .    2]" 1 
       1433 1 65 ARG HA   1 69 VAL QG   . . 4.850 4.590 4.042 4.713     .  0 0 "[    .    1    .    2]" 1 
       1434 1 65 ARG HB2  1 65 ARG QD   . . 3.910 2.326 2.235 2.417     .  0 0 "[    .    1    .    2]" 1 
       1435 1 65 ARG HB3  1 65 ARG QD   . . 3.340 2.509 2.413 2.639     .  0 0 "[    .    1    .    2]" 1 
       1436 1 65 ARG HB3  1 65 ARG HG2  . . 2.910 2.436 2.371 2.469     .  0 0 "[    .    1    .    2]" 1 
       1437 1 65 ARG HB3  1 66 GLN H    . . 3.650 2.892 2.731 3.001     .  0 0 "[    .    1    .    2]" 1 
       1438 1 65 ARG QD   1 66 GLN H    . . 4.910 4.478 4.148 4.841     .  0 0 "[    .    1    .    2]" 1 
       1439 1 65 ARG QD   1 66 GLN QG   . . 5.060 3.912 3.660 4.330     .  0 0 "[    .    1    .    2]" 1 
       1440 1 65 ARG QD   1 69 VAL QG   . . 5.190 4.832 4.284 5.006     .  0 0 "[    .    1    .    2]" 1 
       1441 1 65 ARG HG2  1 66 GLN H    . . 4.180 2.841 2.311 3.227     .  0 0 "[    .    1    .    2]" 1 
       1442 1 65 ARG HG2  1 69 VAL QG   . . 4.560 3.949 3.534 4.245     .  0 0 "[    .    1    .    2]" 1 
       1443 1 65 ARG HG3  1 66 GLN H    . . 4.210 3.923 3.472 4.172     .  0 0 "[    .    1    .    2]" 1 
       1444 1 65 ARG HG3  1 66 GLN QG   . . 4.850 3.985 3.467 4.477     .  0 0 "[    .    1    .    2]" 1 
       1445 1 65 ARG HG3  1 69 VAL QG   . . 4.280 3.579 3.030 3.828     .  0 0 "[    .    1    .    2]" 1 
       1446 1 66 GLN H    1 66 GLN QB   . . 3.200 2.322 2.093 2.554     .  0 0 "[    .    1    .    2]" 1 
       1447 1 66 GLN H    1 66 GLN HE21 . . 5.270 3.742 2.948 4.892     .  0 0 "[    .    1    .    2]" 1 
       1448 1 66 GLN H    1 66 GLN HE22 . . 5.500 5.069 4.100 5.532 0.032  9 0 "[    .    1    .    2]" 1 
       1449 1 66 GLN H    1 66 GLN QG   . . 3.750 2.453 2.134 2.869     .  0 0 "[    .    1    .    2]" 1 
       1450 1 66 GLN H    1 67 TYR H    . . 3.630 2.563 2.369 2.821     .  0 0 "[    .    1    .    2]" 1 
       1451 1 66 GLN H    1 67 TYR HA   . . 5.500 5.118 4.946 5.333     .  0 0 "[    .    1    .    2]" 1 
       1452 1 66 GLN H    1 67 TYR QB   . . 5.040 4.044 3.874 4.277     .  0 0 "[    .    1    .    2]" 1 
       1453 1 66 GLN H    1 68 LYS H    . . 4.760 3.988 3.809 4.572     .  0 0 "[    .    1    .    2]" 1 
       1454 1 66 GLN HA   1 66 GLN HE21 . . 5.500 4.749 4.009 5.130     .  0 0 "[    .    1    .    2]" 1 
       1455 1 66 GLN HA   1 66 GLN QG   . . 3.660 2.347 2.111 2.864     .  0 0 "[    .    1    .    2]" 1 
       1456 1 66 GLN HA   1 69 VAL H    . . 4.560 3.378 3.230 3.630     .  0 0 "[    .    1    .    2]" 1 
       1457 1 66 GLN HA   1 69 VAL QG   . . 3.530 2.522 2.261 3.255     .  0 0 "[    .    1    .    2]" 1 
       1458 1 66 GLN HA   1 70 HIS H    . . 4.670 3.991 3.741 4.216     .  0 0 "[    .    1    .    2]" 1 
       1459 1 66 GLN HA   1 70 HIS HD2  . . 5.030 3.856 3.415 4.329     .  0 0 "[    .    1    .    2]" 1 
       1460 1 66 GLN QB   1 67 TYR H    . . 3.750 2.583 2.502 2.643     .  0 0 "[    .    1    .    2]" 1 
       1461 1 66 GLN QB   1 67 TYR QB   . . 4.950 3.930 3.847 3.975     .  0 0 "[    .    1    .    2]" 1 
       1462 1 66 GLN QB   1 70 HIS HE1  . . 4.480 3.153 2.556 4.155     .  0 0 "[    .    1    .    2]" 1 
       1463 1 66 GLN QG   1 67 TYR H    . . 4.760 4.187 3.782 4.355     .  0 0 "[    .    1    .    2]" 1 
       1464 1 66 GLN QG   1 69 VAL QG   . . 4.950 3.626 3.281 4.081     .  0 0 "[    .    1    .    2]" 1 
       1465 1 66 GLN QG   1 70 HIS HE1  . . 5.380 4.832 4.094 5.177     .  0 0 "[    .    1    .    2]" 1 
       1466 1 67 TYR H    1 67 TYR QB   . . 3.300 2.050 1.985 2.087     .  0 0 "[    .    1    .    2]" 1 
       1467 1 67 TYR H    1 67 TYR QD   . . 4.050 4.030 3.931 4.081 0.031  4 0 "[    .    1    .    2]" 1 
       1468 1 67 TYR H    1 68 LYS H    . . 3.750 2.827 2.727 3.043     .  0 0 "[    .    1    .    2]" 1 
       1469 1 67 TYR H    1 68 LYS HA   . . 5.420 5.305 5.221 5.487 0.067  7 0 "[    .    1    .    2]" 1 
       1470 1 67 TYR HA   1 67 TYR QD   . . 3.370 3.211 2.601 3.348     .  0 0 "[    .    1    .    2]" 1 
       1471 1 67 TYR HA   1 68 LYS HA   . . 4.850 4.775 4.731 4.881 0.031  9 0 "[    .    1    .    2]" 1 
       1472 1 67 TYR HA   1 69 VAL H    . . 5.500 4.614 3.774 5.215     .  0 0 "[    .    1    .    2]" 1 
       1473 1 67 TYR HA   1 70 HIS H    . . 4.510 3.400 3.131 3.675     .  0 0 "[    .    1    .    2]" 1 
       1474 1 67 TYR HA   1 70 HIS HB2  . . 4.060 2.192 1.986 2.475     .  0 0 "[    .    1    .    2]" 1 
       1475 1 67 TYR HA   1 70 HIS HB3  . . 3.950 3.670 3.469 4.001 0.051  7 0 "[    .    1    .    2]" 1 
       1476 1 67 TYR HA   1 70 HIS HD2  . . 4.560 4.481 4.198 4.598 0.038  9 0 "[    .    1    .    2]" 1 
       1477 1 67 TYR QB   1 68 LYS H    . . 3.890 2.781 2.122 3.025     .  0 0 "[    .    1    .    2]" 1 
       1478 1 67 TYR QB   1 68 LYS HA   . . 4.850 4.270 4.040 4.405     .  0 0 "[    .    1    .    2]" 1 
       1479 1 67 TYR QD   1 68 LYS H    . . 4.050 3.140 2.648 3.522     .  0 0 "[    .    1    .    2]" 1 
       1480 1 67 TYR QD   1 68 LYS HA   . . 3.970 2.750 2.486 3.529     .  0 0 "[    .    1    .    2]" 1 
       1481 1 67 TYR QD   1 68 LYS QB   . . 4.120 4.058 3.456 4.197 0.077 16 0 "[    .    1    .    2]" 1 
       1482 1 67 TYR QD   1 68 LYS HG2  . . 4.850 2.780 1.980 4.502     .  0 0 "[    .    1    .    2]" 1 
       1483 1 67 TYR QD   1 68 LYS HG3  . . 4.480 4.221 3.417 4.852 0.372  1 0 "[    .    1    .    2]" 1 
       1484 1 67 TYR QD   1 71 LEU QD   . . 4.120 3.501 2.912 3.772     .  0 0 "[    .    1    .    2]" 1 
       1485 1 67 TYR QE   1 71 LEU QD   . . 3.220 2.509 1.964 2.725     .  0 0 "[    .    1    .    2]" 1 
       1486 1 67 TYR QE   1 71 LEU HG   . . 5.350 4.721 3.096 5.365 0.015 17 0 "[    .    1    .    2]" 1 
       1487 1 68 LYS H    1 68 LYS QB   . . 3.150 2.292 2.124 2.632     .  0 0 "[    .    1    .    2]" 1 
       1488 1 68 LYS H    1 68 LYS QD   . . 5.500 4.227 2.894 4.488     .  0 0 "[    .    1    .    2]" 1 
       1489 1 68 LYS H    1 68 LYS HG2  . . 4.410 2.821 1.939 4.305     .  0 0 "[    .    1    .    2]" 1 
       1490 1 68 LYS H    1 68 LYS HG3  . . 4.510 3.330 2.471 4.414     .  0 0 "[    .    1    .    2]" 1 
       1491 1 68 LYS H    1 69 VAL H    . . 3.950 2.726 2.634 2.890     .  0 0 "[    .    1    .    2]" 1 
       1492 1 68 LYS H    1 69 VAL QG   . . 4.560 3.711 3.493 4.414     .  0 0 "[    .    1    .    2]" 1 
       1493 1 68 LYS H    1 70 HIS H    . . 4.950 3.943 3.702 4.834     .  0 0 "[    .    1    .    2]" 1 
       1494 1 68 LYS H    1 71 LEU H    . . 5.500 4.803 4.689 5.096     .  0 0 "[    .    1    .    2]" 1 
       1495 1 68 LYS HA   1 68 LYS QD   . . 4.850 2.954 1.962 3.708     .  0 0 "[    .    1    .    2]" 1 
       1496 1 68 LYS HA   1 68 LYS QE   . . 4.850 3.387 2.098 4.562     .  0 0 "[    .    1    .    2]" 1 
       1497 1 68 LYS HA   1 68 LYS HG2  . . 3.460 2.392 2.042 3.109     .  0 0 "[    .    1    .    2]" 1 
       1498 1 68 LYS HA   1 68 LYS HG3  . . 4.040 3.561 3.181 3.755     .  0 0 "[    .    1    .    2]" 1 
       1499 1 68 LYS HA   1 71 LEU H    . . 5.060 3.803 3.689 4.075     .  0 0 "[    .    1    .    2]" 1 
       1500 1 68 LYS HA   1 71 LEU HB2  . . 4.770 3.447 2.980 3.802     .  0 0 "[    .    1    .    2]" 1 
       1501 1 68 LYS HA   1 71 LEU QD   . . 3.770 3.266 2.437 3.684     .  0 0 "[    .    1    .    2]" 1 
       1502 1 68 LYS QB   1 68 LYS QE   . . 4.560 3.452 2.018 3.799     .  0 0 "[    .    1    .    2]" 1 
       1503 1 68 LYS QB   1 69 VAL H    . . 3.770 2.527 2.210 3.046     .  0 0 "[    .    1    .    2]" 1 
       1504 1 68 LYS QB   1 69 VAL HA   . . 4.770 3.947 3.834 4.261     .  0 0 "[    .    1    .    2]" 1 
       1505 1 68 LYS QB   1 69 VAL QG   . . 3.820 2.839 2.597 3.337     .  0 0 "[    .    1    .    2]" 1 
       1506 1 68 LYS QD   1 71 LEU QD   . . 5.060 4.455 3.417 4.939     .  0 0 "[    .    1    .    2]" 1 
       1507 1 68 LYS QE   1 71 LEU QD   . . 4.950 4.144 3.122 4.873     .  0 0 "[    .    1    .    2]" 1 
       1508 1 68 LYS HG3  1 69 VAL QG   . . 4.950 4.815 4.655 5.443 0.493  3 0 "[    .    1    .    2]" 1 
       1509 1 69 VAL H    1 69 VAL HB   . . 3.450 3.232 2.139 3.500 0.050 20 0 "[    .    1    .    2]" 1 
       1510 1 69 VAL H    1 69 VAL QG   . . 3.180 1.987 1.806 2.740     .  0 0 "[    .    1    .    2]" 1 
       1511 1 69 VAL H    1 70 HIS H    . . 3.890 2.611 2.353 2.830     .  0 0 "[    .    1    .    2]" 1 
       1512 1 69 VAL H    1 70 HIS HB2  . . 5.340 4.648 4.334 4.872     .  0 0 "[    .    1    .    2]" 1 
       1513 1 69 VAL HA   1 69 VAL QG   . . 3.010 2.369 2.135 2.453     .  0 0 "[    .    1    .    2]" 1 
       1514 1 69 VAL HA   1 70 HIS HA   . . 4.850 4.879 4.832 4.917 0.067 10 0 "[    .    1    .    2]" 1 
       1515 1 69 VAL HA   1 72 ASP H    . . 4.560 3.175 2.997 3.521     .  0 0 "[    .    1    .    2]" 1 
       1516 1 69 VAL HA   1 72 ASP HB2  . . 3.910 2.526 2.381 3.106     .  0 0 "[    .    1    .    2]" 1 
       1517 1 69 VAL HA   1 72 ASP HB3  . . 3.970 3.902 3.785 3.973 0.003 13 0 "[    .    1    .    2]" 1 
       1518 1 69 VAL HA   1 73 LEU H    . . 4.950 4.189 3.979 4.416     .  0 0 "[    .    1    .    2]" 1 
       1519 1 69 VAL HB   1 70 HIS H    . . 4.900 3.715 2.248 4.075     .  0 0 "[    .    1    .    2]" 1 
       1520 1 69 VAL HB   1 70 HIS HA   . . 5.190 4.821 4.315 4.970     .  0 0 "[    .    1    .    2]" 1 
       1521 1 69 VAL HB   1 70 HIS HD2  . . 4.270 4.060 2.529 4.370 0.100  5 0 "[    .    1    .    2]" 1 
       1522 1 69 VAL QG   1 70 HIS H    . . 4.060 2.202 1.942 2.781     .  0 0 "[    .    1    .    2]" 1 
       1523 1 69 VAL QG   1 70 HIS HA   . . 4.180 2.820 2.724 3.065     .  0 0 "[    .    1    .    2]" 1 
       1524 1 69 VAL QG   1 70 HIS HB2  . . 4.770 4.016 3.803 4.611     .  0 0 "[    .    1    .    2]" 1 
       1525 1 69 VAL QG   1 70 HIS HB3  . . 4.950 4.495 4.342 4.919     .  0 0 "[    .    1    .    2]" 1 
       1526 1 69 VAL QG   1 70 HIS HD2  . . 3.490 1.917 1.760 2.555     .  0 0 "[    .    1    .    2]" 1 
       1527 1 69 VAL QG   1 72 ASP H    . . 5.500 4.240 4.115 4.382     .  0 0 "[    .    1    .    2]" 1 
       1528 1 69 VAL QG   1 72 ASP HB2  . . 4.560 3.965 3.647 4.095     .  0 0 "[    .    1    .    2]" 1 
       1529 1 69 VAL QG   1 72 ASP HB3  . . 5.190 4.550 3.695 4.769     .  0 0 "[    .    1    .    2]" 1 
       1530 1 69 VAL QG   1 73 LEU H    . . 4.770 3.868 3.605 4.149     .  0 0 "[    .    1    .    2]" 1 
       1531 1 69 VAL QG   1 73 LEU MD2  . . 4.280 2.860 2.330 3.148     .  0 0 "[    .    1    .    2]" 1 
       1532 1 69 VAL QG   1 73 LEU HG   . . 3.950 2.407 2.106 2.830     .  0 0 "[    .    1    .    2]" 1 
       1533 1 70 HIS H    1 70 HIS HB2  . . 3.720 2.457 2.372 2.569     .  0 0 "[    .    1    .    2]" 1 
       1534 1 70 HIS H    1 70 HIS HB3  . . 3.780 3.544 3.532 3.558     .  0 0 "[    .    1    .    2]" 1 
       1535 1 70 HIS H    1 70 HIS HD2  . . 4.480 2.295 1.930 2.456     .  0 0 "[    .    1    .    2]" 1 
       1536 1 70 HIS H    1 71 LEU H    . . 4.270 2.943 2.815 3.078     .  0 0 "[    .    1    .    2]" 1 
       1537 1 70 HIS H    1 72 ASP H    . . 5.040 4.297 4.125 4.866     .  0 0 "[    .    1    .    2]" 1 
       1538 1 70 HIS H    1 73 LEU MD1  . . 5.190 4.108 3.480 4.414     .  0 0 "[    .    1    .    2]" 1 
       1539 1 70 HIS HA   1 70 HIS HD2  . . 3.610 2.673 2.547 3.030     .  0 0 "[    .    1    .    2]" 1 
       1540 1 70 HIS HA   1 73 LEU H    . . 3.910 3.148 2.947 3.366     .  0 0 "[    .    1    .    2]" 1 
       1541 1 70 HIS HA   1 73 LEU HB2  . . 3.930 2.559 2.269 2.882     .  0 0 "[    .    1    .    2]" 1 
       1542 1 70 HIS HA   1 73 LEU HB3  . . 4.320 4.047 3.849 4.336 0.016  2 0 "[    .    1    .    2]" 1 
       1543 1 70 HIS HA   1 73 LEU MD1  . . 3.700 2.647 2.205 3.135     .  0 0 "[    .    1    .    2]" 1 
       1544 1 70 HIS HA   1 73 LEU MD2  . . 4.560 3.963 3.766 4.179     .  0 0 "[    .    1    .    2]" 1 
       1545 1 70 HIS HA   1 73 LEU HG   . . 4.320 2.289 2.023 2.581     .  0 0 "[    .    1    .    2]" 1 
       1546 1 70 HIS HA   1 74 TRP H    . . 4.700 3.996 3.752 4.279     .  0 0 "[    .    1    .    2]" 1 
       1547 1 70 HIS HB2  1 71 LEU H    . . 4.620 2.630 2.454 2.820     .  0 0 "[    .    1    .    2]" 1 
       1548 1 70 HIS HB3  1 71 LEU H    . . 4.620 3.551 3.305 3.838     .  0 0 "[    .    1    .    2]" 1 
       1549 1 70 HIS HB3  1 73 LEU HG   . . 5.060 4.791 4.518 5.075 0.015 20 0 "[    .    1    .    2]" 1 
       1550 1 70 HIS HD2  1 73 LEU HB2  . . 5.190 4.840 4.344 5.206 0.016  5 0 "[    .    1    .    2]" 1 
       1551 1 70 HIS HD2  1 73 LEU MD1  . . 4.280 2.862 2.552 3.192     .  0 0 "[    .    1    .    2]" 1 
       1552 1 71 LEU H    1 71 LEU HB3  . . 4.090 3.103 2.714 3.539     .  0 0 "[    .    1    .    2]" 1 
       1553 1 71 LEU H    1 71 LEU QD   . . 4.730 3.215 2.993 3.472     .  0 0 "[    .    1    .    2]" 1 
       1554 1 71 LEU H    1 71 LEU HG   . . 5.190 3.745 2.085 4.531     .  0 0 "[    .    1    .    2]" 1 
       1555 1 71 LEU H    1 72 ASP H    . . 4.870 2.811 2.596 3.139     .  0 0 "[    .    1    .    2]" 1 
       1556 1 71 LEU HA   1 71 LEU QD   . . 3.130 2.019 1.955 2.126     .  0 0 "[    .    1    .    2]" 1 
       1557 1 71 LEU HA   1 71 LEU HG   . . 4.120 2.836 2.725 2.955     .  0 0 "[    .    1    .    2]" 1 
       1558 1 71 LEU HA   1 74 TRP H    . . 4.090 3.363 3.162 3.493     .  0 0 "[    .    1    .    2]" 1 
       1559 1 71 LEU HA   1 74 TRP HB2  . . 4.060 3.814 3.625 3.980     .  0 0 "[    .    1    .    2]" 1 
       1560 1 71 LEU HA   1 74 TRP HB3  . . 3.950 2.525 2.197 2.746     .  0 0 "[    .    1    .    2]" 1 
       1561 1 71 LEU HA   1 74 TRP HE3  . . 4.040 3.250 2.593 3.748     .  0 0 "[    .    1    .    2]" 1 
       1562 1 71 LEU HA   1 75 VAL H    . . 5.500 4.389 3.898 4.705     .  0 0 "[    .    1    .    2]" 1 
       1563 1 71 LEU HA   1 75 VAL MG2  . . 4.560 4.070 3.648 4.452     .  0 0 "[    .    1    .    2]" 1 
       1564 1 71 LEU HB2  1 72 ASP H    . . 4.950 3.270 2.324 3.816     .  0 0 "[    .    1    .    2]" 1 
       1565 1 71 LEU HB3  1 71 LEU QD   . . 3.070 2.258 2.121 2.391     .  0 0 "[    .    1    .    2]" 1 
       1566 1 71 LEU HB3  1 72 ASP H    . . 4.060 3.020 2.468 3.602     .  0 0 "[    .    1    .    2]" 1 
       1567 1 71 LEU HB3  1 74 TRP HE3  . . 5.190 4.408 3.182 5.193 0.003  9 0 "[    .    1    .    2]" 1 
       1568 1 71 LEU QD   1 72 ASP H    . . 4.790 4.161 3.910 4.270     .  0 0 "[    .    1    .    2]" 1 
       1569 1 71 LEU QD   1 74 TRP HB2  . . 4.450 4.298 4.147 4.401     .  0 0 "[    .    1    .    2]" 1 
       1570 1 71 LEU QD   1 74 TRP HB3  . . 4.250 3.351 3.162 3.485     .  0 0 "[    .    1    .    2]" 1 
       1571 1 71 LEU QD   1 74 TRP HE3  . . 3.410 3.151 2.528 3.356     .  0 0 "[    .    1    .    2]" 1 
       1572 1 71 LEU QD   1 74 TRP HZ3  . . 4.280 3.804 3.269 4.067     .  0 0 "[    .    1    .    2]" 1 
       1573 1 71 LEU QD   1 86 TYR QE   . . 4.450 3.530 3.257 3.861     .  0 0 "[    .    1    .    2]" 1 
       1574 1 71 LEU HG   1 72 ASP H    . . 5.190 4.605 4.161 4.799     .  0 0 "[    .    1    .    2]" 1 
       1575 1 71 LEU HG   1 74 TRP HE3  . . 5.190 4.053 3.134 5.203 0.013  2 0 "[    .    1    .    2]" 1 
       1576 1 72 ASP H    1 72 ASP HB2  . . 3.450 2.023 2.005 2.051     .  0 0 "[    .    1    .    2]" 1 
       1577 1 72 ASP H    1 72 ASP HB3  . . 3.600 3.252 3.105 3.343     .  0 0 "[    .    1    .    2]" 1 
       1578 1 72 ASP H    1 73 LEU H    . . 3.860 2.615 2.401 2.941     .  0 0 "[    .    1    .    2]" 1 
       1579 1 72 ASP H    1 74 TRP H    . . 5.500 3.973 3.823 4.197     .  0 0 "[    .    1    .    2]" 1 
       1580 1 72 ASP HA   1 75 VAL H    . . 5.420 3.184 2.979 3.345     .  0 0 "[    .    1    .    2]" 1 
       1581 1 72 ASP HA   1 75 VAL HB   . . 3.570 2.453 2.302 2.741     .  0 0 "[    .    1    .    2]" 1 
       1582 1 72 ASP HA   1 75 VAL MG1  . . 4.410 3.776 3.620 4.045     .  0 0 "[    .    1    .    2]" 1 
       1583 1 72 ASP HA   1 75 VAL MG2  . . 4.040 2.447 2.356 2.556     .  0 0 "[    .    1    .    2]" 1 
       1584 1 72 ASP HA   1 76 LYS H    . . 4.990 4.243 4.062 4.515     .  0 0 "[    .    1    .    2]" 1 
       1585 1 72 ASP HB2  1 73 LEU H    . . 3.890 3.020 2.873 3.311     .  0 0 "[    .    1    .    2]" 1 
       1586 1 72 ASP HB2  1 73 LEU HA   . . 5.280 4.929 4.819 5.248     .  0 0 "[    .    1    .    2]" 1 
       1587 1 72 ASP HB2  1 73 LEU MD2  . . 4.950 3.417 3.171 4.011     .  0 0 "[    .    1    .    2]" 1 
       1588 1 72 ASP HB2  1 73 LEU HG   . . 4.850 4.102 3.857 4.345     .  0 0 "[    .    1    .    2]" 1 
       1589 1 72 ASP HB3  1 73 LEU H    . . 3.850 2.935 2.564 3.169     .  0 0 "[    .    1    .    2]" 1 
       1590 1 72 ASP HB3  1 73 LEU HA   . . 4.950 3.763 3.698 3.834     .  0 0 "[    .    1    .    2]" 1 
       1591 1 72 ASP HB3  1 73 LEU MD2  . . 4.510 2.564 2.388 2.944     .  0 0 "[    .    1    .    2]" 1 
       1592 1 72 ASP HB3  1 73 LEU HG   . . 4.770 4.080 3.455 4.375     .  0 0 "[    .    1    .    2]" 1 
       1593 1 72 ASP HB3  1 75 VAL MG2  . . 4.950 4.949 4.869 4.973 0.023  7 0 "[    .    1    .    2]" 1 
       1594 1 72 ASP HB3  1 76 LYS QD   . . 4.770 3.600 2.775 4.770     .  0 0 "[    .    1    .    2]" 1 
       1595 1 73 LEU H    1 73 LEU HB2  . . 3.600 2.627 2.495 2.745     .  0 0 "[    .    1    .    2]" 1 
       1596 1 73 LEU H    1 73 LEU HB3  . . 3.780 3.531 3.518 3.543     .  0 0 "[    .    1    .    2]" 1 
       1597 1 73 LEU H    1 73 LEU MD1  . . 4.150 3.708 3.583 3.870     .  0 0 "[    .    1    .    2]" 1 
       1598 1 73 LEU H    1 73 LEU MD2  . . 3.910 2.422 2.168 2.777     .  0 0 "[    .    1    .    2]" 1 
       1599 1 73 LEU H    1 73 LEU HG   . . 3.300 2.113 1.963 2.369     .  0 0 "[    .    1    .    2]" 1 
       1600 1 73 LEU H    1 74 TRP H    . . 3.670 2.641 2.577 2.735     .  0 0 "[    .    1    .    2]" 1 
       1601 1 73 LEU H    1 74 TRP HA   . . 5.500 5.200 5.145 5.273     .  0 0 "[    .    1    .    2]" 1 
       1602 1 73 LEU HA   1 73 LEU MD1  . . 3.970 3.744 3.625 3.860     .  0 0 "[    .    1    .    2]" 1 
       1603 1 73 LEU HA   1 73 LEU MD2  . . 3.060 2.016 1.956 2.127     .  0 0 "[    .    1    .    2]" 1 
       1604 1 73 LEU HA   1 73 LEU HG   . . 3.990 3.479 3.313 3.534     .  0 0 "[    .    1    .    2]" 1 
       1605 1 73 LEU HA   1 76 LYS H    . . 3.970 3.183 2.882 3.370     .  0 0 "[    .    1    .    2]" 1 
       1606 1 73 LEU HA   1 76 LYS QB   . . 3.050 2.689 2.254 3.056 0.006 20 0 "[    .    1    .    2]" 1 
       1607 1 73 LEU HA   1 76 LYS QD   . . 4.010 2.516 1.983 4.010 0.000 11 0 "[    .    1    .    2]" 1 
       1608 1 73 LEU HA   1 76 LYS QE   . . 4.620 3.836 1.862 4.438     .  0 0 "[    .    1    .    2]" 1 
       1609 1 73 LEU HA   1 76 LYS HG2  . . 4.950 4.512 3.637 4.959 0.009 13 0 "[    .    1    .    2]" 1 
       1610 1 73 LEU HA   1 77 SER H    . . 4.910 4.739 4.626 4.924 0.014  7 0 "[    .    1    .    2]" 1 
       1611 1 73 LEU HB2  1 73 LEU MD1  . . 3.360 2.534 2.381 2.640     .  0 0 "[    .    1    .    2]" 1 
       1612 1 73 LEU HB2  1 74 TRP H    . . 4.000 2.838 2.694 3.026     .  0 0 "[    .    1    .    2]" 1 
       1613 1 73 LEU HB2  1 74 TRP HA   . . 4.770 4.222 4.090 4.314     .  0 0 "[    .    1    .    2]" 1 
       1614 1 73 LEU HB3  1 73 LEU MD1  . . 2.860 2.154 2.032 2.318     .  0 0 "[    .    1    .    2]" 1 
       1615 1 73 LEU HB3  1 74 TRP H    . . 4.230 3.999 3.883 4.127     .  0 0 "[    .    1    .    2]" 1 
       1616 1 73 LEU HB3  1 74 TRP HA   . . 4.950 4.742 4.602 4.880     .  0 0 "[    .    1    .    2]" 1 
       1617 1 73 LEU MD1  1 74 TRP H    . . 5.060 4.834 4.654 5.031     .  0 0 "[    .    1    .    2]" 1 
       1618 1 73 LEU MD2  1 74 TRP H    . . 4.760 4.311 4.252 4.545     .  0 0 "[    .    1    .    2]" 1 
       1619 1 73 LEU MD2  1 76 LYS QB   . . 4.180 3.828 3.383 4.162     .  0 0 "[    .    1    .    2]" 1 
       1620 1 73 LEU MD2  1 76 LYS QD   . . 3.950 2.594 2.115 3.590     .  0 0 "[    .    1    .    2]" 1 
       1621 1 73 LEU MD2  1 76 LYS QE   . . 3.990 3.369 1.737 3.984     .  0 0 "[    .    1    .    2]" 1 
       1622 1 73 LEU HG   1 74 TRP H    . . 4.950 4.147 3.871 4.369     .  0 0 "[    .    1    .    2]" 1 
       1623 1 74 TRP H    1 74 TRP HB2  . . 3.620 2.830 2.782 2.855     .  0 0 "[    .    1    .    2]" 1 
       1624 1 74 TRP H    1 74 TRP HB3  . . 3.620 2.172 2.145 2.211     .  0 0 "[    .    1    .    2]" 1 
       1625 1 74 TRP H    1 74 TRP HD1  . . 5.210 5.255 5.234 5.271 0.061 17 0 "[    .    1    .    2]" 1 
       1626 1 74 TRP H    1 74 TRP HE3  . . 4.800 3.890 3.825 3.955     .  0 0 "[    .    1    .    2]" 1 
       1627 1 74 TRP H    1 75 VAL H    . . 4.020 2.481 2.366 2.558     .  0 0 "[    .    1    .    2]" 1 
       1628 1 74 TRP H    1 75 VAL HA   . . 5.500 5.056 4.975 5.130     .  0 0 "[    .    1    .    2]" 1 
       1629 1 74 TRP H    1 75 VAL HB   . . 5.340 4.501 4.386 4.714     .  0 0 "[    .    1    .    2]" 1 
       1630 1 74 TRP H    1 75 VAL MG2  . . 4.790 4.127 3.862 4.231     .  0 0 "[    .    1    .    2]" 1 
       1631 1 74 TRP H    1 76 LYS H    . . 4.950 4.145 3.816 4.329     .  0 0 "[    .    1    .    2]" 1 
       1632 1 74 TRP HA   1 74 TRP HD1  . . 3.640 3.299 3.233 3.333     .  0 0 "[    .    1    .    2]" 1 
       1633 1 74 TRP HA   1 74 TRP HE1  . . 5.470 5.464 5.393 5.505 0.035  8 0 "[    .    1    .    2]" 1 
       1634 1 74 TRP HA   1 74 TRP HE3  . . 4.620 4.677 4.639 4.711 0.091  2 0 "[    .    1    .    2]" 1 
       1635 1 74 TRP HA   1 76 LYS H    . . 5.190 4.507 4.206 4.682     .  0 0 "[    .    1    .    2]" 1 
       1636 1 74 TRP HA   1 77 SER H    . . 4.230 3.546 3.430 3.717     .  0 0 "[    .    1    .    2]" 1 
       1637 1 74 TRP HB2  1 74 TRP HD1  . . 3.720 2.748 2.732 2.759     .  0 0 "[    .    1    .    2]" 1 
       1638 1 74 TRP HB2  1 74 TRP HE1  . . 5.420 4.958 4.952 4.962     .  0 0 "[    .    1    .    2]" 1 
       1639 1 74 TRP HB2  1 74 TRP HE3  . . 4.120 4.037 4.028 4.052     .  0 0 "[    .    1    .    2]" 1 
       1640 1 74 TRP HB2  1 75 VAL H    . . 4.620 4.271 4.207 4.312     .  0 0 "[    .    1    .    2]" 1 
       1641 1 74 TRP HB3  1 74 TRP HE3  . . 3.790 2.483 2.469 2.504     .  0 0 "[    .    1    .    2]" 1 
       1642 1 74 TRP HB3  1 75 VAL H    . . 4.360 3.088 2.974 3.178     .  0 0 "[    .    1    .    2]" 1 
       1643 1 74 TRP HB3  1 75 VAL MG2  . . 4.450 3.741 3.466 3.846     .  0 0 "[    .    1    .    2]" 1 
       1644 1 74 TRP HB3  1 76 LYS H    . . 5.500 5.383 5.128 5.516 0.016 10 0 "[    .    1    .    2]" 1 
       1645 1 74 TRP HD1  1 77 SER QB   . . 4.850 4.226 3.977 4.554     .  0 0 "[    .    1    .    2]" 1 
       1646 1 74 TRP HD1  1 78 LEU MD2  . . 4.700 4.114 3.770 4.487     .  0 0 "[    .    1    .    2]" 1 
       1647 1 74 TRP HE1  1 78 LEU MD1  . . 5.150 4.376 4.087 4.624     .  0 0 "[    .    1    .    2]" 1 
       1648 1 74 TRP HE1  1 78 LEU MD2  . . 3.970 2.938 2.530 3.288     .  0 0 "[    .    1    .    2]" 1 
       1649 1 74 TRP HE1  1 78 LEU HG   . . 5.500 4.485 4.262 4.649     .  0 0 "[    .    1    .    2]" 1 
       1650 1 74 TRP HE3  1 75 VAL H    . . 4.480 3.020 2.838 3.208     .  0 0 "[    .    1    .    2]" 1 
       1651 1 74 TRP HE3  1 75 VAL HA   . . 4.320 3.481 3.361 3.596     .  0 0 "[    .    1    .    2]" 1 
       1652 1 74 TRP HE3  1 75 VAL HB   . . 5.030 4.128 3.993 4.235     .  0 0 "[    .    1    .    2]" 1 
       1653 1 74 TRP HE3  1 75 VAL MG1  . . 4.620 4.548 4.304 4.628 0.008  6 0 "[    .    1    .    2]" 1 
       1654 1 74 TRP HE3  1 75 VAL MG2  . . 3.270 1.957 1.831 2.093     .  0 0 "[    .    1    .    2]" 1 
       1655 1 74 TRP HE3  1 78 LEU MD1  . . 5.380 3.328 3.186 3.529     .  0 0 "[    .    1    .    2]" 1 
       1656 1 74 TRP HE3  1 86 TYR QE   . . 5.030 4.005 3.650 4.445     .  0 0 "[    .    1    .    2]" 1 
       1657 1 74 TRP HH2  1 75 VAL MG2  . . 4.800 4.032 3.869 4.134     .  0 0 "[    .    1    .    2]" 1 
       1658 1 74 TRP HH2  1 78 LEU MD1  . . 4.480 2.353 2.237 2.667     .  0 0 "[    .    1    .    2]" 1 
       1659 1 74 TRP HH2  1 78 LEU MD2  . . 4.700 3.621 3.322 4.028     .  0 0 "[    .    1    .    2]" 1 
       1660 1 74 TRP HH2  1 86 TYR HB2  . . 5.060 3.338 3.196 3.584     .  0 0 "[    .    1    .    2]" 1 
       1661 1 74 TRP HH2  1 86 TYR HB3  . . 4.800 4.804 4.762 4.818 0.018 19 0 "[    .    1    .    2]" 1 
       1662 1 74 TRP HH2  1 86 TYR QD   . . 4.020 2.377 2.055 2.701     .  0 0 "[    .    1    .    2]" 1 
       1663 1 74 TRP HZ2  1 78 LEU MD1  . . 4.480 2.817 2.542 3.057     .  0 0 "[    .    1    .    2]" 1 
       1664 1 74 TRP HZ2  1 78 LEU MD2  . . 3.830 2.404 2.143 2.868     .  0 0 "[    .    1    .    2]" 1 
       1665 1 74 TRP HZ3  1 75 VAL MG2  . . 4.120 2.277 2.070 2.385     .  0 0 "[    .    1    .    2]" 1 
       1666 1 74 TRP HZ3  1 78 LEU MD1  . . 4.850 2.584 2.411 2.936     .  0 0 "[    .    1    .    2]" 1 
       1667 1 74 TRP HZ3  1 86 TYR QD   . . 4.700 2.591 2.033 3.439     .  0 0 "[    .    1    .    2]" 1 
       1668 1 74 TRP HZ3  1 86 TYR QE   . . 4.320 2.282 2.059 2.630     .  0 0 "[    .    1    .    2]" 1 
       1669 1 75 VAL H    1 75 VAL HB   . . 3.620 2.250 2.196 2.352     .  0 0 "[    .    1    .    2]" 1 
       1670 1 75 VAL H    1 75 VAL MG1  . . 4.180 3.662 3.633 3.709     .  0 0 "[    .    1    .    2]" 1 
       1671 1 75 VAL H    1 75 VAL MG2  . . 3.490 2.523 2.311 2.638     .  0 0 "[    .    1    .    2]" 1 
       1672 1 75 VAL H    1 76 LYS H    . . 3.830 2.547 2.334 2.738     .  0 0 "[    .    1    .    2]" 1 
       1673 1 75 VAL H    1 77 SER H    . . 5.210 3.765 3.725 3.831     .  0 0 "[    .    1    .    2]" 1 
       1674 1 75 VAL HA   1 75 VAL MG1  . . 3.400 2.501 2.386 2.566     .  0 0 "[    .    1    .    2]" 1 
       1675 1 75 VAL HA   1 75 VAL MG2  . . 3.380 2.190 2.158 2.297     .  0 0 "[    .    1    .    2]" 1 
       1676 1 75 VAL HA   1 76 LYS HA   . . 5.350 4.817 4.738 4.856     .  0 0 "[    .    1    .    2]" 1 
       1677 1 75 VAL HA   1 77 SER H    . . 4.870 3.587 3.354 3.672     .  0 0 "[    .    1    .    2]" 1 
       1678 1 75 VAL HA   1 78 LEU H    . . 4.510 2.874 2.740 3.400     .  0 0 "[    .    1    .    2]" 1 
       1679 1 75 VAL HA   1 78 LEU HB2  . . 4.510 2.492 2.247 2.721     .  0 0 "[    .    1    .    2]" 1 
       1680 1 75 VAL HA   1 78 LEU HB3  . . 4.450 3.926 3.798 4.076     .  0 0 "[    .    1    .    2]" 1 
       1681 1 75 VAL HA   1 78 LEU MD1  . . 3.540 2.343 2.119 2.550     .  0 0 "[    .    1    .    2]" 1 
       1682 1 75 VAL HA   1 78 LEU MD2  . . 4.450 3.819 3.730 4.149     .  0 0 "[    .    1    .    2]" 1 
       1683 1 75 VAL HA   1 78 LEU HG   . . 3.600 2.122 1.992 2.609     .  0 0 "[    .    1    .    2]" 1 
       1684 1 75 VAL HA   1 83 ARG HA   . . 5.190 4.987 4.756 5.156     .  0 0 "[    .    1    .    2]" 1 
       1685 1 75 VAL HA   1 83 ARG QG   . . 4.620 3.773 3.014 4.013     .  0 0 "[    .    1    .    2]" 1 
       1686 1 75 VAL HA   1 86 TYR QD   . . 5.030 5.046 5.008 5.080 0.050  9 0 "[    .    1    .    2]" 1 
       1687 1 75 VAL HB   1 76 LYS H    . . 3.680 2.679 2.492 2.935     .  0 0 "[    .    1    .    2]" 1 
       1688 1 75 VAL HB   1 76 LYS HG3  . . 4.450 3.615 3.290 4.163     .  0 0 "[    .    1    .    2]" 1 
       1689 1 75 VAL HB   1 77 SER H    . . 5.500 4.709 4.621 4.797     .  0 0 "[    .    1    .    2]" 1 
       1690 1 75 VAL HB   1 78 LEU MD1  . . 5.350 4.487 4.327 4.719     .  0 0 "[    .    1    .    2]" 1 
       1691 1 75 VAL HB   1 86 TYR QE   . . 5.380 4.677 4.175 5.300     .  0 0 "[    .    1    .    2]" 1 
       1692 1 75 VAL MG1  1 76 LYS H    . . 4.090 3.243 3.044 3.701     .  0 0 "[    .    1    .    2]" 1 
       1693 1 75 VAL MG1  1 76 LYS HA   . . 3.950 3.289 3.153 3.621     .  0 0 "[    .    1    .    2]" 1 
       1694 1 75 VAL MG1  1 76 LYS HG2  . . 4.950 4.164 3.196 4.887     .  0 0 "[    .    1    .    2]" 1 
       1695 1 75 VAL MG1  1 77 SER H    . . 4.990 4.424 4.388 4.507     .  0 0 "[    .    1    .    2]" 1 
       1696 1 75 VAL MG1  1 78 LEU H    . . 4.950 3.994 3.836 4.085     .  0 0 "[    .    1    .    2]" 1 
       1697 1 75 VAL MG1  1 78 LEU MD1  . . 3.930 3.006 2.825 3.169     .  0 0 "[    .    1    .    2]" 1 
       1698 1 75 VAL MG1  1 78 LEU MD2  . . 4.850 4.864 4.831 4.940 0.090 19 0 "[    .    1    .    2]" 1 
       1699 1 75 VAL MG1  1 78 LEU HG   . . 4.510 4.016 3.901 4.316     .  0 0 "[    .    1    .    2]" 1 
       1700 1 75 VAL MG1  1 83 ARG HA   . . 4.850 3.707 3.241 3.817     .  0 0 "[    .    1    .    2]" 1 
       1701 1 75 VAL MG1  1 83 ARG HB2  . . 5.350 3.957 3.876 4.089     .  0 0 "[    .    1    .    2]" 1 
       1702 1 75 VAL MG1  1 83 ARG HB3  . . 4.950 4.417 4.039 4.519     .  0 0 "[    .    1    .    2]" 1 
       1703 1 75 VAL MG1  1 83 ARG QD   . . 3.410 1.862 1.767 1.990     .  0 0 "[    .    1    .    2]" 1 
       1704 1 75 VAL MG1  1 83 ARG QG   . . 3.450 1.944 1.727 2.008     .  0 0 "[    .    1    .    2]" 1 
       1705 1 75 VAL MG1  1 86 TYR QD   . . 4.020 3.315 2.670 3.902     .  0 0 "[    .    1    .    2]" 1 
       1706 1 75 VAL MG1  1 86 TYR QE   . . 4.510 3.092 2.459 3.804     .  0 0 "[    .    1    .    2]" 1 
       1707 1 75 VAL MG2  1 76 LYS H    . . 4.370 4.007 3.930 4.088     .  0 0 "[    .    1    .    2]" 1 
       1708 1 75 VAL MG2  1 77 SER H    . . 5.500 4.945 4.853 4.986     .  0 0 "[    .    1    .    2]" 1 
       1709 1 75 VAL MG2  1 78 LEU H    . . 5.500 4.679 4.546 5.103     .  0 0 "[    .    1    .    2]" 1 
       1710 1 75 VAL MG2  1 78 LEU MD1  . . 4.010 2.345 2.179 2.646     .  0 0 "[    .    1    .    2]" 1 
       1711 1 75 VAL MG2  1 78 LEU MD2  . . 4.690 4.418 4.272 4.701 0.011  9 0 "[    .    1    .    2]" 1 
       1712 1 75 VAL MG2  1 78 LEU HG   . . 3.830 3.476 3.306 3.845 0.015  9 0 "[    .    1    .    2]" 1 
       1713 1 75 VAL MG2  1 83 ARG QD   . . 4.410 4.099 3.930 4.511 0.101  9 0 "[    .    1    .    2]" 1 
       1714 1 75 VAL MG2  1 83 ARG QG   . . 3.610 3.618 3.596 3.642 0.032 19 0 "[    .    1    .    2]" 1 
       1715 1 75 VAL MG2  1 86 TYR QD   . . 4.080 3.156 2.932 3.283     .  0 0 "[    .    1    .    2]" 1 
       1716 1 75 VAL MG2  1 86 TYR QE   . . 3.570 2.450 1.967 2.831     .  0 0 "[    .    1    .    2]" 1 
       1717 1 76 LYS H    1 76 LYS QB   . . 3.110 2.385 2.112 2.623     .  0 0 "[    .    1    .    2]" 1 
       1718 1 76 LYS H    1 76 LYS QD   . . 4.450 3.577 3.253 4.271     .  0 0 "[    .    1    .    2]" 1 
       1719 1 76 LYS H    1 76 LYS QE   . . 4.950 4.360 2.970 4.843     .  0 0 "[    .    1    .    2]" 1 
       1720 1 76 LYS H    1 76 LYS HG2  . . 4.410 3.379 2.033 4.161     .  0 0 "[    .    1    .    2]" 1 
       1721 1 76 LYS H    1 76 LYS HG3  . . 3.630 2.265 1.969 2.983     .  0 0 "[    .    1    .    2]" 1 
       1722 1 76 LYS H    1 77 SER H    . . 3.510 2.703 2.568 2.786     .  0 0 "[    .    1    .    2]" 1 
       1723 1 76 LYS H    1 78 LEU H    . . 5.090 4.083 3.941 4.201     .  0 0 "[    .    1    .    2]" 1 
       1724 1 76 LYS HA   1 76 LYS QD   . . 4.280 4.021 3.291 4.207     .  0 0 "[    .    1    .    2]" 1 
       1725 1 76 LYS HA   1 76 LYS QE   . . 4.090 4.030 3.818 4.101 0.011 13 0 "[    .    1    .    2]" 1 
       1726 1 76 LYS HA   1 76 LYS HG2  . . 3.610 2.561 2.388 2.789     .  0 0 "[    .    1    .    2]" 1 
       1727 1 76 LYS HA   1 76 LYS HG3  . . 4.120 2.860 2.290 3.694     .  0 0 "[    .    1    .    2]" 1 
       1728 1 76 LYS HA   1 78 LEU H    . . 4.950 4.147 3.532 4.459     .  0 0 "[    .    1    .    2]" 1 
       1729 1 76 LYS QB   1 76 LYS QD   . . 3.300 2.240 1.975 2.387     .  0 0 "[    .    1    .    2]" 1 
       1730 1 76 LYS QB   1 76 LYS QE   . . 3.750 2.257 1.930 3.559     .  0 0 "[    .    1    .    2]" 1 
       1731 1 76 LYS QB   1 77 SER H    . . 3.760 3.171 3.055 3.440     .  0 0 "[    .    1    .    2]" 1 
       1732 1 76 LYS QB   1 77 SER HA   . . 4.560 4.104 4.037 4.244     .  0 0 "[    .    1    .    2]" 1 
       1733 1 76 LYS QB   1 78 LEU H    . . 5.040 4.829 4.610 4.916     .  0 0 "[    .    1    .    2]" 1 
       1734 1 76 LYS QE   1 76 LYS HG2  . . 3.800 2.611 2.152 3.397     .  0 0 "[    .    1    .    2]" 1 
       1735 1 76 LYS HG2  1 77 SER H    . . 5.500 5.216 4.446 5.519 0.019 15 0 "[    .    1    .    2]" 1 
       1736 1 77 SER H    1 77 SER QB   . . 3.260 2.266 2.085 2.520     .  0 0 "[    .    1    .    2]" 1 
       1737 1 77 SER H    1 78 LEU H    . . 3.420 2.214 1.933 2.376     .  0 0 "[    .    1    .    2]" 1 
       1738 1 77 SER H    1 78 LEU HB2  . . 4.450 4.182 3.803 4.328     .  0 0 "[    .    1    .    2]" 1 
       1739 1 77 SER H    1 78 LEU MD2  . . 5.420 4.752 4.573 4.946     .  0 0 "[    .    1    .    2]" 1 
       1740 1 77 SER H    1 78 LEU HG   . . 4.450 4.001 3.630 4.152     .  0 0 "[    .    1    .    2]" 1 
       1741 1 77 SER H    1 83 ARG QD   . . 5.500 4.753 4.542 5.593 0.093 19 0 "[    .    1    .    2]" 1 
       1742 1 77 SER QB   1 78 LEU H    . . 4.350 3.033 2.731 3.612     .  0 0 "[    .    1    .    2]" 1 
       1743 1 77 SER QB   1 78 LEU HA   . . 4.950 3.984 3.770 4.269     .  0 0 "[    .    1    .    2]" 1 
       1744 1 77 SER QB   1 78 LEU HG   . . 4.850 4.088 3.950 4.244     .  0 0 "[    .    1    .    2]" 1 
       1745 1 78 LEU H    1 78 LEU HB2  . . 3.620 2.287 2.126 2.357     .  0 0 "[    .    1    .    2]" 1 
       1746 1 78 LEU H    1 78 LEU HB3  . . 4.120 3.506 3.431 3.546     .  0 0 "[    .    1    .    2]" 1 
       1747 1 78 LEU H    1 78 LEU MD1  . . 3.970 3.848 3.711 3.984 0.014 15 0 "[    .    1    .    2]" 1 
       1748 1 78 LEU H    1 78 LEU MD2  . . 4.180 3.359 3.064 3.808     .  0 0 "[    .    1    .    2]" 1 
       1749 1 78 LEU H    1 78 LEU HG   . . 3.370 2.594 2.361 3.003     .  0 0 "[    .    1    .    2]" 1 
       1750 1 78 LEU H    1 79 SER H    . . 4.790 4.577 4.544 4.647     .  0 0 "[    .    1    .    2]" 1 
       1751 1 78 LEU H    1 83 ARG HB2  . . 5.500 4.853 4.598 5.000     .  0 0 "[    .    1    .    2]" 1 
       1752 1 78 LEU H    1 83 ARG QD   . . 4.770 3.795 3.344 4.824 0.054  9 0 "[    .    1    .    2]" 1 
       1753 1 78 LEU HA   1 78 LEU MD1  . . 4.280 3.766 3.724 3.805     .  0 0 "[    .    1    .    2]" 1 
       1754 1 78 LEU HA   1 78 LEU MD2  . . 3.150 1.966 1.884 2.045     .  0 0 "[    .    1    .    2]" 1 
       1755 1 78 LEU HA   1 79 SER H    . . 3.150 2.210 2.181 2.310     .  0 0 "[    .    1    .    2]" 1 
       1756 1 78 LEU HA   1 82 ASP HB2  . . 4.690 3.442 3.242 3.742     .  0 0 "[    .    1    .    2]" 1 
       1757 1 78 LEU HA   1 82 ASP HB3  . . 4.950 4.093 3.863 4.499     .  0 0 "[    .    1    .    2]" 1 
       1758 1 78 LEU HB2  1 78 LEU MD1  . . 3.390 2.419 2.295 2.506     .  0 0 "[    .    1    .    2]" 1 
       1759 1 78 LEU HB2  1 79 SER H    . . 4.430 4.361 4.127 4.469 0.039 19 0 "[    .    1    .    2]" 1 
       1760 1 78 LEU HB2  1 82 ASP HB2  . . 4.450 4.340 4.173 4.480 0.030 19 0 "[    .    1    .    2]" 1 
       1761 1 78 LEU HB2  1 82 ASP HB3  . . 4.620 4.562 4.483 4.623 0.003  2 0 "[    .    1    .    2]" 1 
       1762 1 78 LEU HB2  1 83 ARG H    . . 3.980 3.870 3.740 3.993 0.013 15 0 "[    .    1    .    2]" 1 
       1763 1 78 LEU HB2  1 83 ARG HA   . . 4.850 3.579 3.376 3.880     .  0 0 "[    .    1    .    2]" 1 
       1764 1 78 LEU HB2  1 83 ARG HB2  . . 4.280 3.057 2.918 3.582     .  0 0 "[    .    1    .    2]" 1 
       1765 1 78 LEU HB2  1 83 ARG QD   . . 5.190 2.740 2.499 4.099     .  0 0 "[    .    1    .    2]" 1 
       1766 1 78 LEU HB3  1 79 SER H    . . 3.850 3.331 2.911 3.487     .  0 0 "[    .    1    .    2]" 1 
       1767 1 78 LEU HB3  1 82 ASP H    . . 5.210 4.520 4.421 4.679     .  0 0 "[    .    1    .    2]" 1 
       1768 1 78 LEU HB3  1 82 ASP HB2  . . 4.090 2.636 2.441 2.750     .  0 0 "[    .    1    .    2]" 1 
       1769 1 78 LEU HB3  1 82 ASP HB3  . . 4.250 2.901 2.796 2.992     .  0 0 "[    .    1    .    2]" 1 
       1770 1 78 LEU HB3  1 83 ARG H    . . 4.370 2.545 2.394 2.649     .  0 0 "[    .    1    .    2]" 1 
       1771 1 78 LEU HB3  1 83 ARG HA   . . 4.410 3.000 2.808 3.306     .  0 0 "[    .    1    .    2]" 1 
       1772 1 78 LEU HB3  1 83 ARG HB2  . . 4.510 2.772 2.666 2.967     .  0 0 "[    .    1    .    2]" 1 
       1773 1 78 LEU HB3  1 83 ARG HB3  . . 4.560 4.345 4.265 4.450     .  0 0 "[    .    1    .    2]" 1 
       1774 1 78 LEU HB3  1 83 ARG QD   . . 5.500 3.752 3.515 4.800     .  0 0 "[    .    1    .    2]" 1 
       1775 1 78 LEU HB3  1 83 ARG QG   . . 4.850 3.376 2.563 3.634     .  0 0 "[    .    1    .    2]" 1 
       1776 1 78 LEU MD1  1 79 SER H    . . 4.950 4.867 4.610 4.949     .  0 0 "[    .    1    .    2]" 1 
       1777 1 78 LEU MD1  1 82 ASP H    . . 5.500 5.468 5.348 5.521 0.021 15 0 "[    .    1    .    2]" 1 
       1778 1 78 LEU MD1  1 82 ASP HA   . . 5.500 4.837 4.746 4.948     .  0 0 "[    .    1    .    2]" 1 
       1779 1 78 LEU MD1  1 82 ASP HB2  . . 4.560 3.815 3.667 3.925     .  0 0 "[    .    1    .    2]" 1 
       1780 1 78 LEU MD1  1 82 ASP HB3  . . 4.410 2.965 2.752 3.077     .  0 0 "[    .    1    .    2]" 1 
       1781 1 78 LEU MD1  1 83 ARG H    . . 4.760 3.718 3.575 3.849     .  0 0 "[    .    1    .    2]" 1 
       1782 1 78 LEU MD1  1 83 ARG HA   . . 3.550 2.433 2.318 2.667     .  0 0 "[    .    1    .    2]" 1 
       1783 1 78 LEU MD1  1 83 ARG HB2  . . 4.620 3.814 3.658 4.146     .  0 0 "[    .    1    .    2]" 1 
       1784 1 78 LEU MD1  1 83 ARG HB3  . . 4.850 4.763 4.673 4.889 0.039 19 0 "[    .    1    .    2]" 1 
       1785 1 78 LEU MD1  1 83 ARG QD   . . 4.850 3.856 3.495 4.726     .  0 0 "[    .    1    .    2]" 1 
       1786 1 78 LEU MD1  1 83 ARG QG   . . 4.450 2.846 2.604 3.040     .  0 0 "[    .    1    .    2]" 1 
       1787 1 78 LEU MD1  1 84 ALA H    . . 5.500 5.430 5.328 5.543 0.043 19 0 "[    .    1    .    2]" 1 
       1788 1 78 LEU MD1  1 86 TYR HB3  . . 4.150 2.918 2.680 3.326     .  0 0 "[    .    1    .    2]" 1 
       1789 1 78 LEU MD1  1 86 TYR QD   . . 4.420 3.065 2.832 3.541     .  0 0 "[    .    1    .    2]" 1 
       1790 1 78 LEU MD1  1 86 TYR QE   . . 4.900 4.005 3.873 4.396     .  0 0 "[    .    1    .    2]" 1 
       1791 1 78 LEU MD2  1 79 SER H    . . 3.990 3.101 2.835 3.284     .  0 0 "[    .    1    .    2]" 1 
       1792 1 78 LEU MD2  1 82 ASP H    . . 5.500 4.806 4.419 5.012     .  0 0 "[    .    1    .    2]" 1 
       1793 1 78 LEU MD2  1 82 ASP HA   . . 4.950 4.720 4.516 4.893     .  0 0 "[    .    1    .    2]" 1 
       1794 1 78 LEU MD2  1 82 ASP HB2  . . 4.010 2.770 2.453 2.964     .  0 0 "[    .    1    .    2]" 1 
       1795 1 78 LEU MD2  1 82 ASP HB3  . . 3.850 2.433 2.146 2.580     .  0 0 "[    .    1    .    2]" 1 
       1796 1 78 LEU MD2  1 83 ARG H    . . 5.340 4.131 3.882 4.293     .  0 0 "[    .    1    .    2]" 1 
       1797 1 78 LEU MD2  1 83 ARG HA   . . 4.560 4.527 4.460 4.587 0.027 19 0 "[    .    1    .    2]" 1 
       1798 1 78 LEU HG   1 79 SER H    . . 5.350 5.091 4.909 5.244     .  0 0 "[    .    1    .    2]" 1 
       1799 1 78 LEU HG   1 82 ASP HB2  . . 5.190 5.124 4.970 5.199 0.009  3 0 "[    .    1    .    2]" 1 
       1800 1 79 SER H    1 79 SER QB   . . 3.590 2.317 1.996 2.893     .  0 0 "[    .    1    .    2]" 1 
       1801 1 79 SER H    1 80 PRO HD2  . . 4.730 4.726 4.686 4.786 0.056 19 0 "[    .    1    .    2]" 1 
       1802 1 79 SER H    1 80 PRO HD3  . . 4.730 4.754 4.737 4.783 0.053 15 0 "[    .    1    .    2]" 1 
       1803 1 79 SER H    1 81 GLN H    . . 5.500 4.650 4.492 4.746     .  0 0 "[    .    1    .    2]" 1 
       1804 1 79 SER H    1 82 ASP H    . . 4.910 3.795 3.581 4.107     .  0 0 "[    .    1    .    2]" 1 
       1805 1 79 SER H    1 82 ASP HB2  . . 4.090 2.579 2.323 3.037     .  0 0 "[    .    1    .    2]" 1 
       1806 1 79 SER H    1 82 ASP HB3  . . 4.470 4.008 3.758 4.490 0.020 19 0 "[    .    1    .    2]" 1 
       1807 1 79 SER H    1 83 ARG H    . . 5.210 3.887 3.636 4.152     .  0 0 "[    .    1    .    2]" 1 
       1808 1 79 SER HA   1 80 PRO HD2  . . 3.270 3.143 3.078 3.179     .  0 0 "[    .    1    .    2]" 1 
       1809 1 79 SER HA   1 80 PRO HD3  . . 3.340 2.323 2.264 2.356     .  0 0 "[    .    1    .    2]" 1 
       1810 1 79 SER HA   1 81 GLN H    . . 4.830 4.185 4.066 4.229     .  0 0 "[    .    1    .    2]" 1 
       1811 1 79 SER QB   1 80 PRO HD2  . . 3.850 1.930 1.784 2.022     .  0 0 "[    .    1    .    2]" 1 
       1812 1 79 SER QB   1 80 PRO HD3  . . 3.700 2.606 2.312 3.040     .  0 0 "[    .    1    .    2]" 1 
       1813 1 79 SER QB   1 81 GLN H    . . 4.350 2.374 1.959 3.246     .  0 0 "[    .    1    .    2]" 1 
       1814 1 79 SER QB   1 81 GLN HB2  . . 4.770 3.684 3.049 5.176 0.406 14 0 "[    .    1    .    2]" 1 
       1815 1 79 SER QB   1 82 ASP H    . . 5.060 2.792 2.442 3.534     .  0 0 "[    .    1    .    2]" 1 
       1816 1 80 PRO HA   1 82 ASP H    . . 5.190 4.672 4.459 4.968     .  0 0 "[    .    1    .    2]" 1 
       1817 1 80 PRO HA   1 83 ARG H    . . 4.290 4.082 3.960 4.271     .  0 0 "[    .    1    .    2]" 1 
       1818 1 80 PRO HA   1 83 ARG HB2  . . 3.800 3.750 3.375 3.822 0.022 15 0 "[    .    1    .    2]" 1 
       1819 1 80 PRO HA   1 83 ARG HB3  . . 3.620 3.520 3.347 3.739 0.119 19 0 "[    .    1    .    2]" 1 
       1820 1 80 PRO HA   1 83 ARG QD   . . 4.450 4.440 4.332 4.632 0.182  9 0 "[    .    1    .    2]" 1 
       1821 1 80 PRO HA   1 84 ALA H    . . 4.770 3.867 3.659 3.993     .  0 0 "[    .    1    .    2]" 1 
       1822 1 80 PRO HA   1 84 ALA MB   . . 5.060 4.165 4.002 4.266     .  0 0 "[    .    1    .    2]" 1 
       1823 1 80 PRO HB2  1 81 GLN H    . . 4.010 3.764 3.713 3.893     .  0 0 "[    .    1    .    2]" 1 
       1824 1 80 PRO HB2  1 84 ALA MB   . . 4.620 4.587 4.433 4.639 0.019  8 0 "[    .    1    .    2]" 1 
       1825 1 80 PRO HB3  1 81 GLN H    . . 4.510 4.476 4.449 4.544 0.034 19 0 "[    .    1    .    2]" 1 
       1826 1 80 PRO HD2  1 81 GLN H    . . 4.410 2.416 2.375 2.538     .  0 0 "[    .    1    .    2]" 1 
       1827 1 80 PRO HD3  1 81 GLN H    . . 4.060 3.699 3.684 3.748     .  0 0 "[    .    1    .    2]" 1 
       1828 1 80 PRO HG2  1 81 GLN H    . . 4.540 3.434 3.358 3.634     .  0 0 "[    .    1    .    2]" 1 
       1829 1 81 GLN H    1 81 GLN HB2  . . 3.330 2.602 2.429 2.994     .  0 0 "[    .    1    .    2]" 1 
       1830 1 81 GLN H    1 81 GLN HB3  . . 3.670 3.298 2.278 3.639     .  0 0 "[    .    1    .    2]" 1 
       1831 1 81 GLN H    1 81 GLN HG2  . . 4.560 3.935 3.678 4.255     .  0 0 "[    .    1    .    2]" 1 
       1832 1 81 GLN H    1 81 GLN HG3  . . 4.510 2.971 2.291 4.588 0.078  4 0 "[    .    1    .    2]" 1 
       1833 1 81 GLN H    1 82 ASP H    . . 3.470 2.274 2.201 2.407     .  0 0 "[    .    1    .    2]" 1 
       1834 1 81 GLN H    1 82 ASP HB2  . . 5.150 4.191 4.150 4.258     .  0 0 "[    .    1    .    2]" 1 
       1835 1 81 GLN H    1 83 ARG H    . . 4.700 3.938 3.834 4.082     .  0 0 "[    .    1    .    2]" 1 
       1836 1 81 GLN H    1 84 ALA MB   . . 5.500 4.332 4.221 4.415     .  0 0 "[    .    1    .    2]" 1 
       1837 1 81 GLN HA   1 81 GLN HG2  . . 3.630 2.938 2.642 3.598     .  0 0 "[    .    1    .    2]" 1 
       1838 1 81 GLN HA   1 81 GLN HG3  . . 3.200 2.731 2.584 2.896     .  0 0 "[    .    1    .    2]" 1 
       1839 1 81 GLN HA   1 83 ARG H    . . 5.060 4.908 4.720 5.010     .  0 0 "[    .    1    .    2]" 1 
       1840 1 81 GLN HA   1 84 ALA MB   . . 3.250 2.411 2.190 2.523     .  0 0 "[    .    1    .    2]" 1 
       1841 1 81 GLN HB2  1 82 ASP H    . . 3.890 2.973 2.308 3.960 0.070 15 0 "[    .    1    .    2]" 1 
       1842 1 81 GLN HB2  1 83 ARG H    . . 5.340 5.489 5.055 6.202 0.862 15 5 "[ - *.  * 1   *+    2]" 1 
       1843 1 81 GLN HB2  1 84 ALA MB   . . 5.340 4.754 4.327 4.937     .  0 0 "[    .    1    .    2]" 1 
       1844 1 81 GLN HB3  1 82 ASP H    . . 3.930 3.458 2.540 3.873     .  0 0 "[    .    1    .    2]" 1 
       1845 1 81 GLN HB3  1 84 ALA MB   . . 4.320 4.409 4.173 4.765 0.445 15 0 "[    .    1    .    2]" 1 
       1846 1 81 GLN HG2  1 84 ALA MB   . . 4.950 4.671 4.113 4.928     .  0 0 "[    .    1    .    2]" 1 
       1847 1 81 GLN HG3  1 82 ASP H    . . 4.690 4.280 3.994 4.638     .  0 0 "[    .    1    .    2]" 1 
       1848 1 81 GLN HG3  1 84 ALA MB   . . 4.950 4.505 3.600 4.901     .  0 0 "[    .    1    .    2]" 1 
       1849 1 82 ASP H    1 82 ASP HB2  . . 3.720 2.279 2.217 2.396     .  0 0 "[    .    1    .    2]" 1 
       1850 1 82 ASP H    1 82 ASP HB3  . . 3.970 3.510 3.488 3.538     .  0 0 "[    .    1    .    2]" 1 
       1851 1 82 ASP H    1 83 ARG H    . . 3.600 2.759 2.639 2.901     .  0 0 "[    .    1    .    2]" 1 
       1852 1 82 ASP H    1 84 ALA H    . . 5.270 3.977 3.818 4.250     .  0 0 "[    .    1    .    2]" 1 
       1853 1 82 ASP H    1 84 ALA MB   . . 5.090 4.420 4.351 4.595     .  0 0 "[    .    1    .    2]" 1 
       1854 1 82 ASP HA   1 84 ALA H    . . 5.090 4.394 4.165 4.651     .  0 0 "[    .    1    .    2]" 1 
       1855 1 82 ASP HA   1 85 ALA H    . . 4.050 3.528 3.383 3.692     .  0 0 "[    .    1    .    2]" 1 
       1856 1 82 ASP HA   1 85 ALA MB   . . 3.420 2.973 2.640 3.146     .  0 0 "[    .    1    .    2]" 1 
       1857 1 82 ASP HA   1 86 TYR H    . . 5.500 4.245 4.004 4.583     .  0 0 "[    .    1    .    2]" 1 
       1858 1 82 ASP HB2  1 83 ARG H    . . 4.230 2.313 2.248 2.382     .  0 0 "[    .    1    .    2]" 1 
       1859 1 82 ASP HB3  1 83 ARG H    . . 4.560 3.122 2.929 3.249     .  0 0 "[    .    1    .    2]" 1 
       1860 1 82 ASP HB3  1 85 ALA MB   . . 4.950 4.427 4.242 4.782     .  0 0 "[    .    1    .    2]" 1 
       1861 1 82 ASP HB3  1 86 TYR HB3  . . 5.350 4.951 4.582 5.312     .  0 0 "[    .    1    .    2]" 1 
       1862 1 83 ARG H    1 83 ARG HB2  . . 3.640 2.097 2.029 2.135     .  0 0 "[    .    1    .    2]" 1 
       1863 1 83 ARG H    1 83 ARG HB3  . . 3.650 2.978 2.899 3.223     .  0 0 "[    .    1    .    2]" 1 
       1864 1 83 ARG H    1 83 ARG QD   . . 5.040 4.106 3.992 4.713     .  0 0 "[    .    1    .    2]" 1 
       1865 1 83 ARG H    1 83 ARG QG   . . 4.280 3.728 3.350 3.809     .  0 0 "[    .    1    .    2]" 1 
       1866 1 83 ARG H    1 84 ALA H    . . 3.570 2.819 2.727 2.947     .  0 0 "[    .    1    .    2]" 1 
       1867 1 83 ARG H    1 84 ALA HA   . . 5.500 5.324 5.245 5.422     .  0 0 "[    .    1    .    2]" 1 
       1868 1 83 ARG H    1 84 ALA MB   . . 4.770 4.318 4.191 4.393     .  0 0 "[    .    1    .    2]" 1 
       1869 1 83 ARG H    1 85 ALA H    . . 5.090 4.177 4.031 4.574     .  0 0 "[    .    1    .    2]" 1 
       1870 1 83 ARG HA   1 83 ARG QD   . . 3.720 3.759 3.723 3.943 0.223  9 0 "[    .    1    .    2]" 1 
       1871 1 83 ARG HA   1 83 ARG QG   . . 3.460 2.122 2.104 2.177     .  0 0 "[    .    1    .    2]" 1 
       1872 1 83 ARG HA   1 84 ALA MB   . . 4.950 4.992 4.973 5.018 0.068 19 0 "[    .    1    .    2]" 1 
       1873 1 83 ARG HA   1 85 ALA H    . . 5.040 3.953 3.702 4.571     .  0 0 "[    .    1    .    2]" 1 
       1874 1 83 ARG HA   1 85 ALA MB   . . 4.950 4.661 4.457 4.953 0.003  7 0 "[    .    1    .    2]" 1 
       1875 1 83 ARG HA   1 86 TYR HB3  . . 3.540 2.143 2.002 2.379     .  0 0 "[    .    1    .    2]" 1 
       1876 1 83 ARG HA   1 86 TYR QD   . . 4.230 3.703 3.390 4.111     .  0 0 "[    .    1    .    2]" 1 
       1877 1 83 ARG HB2  1 84 ALA H    . . 4.180 3.523 3.169 3.673     .  0 0 "[    .    1    .    2]" 1 
       1878 1 83 ARG HB3  1 84 ALA H    . . 3.690 2.706 2.537 2.841     .  0 0 "[    .    1    .    2]" 1 
       1879 1 83 ARG QG   1 84 ALA H    . . 4.260 4.227 4.142 4.384 0.124 19 0 "[    .    1    .    2]" 1 
       1880 1 83 ARG QG   1 86 TYR HB3  . . 4.690 3.151 2.825 3.414     .  0 0 "[    .    1    .    2]" 1 
       1881 1 84 ALA H    1 84 ALA MB   . . 2.890 2.065 1.960 2.149     .  0 0 "[    .    1    .    2]" 1 
       1882 1 84 ALA H    1 85 ALA H    . . 3.490 2.768 2.633 3.014     .  0 0 "[    .    1    .    2]" 1 
       1883 1 84 ALA H    1 86 TYR H    . . 4.760 4.545 4.307 4.758     .  0 0 "[    .    1    .    2]" 1 
       1884 1 84 ALA H    1 86 TYR HB3  . . 4.990 4.987 4.901 5.018 0.028  7 0 "[    .    1    .    2]" 1 
       1885 1 84 ALA H    1 87 LYS QB   . . 4.950 4.795 4.489 4.988 0.038  6 0 "[    .    1    .    2]" 1 
       1886 1 84 ALA HA   1 87 LYS H    . . 4.180 4.073 3.864 4.184 0.004  2 0 "[    .    1    .    2]" 1 
       1887 1 84 ALA HA   1 87 LYS QB   . . 3.560 3.207 2.869 3.468     .  0 0 "[    .    1    .    2]" 1 
       1888 1 84 ALA HA   1 88 GLU H    . . 4.770 4.339 3.803 4.744     .  0 0 "[    .    1    .    2]" 1 
       1889 1 84 ALA MB   1 85 ALA H    . . 3.230 2.817 2.467 2.982     .  0 0 "[    .    1    .    2]" 1 
       1890 1 85 ALA H    1 85 ALA MB   . . 2.870 2.148 1.966 2.236     .  0 0 "[    .    1    .    2]" 1 
       1891 1 85 ALA H    1 86 TYR H    . . 3.520 2.584 2.353 2.960     .  0 0 "[    .    1    .    2]" 1 
       1892 1 85 ALA H    1 86 TYR HA   . . 5.500 5.104 4.942 5.407     .  0 0 "[    .    1    .    2]" 1 
       1893 1 85 ALA H    1 86 TYR HB3  . . 4.790 4.202 3.950 4.692     .  0 0 "[    .    1    .    2]" 1 
       1894 1 85 ALA H    1 87 LYS QB   . . 5.150 4.804 4.570 5.045     .  0 0 "[    .    1    .    2]" 1 
       1895 1 85 ALA H    1 88 GLU QB   . . 5.090 4.593 4.144 4.956     .  0 0 "[    .    1    .    2]" 1 
       1896 1 85 ALA HA   1 87 LYS H    . . 4.950 4.557 4.269 4.965 0.015 20 0 "[    .    1    .    2]" 1 
       1897 1 85 ALA HA   1 88 GLU H    . . 4.150 3.311 3.159 3.548     .  0 0 "[    .    1    .    2]" 1 
       1898 1 85 ALA HA   1 88 GLU HA   . . 5.060 5.025 4.918 5.107 0.047  2 0 "[    .    1    .    2]" 1 
       1899 1 85 ALA HA   1 88 GLU QB   . . 3.470 2.307 2.115 2.513     .  0 0 "[    .    1    .    2]" 1 
       1900 1 85 ALA HA   1 88 GLU HG2  . . 4.850 3.684 3.528 3.937     .  0 0 "[    .    1    .    2]" 1 
       1901 1 85 ALA HA   1 88 GLU HG3  . . 4.690 4.781 4.529 4.880 0.190  6 0 "[    .    1    .    2]" 1 
       1902 1 85 ALA MB   1 86 TYR H    . . 3.670 2.306 2.134 2.580     .  0 0 "[    .    1    .    2]" 1 
       1903 1 85 ALA MB   1 86 TYR HA   . . 4.620 3.750 3.617 3.822     .  0 0 "[    .    1    .    2]" 1 
       1904 1 85 ALA MB   1 86 TYR HB3  . . 4.510 4.304 4.191 4.447     .  0 0 "[    .    1    .    2]" 1 
       1905 1 85 ALA MB   1 88 GLU QB   . . 4.280 3.760 3.644 3.885     .  0 0 "[    .    1    .    2]" 1 
       1906 1 85 ALA MB   1 89 TYR H    . . 5.420 5.003 4.883 5.151     .  0 0 "[    .    1    .    2]" 1 
       1907 1 86 TYR H    1 86 TYR HB2  . . 3.890 2.412 2.216 2.499     .  0 0 "[    .    1    .    2]" 1 
       1908 1 86 TYR H    1 86 TYR HB3  . . 3.620 2.308 2.196 2.570     .  0 0 "[    .    1    .    2]" 1 
       1909 1 86 TYR H    1 86 TYR QD   . . 4.270 4.069 4.040 4.104     .  0 0 "[    .    1    .    2]" 1 
       1910 1 86 TYR HA   1 86 TYR QD   . . 3.480 3.102 2.740 3.309     .  0 0 "[    .    1    .    2]" 1 
       1911 1 86 TYR HA   1 88 GLU H    . . 5.150 4.443 4.151 4.612     .  0 0 "[    .    1    .    2]" 1 
       1912 1 86 TYR HA   1 89 TYR H    . . 4.300 3.586 3.449 3.685     .  0 0 "[    .    1    .    2]" 1 
       1913 1 86 TYR HA   1 89 TYR QD   . . 4.230 4.142 3.306 4.251 0.021  6 0 "[    .    1    .    2]" 1 
       1914 1 86 TYR HA   1 90 ILE H    . . 5.340 4.575 4.349 4.994     .  0 0 "[    .    1    .    2]" 1 
       1915 1 86 TYR HB3  1 87 LYS H    . . 3.760 2.338 2.118 2.541     .  0 0 "[    .    1    .    2]" 1 
       1916 1 86 TYR QD   1 87 LYS H    . . 4.150 2.600 2.244 3.233     .  0 0 "[    .    1    .    2]" 1 
       1917 1 86 TYR QD   1 87 LYS HA   . . 4.420 2.741 2.398 3.306     .  0 0 "[    .    1    .    2]" 1 
       1918 1 86 TYR QD   1 87 LYS QB   . . 5.190 3.369 2.908 4.171     .  0 0 "[    .    1    .    2]" 1 
       1919 1 86 TYR QD   1 87 LYS HG2  . . 4.190 3.000 2.350 4.375 0.185  6 0 "[    .    1    .    2]" 1 
       1920 1 86 TYR QD   1 87 LYS HG3  . . 4.850 3.558 3.211 4.398     .  0 0 "[    .    1    .    2]" 1 
       1921 1 86 TYR QD   1 90 ILE H    . . 4.700 4.634 4.412 4.754 0.054  8 0 "[    .    1    .    2]" 1 
       1922 1 86 TYR QD   1 90 ILE MD   . . 4.620 3.655 3.476 3.807     .  0 0 "[    .    1    .    2]" 1 
       1923 1 86 TYR QD   1 90 ILE HG12 . . 5.190 3.554 3.247 3.821     .  0 0 "[    .    1    .    2]" 1 
       1924 1 86 TYR QD   1 90 ILE HG13 . . 5.030 2.777 2.632 2.904     .  0 0 "[    .    1    .    2]" 1 
       1925 1 86 TYR QD   1 90 ILE MG   . . 4.690 4.676 4.544 4.724 0.034 11 0 "[    .    1    .    2]" 1 
       1926 1 86 TYR QE   1 87 LYS H    . . 5.500 4.917 4.608 5.468     .  0 0 "[    .    1    .    2]" 1 
       1927 1 86 TYR QE   1 87 LYS HA   . . 4.900 3.838 3.499 4.682     .  0 0 "[    .    1    .    2]" 1 
       1928 1 86 TYR QE   1 87 LYS HG2  . . 4.620 3.619 2.959 5.111 0.491  6 0 "[    .    1    .    2]" 1 
       1929 1 86 TYR QE   1 90 ILE HB   . . 5.190 4.393 4.069 4.994     .  0 0 "[    .    1    .    2]" 1 
       1930 1 86 TYR QE   1 90 ILE MD   . . 3.470 2.469 2.135 2.795     .  0 0 "[    .    1    .    2]" 1 
       1931 1 86 TYR QE   1 90 ILE HG12 . . 4.550 3.607 3.254 3.948     .  0 0 "[    .    1    .    2]" 1 
       1932 1 86 TYR QE   1 90 ILE HG13 . . 4.700 2.320 1.994 2.776     .  0 0 "[    .    1    .    2]" 1 
       1933 1 86 TYR QE   1 90 ILE MG   . . 4.120 3.570 3.361 3.965     .  0 0 "[    .    1    .    2]" 1 
       1934 1 87 LYS H    1 87 LYS QB   . . 3.260 2.000 1.984 2.029     .  0 0 "[    .    1    .    2]" 1 
       1935 1 87 LYS H    1 87 LYS QD   . . 5.500 4.452 2.556 4.608     .  0 0 "[    .    1    .    2]" 1 
       1936 1 87 LYS H    1 87 LYS HG2  . . 3.990 3.634 3.246 4.362 0.372  6 0 "[    .    1    .    2]" 1 
       1937 1 87 LYS H    1 87 LYS HG3  . . 4.250 3.742 3.468 4.003     .  0 0 "[    .    1    .    2]" 1 
       1938 1 87 LYS H    1 88 GLU H    . . 3.590 2.731 2.655 2.818     .  0 0 "[    .    1    .    2]" 1 
       1939 1 87 LYS H    1 90 ILE MD   . . 5.500 5.456 5.264 5.527 0.027 12 0 "[    .    1    .    2]" 1 
       1940 1 87 LYS H    1 90 ILE HG13 . . 5.500 4.316 4.067 4.556     .  0 0 "[    .    1    .    2]" 1 
       1941 1 87 LYS HA   1 87 LYS QD   . . 4.180 3.096 2.535 3.730     .  0 0 "[    .    1    .    2]" 1 
       1942 1 87 LYS HA   1 87 LYS HG2  . . 3.800 2.060 1.920 3.412     .  0 0 "[    .    1    .    2]" 1 
       1943 1 87 LYS HA   1 87 LYS HG3  . . 3.750 3.223 2.067 3.476     .  0 0 "[    .    1    .    2]" 1 
       1944 1 87 LYS HA   1 89 TYR H    . . 5.040 3.939 3.813 4.043     .  0 0 "[    .    1    .    2]" 1 
       1945 1 87 LYS HA   1 90 ILE H    . . 3.870 2.833 2.760 2.952     .  0 0 "[    .    1    .    2]" 1 
       1946 1 87 LYS HA   1 90 ILE HB   . . 4.090 2.201 2.066 2.429     .  0 0 "[    .    1    .    2]" 1 
       1947 1 87 LYS HA   1 90 ILE MD   . . 3.950 3.884 3.711 3.982 0.032  2 0 "[    .    1    .    2]" 1 
       1948 1 87 LYS HA   1 90 ILE HG12 . . 4.090 2.752 2.485 3.100     .  0 0 "[    .    1    .    2]" 1 
       1949 1 87 LYS HA   1 90 ILE HG13 . . 3.710 2.231 1.997 2.439     .  0 0 "[    .    1    .    2]" 1 
       1950 1 87 LYS HA   1 90 ILE MG   . . 3.780 3.616 3.543 3.723     .  0 0 "[    .    1    .    2]" 1 
       1951 1 87 LYS QB   1 88 GLU H    . . 3.680 2.799 2.681 3.005     .  0 0 "[    .    1    .    2]" 1 
       1952 1 87 LYS QD   1 88 GLU H    . . 4.950 4.707 4.555 4.774     .  0 0 "[    .    1    .    2]" 1 
       1953 1 87 LYS QD   1 90 ILE HB   . . 4.950 3.347 2.477 4.391     .  0 0 "[    .    1    .    2]" 1 
       1954 1 87 LYS HG2  1 88 GLU H    . . 5.090 4.989 4.883 5.366 0.276  6 0 "[    .    1    .    2]" 1 
       1955 1 87 LYS HG3  1 90 ILE HG13 . . 4.690 4.413 3.013 4.688     .  0 0 "[    .    1    .    2]" 1 
       1956 1 88 GLU H    1 88 GLU QB   . . 2.960 2.072 2.040 2.104     .  0 0 "[    .    1    .    2]" 1 
       1957 1 88 GLU H    1 88 GLU HG2  . . 4.230 3.466 3.060 4.136     .  0 0 "[    .    1    .    2]" 1 
       1958 1 88 GLU H    1 88 GLU HG3  . . 4.090 4.244 4.160 4.375 0.285  2 0 "[    .    1    .    2]" 1 
       1959 1 88 GLU H    1 89 TYR QB   . . 4.730 4.420 4.211 4.535     .  0 0 "[    .    1    .    2]" 1 
       1960 1 88 GLU HA   1 88 GLU HG2  . . 3.870 3.733 3.686 3.766     .  0 0 "[    .    1    .    2]" 1 
       1961 1 88 GLU HA   1 88 GLU HG3  . . 3.850 3.323 2.801 3.607     .  0 0 "[    .    1    .    2]" 1 
       1962 1 88 GLU HA   1 90 ILE H    . . 5.340 4.492 4.119 4.701     .  0 0 "[    .    1    .    2]" 1 
       1963 1 88 GLU HA   1 91 SER H    . . 4.320 4.156 3.573 4.339 0.019  7 0 "[    .    1    .    2]" 1 
       1964 1 88 GLU QB   1 88 GLU HG3  . . 2.790 2.407 2.328 2.529     .  0 0 "[    .    1    .    2]" 1 
       1965 1 88 GLU QB   1 89 TYR H    . . 3.390 3.288 2.936 3.438 0.048  6 0 "[    .    1    .    2]" 1 
       1966 1 88 GLU QB   1 89 TYR HA   . . 4.770 4.668 4.573 4.724     .  0 0 "[    .    1    .    2]" 1 
       1967 1 88 GLU QB   1 92 ASN HD21 . . 5.340 4.800 4.278 5.379 0.039 19 0 "[    .    1    .    2]" 1 
       1968 1 88 GLU QB   1 92 ASN HD22 . . 5.500 4.595 4.074 5.277     .  0 0 "[    .    1    .    2]" 1 
       1969 1 88 GLU HG2  1 89 TYR H    . . 3.950 2.471 1.969 3.476     .  0 0 "[    .    1    .    2]" 1 
       1970 1 88 GLU HG2  1 92 ASN HD21 . . 5.420 4.609 3.982 5.452 0.032 11 0 "[    .    1    .    2]" 1 
       1971 1 88 GLU HG3  1 89 TYR H    . . 3.990 3.394 3.007 3.972     .  0 0 "[    .    1    .    2]" 1 
       1972 1 88 GLU HG3  1 92 ASN HD21 . . 5.340 3.365 2.906 4.246     .  0 0 "[    .    1    .    2]" 1 
       1973 1 88 GLU HG3  1 92 ASN HD22 . . 5.420 3.492 2.763 4.373     .  0 0 "[    .    1    .    2]" 1 
       1974 1 89 TYR H    1 89 TYR QB   . . 3.100 1.953 1.908 1.982     .  0 0 "[    .    1    .    2]" 1 
       1975 1 89 TYR H    1 89 TYR QD   . . 4.230 3.787 3.648 3.887     .  0 0 "[    .    1    .    2]" 1 
       1976 1 89 TYR H    1 90 ILE HA   . . 5.500 4.947 4.846 5.037     .  0 0 "[    .    1    .    2]" 1 
       1977 1 89 TYR H    1 90 ILE MD   . . 5.150 5.152 5.006 5.199 0.049  3 0 "[    .    1    .    2]" 1 
       1978 1 89 TYR H    1 90 ILE HG13 . . 5.270 5.002 4.725 5.246     .  0 0 "[    .    1    .    2]" 1 
       1979 1 89 TYR H    1 91 SER H    . . 5.150 4.492 4.140 4.642     .  0 0 "[    .    1    .    2]" 1 
       1980 1 89 TYR HA   1 89 TYR QD   . . 3.290 3.054 2.811 3.304 0.014 20 0 "[    .    1    .    2]" 1 
       1981 1 89 TYR HA   1 92 ASN QB   . . 4.280 2.966 2.237 4.302 0.022 19 0 "[    .    1    .    2]" 1 
       1982 1 89 TYR HA   1 92 ASN HD21 . . 5.500 2.788 2.024 3.639     .  0 0 "[    .    1    .    2]" 1 
       1983 1 89 TYR QB   1 90 ILE H    . . 3.690 2.746 2.577 3.037     .  0 0 "[    .    1    .    2]" 1 
       1984 1 89 TYR QB   1 90 ILE HB   . . 5.060 4.955 4.838 5.157 0.097  6 0 "[    .    1    .    2]" 1 
       1985 1 89 TYR QB   1 90 ILE MD   . . 4.620 4.318 4.085 4.493     .  0 0 "[    .    1    .    2]" 1 
       1986 1 89 TYR QB   1 90 ILE HG12 . . 5.350 3.357 3.232 3.466     .  0 0 "[    .    1    .    2]" 1 
       1987 1 89 TYR QB   1 90 ILE HG13 . . 4.950 4.880 4.671 4.977 0.027 12 0 "[    .    1    .    2]" 1 
       1988 1 89 TYR QB   1 91 SER H    . . 5.420 5.234 5.032 5.399     .  0 0 "[    .    1    .    2]" 1 
       1989 1 89 TYR QD   1 90 ILE H    . . 3.610 2.991 2.839 3.249     .  0 0 "[    .    1    .    2]" 1 
       1990 1 89 TYR QD   1 90 ILE HA   . . 4.560 3.161 2.693 3.792     .  0 0 "[    .    1    .    2]" 1 
       1991 1 89 TYR QD   1 90 ILE HB   . . 5.060 4.619 4.332 4.953     .  0 0 "[    .    1    .    2]" 1 
       1992 1 89 TYR QD   1 90 ILE MD   . . 3.510 2.719 2.427 3.126     .  0 0 "[    .    1    .    2]" 1 
       1993 1 89 TYR QD   1 90 ILE HG12 . . 4.620 2.418 1.985 2.720     .  0 0 "[    .    1    .    2]" 1 
       1994 1 89 TYR QD   1 90 ILE HG13 . . 4.370 4.057 3.531 4.305     .  0 0 "[    .    1    .    2]" 1 
       1995 1 89 TYR QD   1 93 LYS QD   . . 4.700 3.767 2.432 4.559     .  0 0 "[    .    1    .    2]" 1 
       1996 1 89 TYR QE   1 90 ILE H    . . 5.080 5.064 4.954 5.159 0.079  6 0 "[    .    1    .    2]" 1 
       1997 1 89 TYR QE   1 90 ILE HA   . . 4.900 3.916 3.627 4.196     .  0 0 "[    .    1    .    2]" 1 
       1998 1 89 TYR QE   1 90 ILE MD   . . 3.770 2.956 2.427 3.215     .  0 0 "[    .    1    .    2]" 1 
       1999 1 89 TYR QE   1 93 LYS QD   . . 4.270 2.490 2.111 3.001     .  0 0 "[    .    1    .    2]" 1 
       2000 1 89 TYR QE   1 93 LYS HE2  . . 4.620 3.912 2.149 5.396 0.776 20 2 "[    .    1    . -  +]" 1 
       2001 1 89 TYR QE   1 93 LYS QG   . . 4.900 3.463 1.988 4.290     .  0 0 "[    .    1    .    2]" 1 
       2002 1 90 ILE H    1 90 ILE HB   . . 3.510 2.436 2.355 2.502     .  0 0 "[    .    1    .    2]" 1 
       2003 1 90 ILE H    1 90 ILE MD   . . 3.640 3.506 3.313 3.649 0.009 20 0 "[    .    1    .    2]" 1 
       2004 1 90 ILE H    1 90 ILE HG12 . . 3.800 1.998 1.932 2.168     .  0 0 "[    .    1    .    2]" 1 
       2005 1 90 ILE H    1 90 ILE HG13 . . 3.620 3.218 3.047 3.327     .  0 0 "[    .    1    .    2]" 1 
       2006 1 90 ILE H    1 90 ILE MG   . . 3.510 3.706 3.694 3.738 0.228  6 0 "[    .    1    .    2]" 1 
       2007 1 90 ILE H    1 91 SER H    . . 3.340 2.932 2.433 3.091     .  0 0 "[    .    1    .    2]" 1 
       2008 1 90 ILE H    1 91 SER QB   . . 4.790 4.485 4.234 4.628     .  0 0 "[    .    1    .    2]" 1 
       2009 1 90 ILE HA   1 90 ILE MD   . . 3.480 2.231 2.118 2.423     .  0 0 "[    .    1    .    2]" 1 
       2010 1 90 ILE HA   1 90 ILE HG13 . . 4.180 3.755 3.726 3.826     .  0 0 "[    .    1    .    2]" 1 
       2011 1 90 ILE HA   1 90 ILE MG   . . 3.170 2.375 2.327 2.435     .  0 0 "[    .    1    .    2]" 1 
       2012 1 90 ILE HA   1 93 LYS H    . . 4.830 4.164 3.417 4.829     .  0 0 "[    .    1    .    2]" 1 
       2013 1 90 ILE HA   1 93 LYS HB2  . . 4.510 3.230 2.497 4.137     .  0 0 "[    .    1    .    2]" 1 
       2014 1 90 ILE HA   1 93 LYS HB3  . . 4.450 3.413 2.475 4.184     .  0 0 "[    .    1    .    2]" 1 
       2015 1 90 ILE HA   1 93 LYS QD   . . 4.690 4.323 3.023 4.710 0.020  2 0 "[    .    1    .    2]" 1 
       2016 1 90 ILE HB   1 90 ILE MD   . . 3.450 3.177 3.143 3.197     .  0 0 "[    .    1    .    2]" 1 
       2017 1 90 ILE HB   1 91 SER H    . . 3.890 2.311 2.232 2.666     .  0 0 "[    .    1    .    2]" 1 
       2018 1 90 ILE HB   1 91 SER HA   . . 4.620 4.249 4.172 4.334     .  0 0 "[    .    1    .    2]" 1 
       2019 1 90 ILE HG12 1 90 ILE MG   . . 3.520 3.216 3.189 3.231     .  0 0 "[    .    1    .    2]" 1 
       2020 1 90 ILE HG12 1 91 SER H    . . 4.450 4.272 4.139 4.352     .  0 0 "[    .    1    .    2]" 1 
       2021 1 90 ILE HG13 1 90 ILE MG   . . 3.390 2.561 2.439 2.681     .  0 0 "[    .    1    .    2]" 1 
       2022 1 90 ILE HG13 1 91 SER H    . . 4.540 4.553 4.481 4.600 0.060  6 0 "[    .    1    .    2]" 1 
       2023 1 90 ILE MG   1 91 SER H    . . 4.090 3.055 2.842 3.660     .  0 0 "[    .    1    .    2]" 1 
       2024 1 90 ILE MG   1 91 SER HA   . . 4.410 3.312 3.125 3.737     .  0 0 "[    .    1    .    2]" 1 
       2025 1 90 ILE MG   1 91 SER QB   . . 4.360 4.092 3.927 4.394 0.034  3 0 "[    .    1    .    2]" 1 
       2026 1 90 ILE MG   1 93 LYS H    . . 5.500 4.794 4.628 5.217     .  0 0 "[    .    1    .    2]" 1 
       2027 1 90 ILE MG   1 94 ARG HD2  . . 4.280 3.492 2.094 4.733 0.453  9 0 "[    .    1    .    2]" 1 
       2028 1 90 ILE MG   1 94 ARG HG2  . . 4.450 4.232 3.220 4.621 0.171  5 0 "[    .    1    .    2]" 1 
       2029 1 90 ILE MG   1 94 ARG HG3  . . 4.620 3.198 2.178 4.303     .  0 0 "[    .    1    .    2]" 1 
       2030 1 91 SER H    1 91 SER QB   . . 3.310 2.184 2.016 2.225     .  0 0 "[    .    1    .    2]" 1 
       2031 1 91 SER H    1 92 ASN H    . . 4.020 3.030 2.927 3.334     .  0 0 "[    .    1    .    2]" 1 
       2032 1 91 SER H    1 92 ASN HA   . . 5.500 5.439 5.381 5.524 0.024 10 0 "[    .    1    .    2]" 1 
       2033 1 91 SER HA   1 93 LYS H    . . 4.670 4.266 3.815 4.629     .  0 0 "[    .    1    .    2]" 1 
       2034 1 91 SER QB   1 92 ASN H    . . 4.130 2.554 2.178 4.064     .  0 0 "[    .    1    .    2]" 1 
       2035 1 91 SER QB   1 92 ASN QB   . . 4.850 4.283 4.100 4.502     .  0 0 "[    .    1    .    2]" 1 
       2036 1 92 ASN H    1 92 ASN QB   . . 3.620 2.473 2.093 3.324     .  0 0 "[    .    1    .    2]" 1 
       2037 1 92 ASN H    1 92 ASN HD21 . . 5.150 3.408 2.855 5.235 0.085  6 0 "[    .    1    .    2]" 1 
       2038 1 92 ASN H    1 92 ASN HD22 . . 5.500 4.024 3.215 5.251     .  0 0 "[    .    1    .    2]" 1 
       2039 1 92 ASN H    1 93 LYS HB2  . . 5.420 4.543 3.879 5.060     .  0 0 "[    .    1    .    2]" 1 
       2040 1 92 ASN QB   1 93 LYS H    . . 4.120 3.267 2.288 4.122 0.002  6 0 "[    .    1    .    2]" 1 
       2041 1 92 ASN QB   1 93 LYS HA   . . 4.950 4.155 3.605 4.725     .  0 0 "[    .    1    .    2]" 1 
       2042 1 93 LYS H    1 93 LYS HB2  . . 3.810 2.756 2.006 3.631     .  0 0 "[    .    1    .    2]" 1 
       2043 1 93 LYS H    1 93 LYS HB3  . . 3.530 3.249 2.824 3.785 0.255  2 0 "[    .    1    .    2]" 1 
       2044 1 93 LYS H    1 93 LYS QG   . . 4.040 3.837 3.278 4.065 0.025  7 0 "[    .    1    .    2]" 1 
       2045 1 93 LYS HA   1 93 LYS QD   . . 3.910 3.484 2.446 3.916 0.006  3 0 "[    .    1    .    2]" 1 
       2046 1 93 LYS HA   1 93 LYS HE2  . . 5.500 4.398 2.472 6.228 0.728 18 3 "[  - .  * 1    .  + 2]" 1 
       2047 1 93 LYS HA   1 93 LYS QG   . . 3.820 2.169 1.933 2.664     .  0 0 "[    .    1    .    2]" 1 
       2048 1 93 LYS HB2  1 93 LYS HE2  . . 4.950 4.397 3.388 5.227 0.277  2 0 "[    .    1    .    2]" 1 
       2049 1 93 LYS HB3  1 94 ARG H    . . 3.870 2.382 1.934 2.769     .  0 0 "[    .    1    .    2]" 1 
       2050 1 93 LYS QD   1 94 ARG H    . . 5.500 4.373 1.936 4.937     .  0 0 "[    .    1    .    2]" 1 
       2051 1 93 LYS QG   1 94 ARG H    . . 5.150 3.460 2.265 4.478     .  0 0 "[    .    1    .    2]" 1 
       2052 1 94 ARG H    1 94 ARG HB2  . . 3.930 2.826 2.067 3.930     .  0 0 "[    .    1    .    2]" 1 
       2053 1 94 ARG H    1 94 ARG HB3  . . 3.450 3.610 2.974 4.012 0.562 19 5 "[    *   **    .-  +2]" 1 
       2054 1 94 ARG H    1 94 ARG HG2  . . 4.560 3.289 2.286 4.570 0.010 10 0 "[    .    1    .    2]" 1 
       2055 1 94 ARG H    1 94 ARG HG3  . . 4.090 3.051 2.047 4.124 0.034  1 0 "[    .    1    .    2]" 1 
       2056 1 94 ARG HA   1 94 ARG HD2  . . 4.450 4.500 3.680 5.431 0.981  8 2 "[-   .  + 1    .    2]" 1 
       2057 1 94 ARG HA   1 94 ARG HG2  . . 4.010 2.604 1.996 4.031 0.021  8 0 "[    .    1    .    2]" 1 
       2058 1 94 ARG HA   1 94 ARG HG3  . . 3.820 3.171 2.321 3.703     .  0 0 "[    .    1    .    2]" 1 
       2059 1 94 ARG HA   1 95 LYS H    . . 3.640 2.943 2.270 3.648 0.008 18 0 "[    .    1    .    2]" 1 
       2060 1 94 ARG HB2  1 94 ARG HD2  . . 3.930 3.376 2.576 4.150 0.220  9 0 "[    .    1    .    2]" 1 
       2061 1 94 ARG HB2  1 94 ARG HG2  . . 2.990 2.950 2.799 3.057 0.067 12 0 "[    .    1    .    2]" 1 
       2062 1 94 ARG HB3  1 94 ARG HD2  . . 3.770 3.267 2.017 4.223 0.453  6 0 "[    .    1    .    2]" 1 
       2063 1 94 ARG HB3  1 94 ARG HG3  . . 2.860 2.950 2.799 3.057 0.197 10 0 "[    .    1    .    2]" 1 
       2064 1 94 ARG HB3  1 95 LYS H    . . 5.060 2.981 1.947 4.094     .  0 0 "[    .    1    .    2]" 1 
       2065 1 94 ARG HG2  1 95 LYS H    . . 4.990 4.298 2.068 4.988     .  0 0 "[    .    1    .    2]" 1 
       2066 1 95 LYS H    1 95 LYS HB2  . . 4.200 2.799 2.092 3.535     .  0 0 "[    .    1    .    2]" 1 
       2067 1 95 LYS H    1 95 LYS HB3  . . 3.750 3.183 2.408 4.005 0.255  9 0 "[    .    1    .    2]" 1 
       2068 1 95 LYS H    1 95 LYS HG2  . . 4.670 4.400 3.011 5.002 0.332 10 0 "[    .    1    .    2]" 1 
       2069 1 95 LYS HA   1 95 LYS QD   . . 4.560 3.745 2.454 4.092     .  0 0 "[    .    1    .    2]" 1 
       2070 1 95 LYS HA   1 95 LYS HG3  . . 4.010 2.658 2.020 3.566     .  0 0 "[    .    1    .    2]" 1 
       2071 1 95 LYS HA   1 96 SER HA   . . 4.690 4.430 4.260 4.662     .  0 0 "[    .    1    .    2]" 1 
       2072 1 95 LYS HB2  1 96 SER H    . . 4.870 4.113 2.503 4.706     .  0 0 "[    .    1    .    2]" 1 
       2073 1 95 LYS HB3  1 96 SER H    . . 4.990 3.557 1.998 4.582     .  0 0 "[    .    1    .    2]" 1 
       2074 1 96 SER HA   1 96 SER HB3  . . 2.960 2.786 2.423 3.052 0.092  2 0 "[    .    1    .    2]" 1 
       2075 1 96 SER HB3  1 97 GLY H    . . 4.700 3.319 2.222 4.570     .  0 0 "[    .    1    .    2]" 1 
       2076 1 97 GLY QA   1 98 PRO HD3  . . 3.180 2.111 1.927 2.413     .  0 0 "[    .    1    .    2]" 1 
    stop_

save_



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