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
382417 1jgn 5084 cing 4-filtered-FRED Wattos check violation distance


data_1jgn


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              1694
    _Distance_constraint_stats_list.Viol_count                    3362
    _Distance_constraint_stats_list.Viol_total                    7521.021
    _Distance_constraint_stats_list.Viol_max                      2.628
    _Distance_constraint_stats_list.Viol_rms                      0.0374
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0049
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0746
    _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  2 PRO  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1  3 LEU  0.015 0.009  3 0 "[    .    1    .    2    .    3]" 
       1  4 GLY  0.015 0.009  3 0 "[    .    1    .    2    .    3]" 
       1  5 SER  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1  6 PRO  1.945 0.338 30 0 "[    .    1    .    2    .    3]" 
       1  7 LEU  1.985 0.338 30 0 "[    .    1    .    2    .    3]" 
       1  8 THR  6.699 0.096 26 0 "[    .    1    .    2    .    3]" 
       1  9 ALA  0.591 0.034 20 0 "[    .    1    .    2    .    3]" 
       1 10 SER  1.227 0.056 12 0 "[    .    1    .    2    .    3]" 
       1 11 MET 13.624 0.984 14 7 "[*  -.   *1   +.    *    .  **3]" 
       1 12 LEU  1.290 0.061  2 0 "[    .    1    .    2    .    3]" 
       1 13 ALA  2.215 0.161  4 0 "[    .    1    .    2    .    3]" 
       1 14 SER 15.822 0.984 14 7 "[*  -.   *1   +.    *    .  **3]" 
       1 15 ALA  7.564 0.475 26 0 "[    .    1    .    2    .    3]" 
       1 18 GLN  3.786 0.451 16 0 "[    .    1    .    2    .    3]" 
       1 19 GLU  4.220 0.475 26 0 "[    .    1    .    2    .    3]" 
       1 20 GLN  7.449 0.543 23 1 "[    .    1    .    2  + .    3]" 
       1 21 LYS  3.731 0.355 18 0 "[    .    1    .    2    .    3]" 
       1 22 GLN  0.959 0.355 18 0 "[    .    1    .    2    .    3]" 
       1 23 MET  2.612 0.092 18 0 "[    .    1    .    2    .    3]" 
       1 24 LEU  4.257 0.100 17 0 "[    .    1    .    2    .    3]" 
       1 25 GLY  5.414 0.178 30 0 "[    .    1    .    2    .    3]" 
       1 26 GLU  4.859 0.416  8 0 "[    .    1    .    2    .    3]" 
       1 27 ARG  9.992 0.560 30 1 "[    .    1    .    2    .    +]" 
       1 28 LEU 13.541 0.383 19 0 "[    .    1    .    2    .    3]" 
       1 29 PHE  6.363 0.106 23 0 "[    .    1    .    2    .    3]" 
       1 31 LEU 16.133 0.412 22 0 "[    .    1    .    2    .    3]" 
       1 32 ILE  8.142 0.129 28 0 "[    .    1    .    2    .    3]" 
       1 33 GLN  3.323 0.121 21 0 "[    .    1    .    2    .    3]" 
       1 34 ALA  2.225 0.096 26 0 "[    .    1    .    2    .    3]" 
       1 35 MET  6.710 0.128 29 0 "[    .    1    .    2    .    3]" 
       1 36 HIS  3.164 0.139 29 0 "[    .    1    .    2    .    3]" 
       1 38 THR  1.049 0.139 29 0 "[    .    1    .    2    .    3]" 
       1 39 LEU  7.343 0.816 28 9 "[* * .  * 1    .    -* * ** + 3]" 
       1 40 ALA 11.517 0.816 28 8 "[* * .  * 1    .    -*   ** + 3]" 
       1 41 GLY  2.176 0.123 13 0 "[    .    1    .    2    .    3]" 
       1 42 LYS  5.827 0.739 23 2 "[    .    1    .    2  + .-   3]" 
       1 43 ILE  4.680 0.245  4 0 "[    .    1    .    2    .    3]" 
       1 44 THR  3.895 0.148 24 0 "[    .    1    .    2    .    3]" 
       1 45 GLY 11.248 0.571 22 5 "[    .    1 *-*. *  2 +  .    3]" 
       1 46 MET 10.100 0.912 23 2 "[    .    1    .    2- + .    3]" 
       1 47 LEU  2.408 0.077 21 0 "[    .    1    .    2    .    3]" 
       1 48 LEU  4.456 0.753 23 1 "[    .    1    .    2  + .    3]" 
       1 49 GLU  7.299 0.912 23 2 "[    .    1    .    2- + .    3]" 
       1 50 ILE  8.251 0.560 19 4 "[ -  . *  1    .   +2*   .    3]" 
       1 51 ASP  2.660 0.062 26 0 "[    .    1    .    2    .    3]" 
       1 52 ASN  6.902 0.449  8 0 "[    .    1    .    2    .    3]" 
       1 53 SER  0.567 0.047 11 0 "[    .    1    .    2    .    3]" 
       1 54 GLU  0.085 0.055 29 0 "[    .    1    .    2    .    3]" 
       1 55 LEU 15.005 0.560 30 1 "[    .    1    .    2    .    +]" 
       1 56 LEU  2.971 0.098 24 0 "[    .    1    .    2    .    3]" 
       1 57 HIS  0.918 0.061  1 0 "[    .    1    .    2    .    3]" 
       1 58 MET  4.889 0.398 29 0 "[    .    1    .    2    .    3]" 
       1 59 LEU  3.447 0.231 14 0 "[    .    1    .    2    .    3]" 
       1 60 GLU  2.490 0.094 29 0 "[    .    1    .    2    .    3]" 
       1 61 SER  3.590 0.568 22 1 "[    .    1    .    2 +  .    3]" 
       1 63 GLU  3.619 0.956  7 3 "[    . +  1 -  .    2    .    *]" 
       1 64 SER  6.236 0.588 22 2 "[    .    1    .    2 +  . -  3]" 
       1 65 LEU  9.344 0.588 22 2 "[    .    1    .    2 +  . -  3]" 
       1 66 ARG  1.293 0.132 20 0 "[    .    1    .    2    .    3]" 
       1 67 SER  0.625 0.040 19 0 "[    .    1    .    2    .    3]" 
       1 68 LYS 11.324 0.560 19 4 "[ -  . *  1    .   +2*   .    3]" 
       1 69 VAL  0.849 0.040 19 0 "[    .    1    .    2    .    3]" 
       1 70 ASP  0.123 0.035  8 0 "[    .    1    .    2    .    3]" 
       1 71 GLU 13.834 0.688  7 8 "[ *  .*+- 1*   .   **   *.    3]" 
       1 72 ALA 16.072 0.508  6 1 "[    .+   1    .    2    .    3]" 
       1 73 VAL  2.054 0.078 22 0 "[    .    1    .    2    .    3]" 
       1 74 ALA  1.603 0.089 20 0 "[    .    1    .    2    .    3]" 
       1 75 VAL 15.689 0.688  7 8 "[ *  .*+- 1*   .   **   *.    3]" 
       1 76 LEU  1.203 0.127 28 0 "[    .    1    .    2    .    3]" 
       1 77 GLN  1.303 0.127 28 0 "[    .    1    .    2    .    3]" 
       1 78 ALA  0.161 0.034 22 0 "[    .    1    .    2    .    3]" 
       1 79 HIS  2.793 0.628 26 1 "[    .    1    .    2    .+   3]" 
       1 80 GLN  3.502 0.763  9 2 "[    .   +1    .    2-   .    3]" 
       1 81 ALA  0.315 0.108 24 0 "[    .    1    .    2    .    3]" 
       1 82 LYS  0.036 0.030 11 0 "[    .    1    .    2    .    3]" 
       1 83 GLU  3.074 2.628 30 1 "[    .    1    .    2    .    +]" 
       1 84 ALA  0.509 0.209 13 0 "[    .    1    .    2    .    3]" 
       1 85 ALA  0.198 0.102 28 0 "[    .    1    .    2    .    3]" 
       1 86 GLN  5.413 2.628 30 3 "[    . -  1    .    2   *.    +]" 
       1 87 LYS  0.470 0.211 19 0 "[    .    1    .    2    .    3]" 
       1 88 ALA  0.026 0.016 10 0 "[    .    1    .    2    .    3]" 
       1 89 VAL  5.134 0.435 10 0 "[    .    1    .    2    .    3]" 
       1 90 ASN  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 91 SER  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 92 ALA  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 93 THR  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 94 GLY  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 95 VAL  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 96 PRO  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 97 THR  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 98 VAL  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       2  1 VAL  0.041 0.032  4 0 "[    .    1    .    2    .    3]" 
       2  2 VAL  0.309 0.164  4 0 "[    .    1    .    2    .    3]" 
       2  3 LYS  2.100 0.346  7 0 "[    .    1    .    2    .    3]" 
       2  4 SER  0.734 0.294 15 0 "[    .    1    .    2    .    3]" 
       2  5 ASN  0.029 0.018 12 0 "[    .    1    .    2    .    3]" 
       2  6 LEU  2.594 0.284 12 0 "[    .    1    .    2    .    3]" 
       2  7 ASN  0.890 0.077 21 0 "[    .    1    .    2    .    3]" 
       2  8 PRO  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       2  9 ASN  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       2 10 ALA  0.650 0.056 29 0 "[    .    1    .    2    .    3]" 
       2 11 LYS 10.987 0.586 21 1 "[    .    1    .    2+   .    3]" 
       2 12 GLU  2.583 0.348 21 0 "[    .    1    .    2    .    3]" 
       2 13 PHE 14.847 0.571 22 5 "[    .    1 *-*. *  2 +  .    3]" 
       2 14 VAL  7.293 0.221 24 0 "[    .    1    .    2    .    3]" 
       2 16 GLY  0.633 0.081  2 0 "[    .    1    .    2    .    3]" 
       2 17 VAL  3.880 0.790 18 4 "[  * .*   1    .  +-2    .    3]" 
       2 18 LYS  0.510 0.048 18 0 "[    .    1    .    2    .    3]" 
       2 19 TYR  0.758 0.539 18 1 "[    .    1    .  + 2    .    3]" 
       2 20 GLY  0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       2 21 ASN  0.527 0.135 22 0 "[    .    1    .    2    .    3]" 
       2 22 ILE  0.527 0.135 22 0 "[    .    1    .    2    .    3]" 
    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  2 PRO HA   1  3 LEU H    2.800 . 3.800 2.778 2.149 3.572     .  0 0 "[    .    1    .    2    .    3]" 1 
          2 1  2 PRO QB   1  3 LEU H    4.000 . 5.500 3.133 2.082 4.013     .  0 0 "[    .    1    .    2    .    3]" 1 
          3 1  3 LEU H    1  3 LEU QB   2.700 . 3.600 2.360 2.068 3.013     .  0 0 "[    .    1    .    2    .    3]" 1 
          4 1  4 GLY H    1  4 GLY QA   2.500 . 3.300 2.266 2.222 2.313     .  0 0 "[    .    1    .    2    .    3]" 1 
          5 1  5 SER H    1  5 SER HA   2.800 . 3.800 2.895 2.868 2.923     .  0 0 "[    .    1    .    2    .    3]" 1 
          6 1  5 SER H    1  5 SER HB3  4.000 . 5.500 3.002 2.232 3.677     .  0 0 "[    .    1    .    2    .    3]" 1 
          7 1  6 PRO HB3  1  7 LEU H    2.800 . 5.500 3.835 2.579 4.577     .  0 0 "[    .    1    .    2    .    3]" 1 
          8 1  6 PRO HB2  1  7 LEU H    2.700 . 5.500 3.346 1.699 4.317     .  0 0 "[    .    1    .    2    .    3]" 1 
          9 1  6 PRO HG2  1  7 LEU H    3.200 . 5.500 4.676 2.444 5.838 0.338 30 0 "[    .    1    .    2    .    3]" 1 
         10 1  8 THR H    1  8 THR HA   2.400 . 3.100 2.892 2.887 2.896     .  0 0 "[    .    1    .    2    .    3]" 1 
         11 1  8 THR H    1  8 THR MG   2.300 . 3.000 2.116 1.744 2.406     .  0 0 "[    .    1    .    2    .    3]" 1 
         12 1  9 ALA H    1  9 ALA HA   2.600 . 3.400 2.819 2.808 2.826     .  0 0 "[    .    1    .    2    .    3]" 1 
         13 1  9 ALA H    1  9 ALA MB   2.200 . 2.800 2.147 2.054 2.233     .  0 0 "[    .    1    .    2    .    3]" 1 
         14 1 10 SER H    1 10 SER HA   2.700 . 3.600 2.855 2.841 2.869     .  0 0 "[    .    1    .    2    .    3]" 1 
         15 1 10 SER H    1 10 SER QB   3.100 . 4.300 2.233 2.140 2.285     .  0 0 "[    .    1    .    2    .    3]" 1 
         16 1 11 MET H    1 11 MET HA   2.500 . 3.300 2.831 2.828 2.835     .  0 0 "[    .    1    .    2    .    3]" 1 
         17 1 11 MET H    1 11 MET HG3  2.500 . 3.300 2.470 2.391 2.556     .  0 0 "[    .    1    .    2    .    3]" 1 
         18 1 11 MET H    1 11 MET HG2  3.000 . 4.100 2.635 2.527 2.743     .  0 0 "[    .    1    .    2    .    3]" 1 
         19 1 11 MET H    1 11 MET HB2  2.500 . 3.300 2.632 2.542 2.684     .  0 0 "[    .    1    .    2    .    3]" 1 
         20 1 11 MET H    1 11 MET HB3  2.600 . 5.500 3.612 3.600 3.622     .  0 0 "[    .    1    .    2    .    3]" 1 
         21 1 12 LEU H    1 12 LEU HB2  2.000 . 2.500 2.258 2.064 2.561 0.061  2 0 "[    .    1    .    2    .    3]" 1 
         22 1 12 LEU H    1 12 LEU QD   2.600 . 3.400 2.636 2.391 2.846     .  0 0 "[    .    1    .    2    .    3]" 1 
         23 1 13 ALA H    1 13 ALA MB   2.000 . 2.500 2.075 2.032 2.154     .  0 0 "[    .    1    .    2    .    3]" 1 
         24 1 14 SER H    1 14 SER HA   2.400 . 3.100 2.931 2.929 2.934     .  0 0 "[    .    1    .    2    .    3]" 1 
         25 1 14 SER H    1 14 SER HB2  2.200 . 2.800 2.728 2.249 3.686 0.886 29 7 "[-  *.   *1   *.    *    .  *+3]" 1 
         26 1 15 ALA H    1 15 ALA HA   2.500 . 3.300 2.936 2.909 2.946     .  0 0 "[    .    1    .    2    .    3]" 1 
         27 1 15 ALA H    1 15 ALA MB   2.100 . 2.700 2.518 2.416 2.646     .  0 0 "[    .    1    .    2    .    3]" 1 
         28 1 18 GLN H    1 18 GLN HA   2.500 . 3.300 2.853 2.738 2.872     .  0 0 "[    .    1    .    2    .    3]" 1 
         29 1 18 GLN H    1 18 GLN HG3  2.800 . 3.800 2.954 1.790 4.021 0.221 16 0 "[    .    1    .    2    .    3]" 1 
         30 1 18 GLN H    1 18 GLN QB   2.100 . 2.700 2.275 2.066 2.806 0.106 22 0 "[    .    1    .    2    .    3]" 1 
         31 1 19 GLU H    1 19 GLU HA   2.600 . 3.400 2.913 2.888 2.944     .  0 0 "[    .    1    .    2    .    3]" 1 
         32 1 19 GLU H    1 19 GLU QG   2.500 . 5.500 3.853 3.027 4.181     .  0 0 "[    .    1    .    2    .    3]" 1 
         33 1 19 GLU H    1 19 GLU HB3  2.500 . 3.300 3.090 2.631 3.472 0.172 27 0 "[    .    1    .    2    .    3]" 1 
         34 1 19 GLU H    1 19 GLU HB2  2.200 . 2.800 2.309 2.125 2.575     .  0 0 "[    .    1    .    2    .    3]" 1 
         35 1 20 GLN H    1 20 GLN HA   2.600 . 3.400 2.743 2.710 2.806     .  0 0 "[    .    1    .    2    .    3]" 1 
         36 1 20 GLN H    1 20 GLN HG3  2.900 . 4.000 2.216 1.417 4.429 0.429 12 0 "[    .    1    .    2    .    3]" 1 
         37 1 20 GLN H    1 20 GLN QB   2.500 . 5.500 2.704 2.079 2.946     .  0 0 "[    .    1    .    2    .    3]" 1 
         38 1 21 LYS H    1 21 LYS HB2  2.300 . 5.500 3.473 2.584 3.556     .  0 0 "[    .    1    .    2    .    3]" 1 
         39 1 21 LYS H    1 21 LYS HB3  2.400 . 3.100 2.955 2.348 3.105 0.005  7 0 "[    .    1    .    2    .    3]" 1 
         40 1 21 LYS H    1 21 LYS HG2  3.100 . 4.300 3.125 2.370 4.384 0.084 26 0 "[    .    1    .    2    .    3]" 1 
         41 1 21 LYS H    1 21 LYS HD2  2.700 . 5.500 3.408 2.509 4.733     .  0 0 "[    .    1    .    2    .    3]" 1 
         42 1 21 LYS H    1 21 LYS HA   2.600 . 3.400 2.759 2.746 2.775     .  0 0 "[    .    1    .    2    .    3]" 1 
         43 1 22 GLN H    1 22 GLN HA   2.500 . 3.300 2.862 2.851 2.870     .  0 0 "[    .    1    .    2    .    3]" 1 
         44 1 22 GLN H    1 22 GLN QG   2.200 . 5.500 3.967 3.912 4.019     .  0 0 "[    .    1    .    2    .    3]" 1 
         45 1 22 GLN H    1 22 GLN QB   2.300 . 3.000 2.253 2.226 2.287     .  0 0 "[    .    1    .    2    .    3]" 1 
         46 1 21 LYS H    1 21 LYS QE   3.700 . 5.400 3.701 2.664 4.425     .  0 0 "[    .    1    .    2    .    3]" 1 
         47 1 23 MET H    1 23 MET HA   2.600 . 3.400 2.822 2.809 2.829     .  0 0 "[    .    1    .    2    .    3]" 1 
         48 1 23 MET H    1 23 MET HG3  2.400 . 5.500 1.569 1.360 1.723     .  0 0 "[    .    1    .    2    .    3]" 1 
         49 1 23 MET H    1 23 MET HG2  2.600 . 3.400 3.145 2.671 3.253     .  0 0 "[    .    1    .    2    .    3]" 1 
         50 1 23 MET H    1 23 MET HB2  2.400 . 5.500 3.420 3.386 3.483     .  0 0 "[    .    1    .    2    .    3]" 1 
         51 1 23 MET H    1 23 MET HB3  2.600 . 3.400 3.168 3.059 3.222     .  0 0 "[    .    1    .    2    .    3]" 1 
         52 1 24 LEU H    1 24 LEU HA   2.700 . 3.600 2.766 2.744 2.776     .  0 0 "[    .    1    .    2    .    3]" 1 
         53 1 24 LEU H    1 24 LEU HB2  2.900 . 4.000 3.478 3.403 3.567     .  0 0 "[    .    1    .    2    .    3]" 1 
         54 1 24 LEU H    1 24 LEU QD   2.600 . 3.400 2.391 2.158 2.621     .  0 0 "[    .    1    .    2    .    3]" 1 
         55 1 25 GLY H    1 25 GLY HA3  2.400 . 3.100 2.866 2.861 2.871     .  0 0 "[    .    1    .    2    .    3]" 1 
         56 1 25 GLY H    1 25 GLY HA2  2.300 . 3.000 2.324 2.321 2.329     .  0 0 "[    .    1    .    2    .    3]" 1 
         57 1 26 GLU H    1 26 GLU HA   2.700 . 3.600 2.910 2.906 2.915     .  0 0 "[    .    1    .    2    .    3]" 1 
         58 1 26 GLU H    1 26 GLU HB3  2.600 . 5.500 3.368 3.297 3.531     .  0 0 "[    .    1    .    2    .    3]" 1 
         59 1 26 GLU H    1 26 GLU HB2  2.400 . 3.100 2.189 2.174 2.260     .  0 0 "[    .    1    .    2    .    3]" 1 
         60 1 27 ARG H    1 27 ARG HB3  2.900 . 4.000 3.100 2.955 3.369     .  0 0 "[    .    1    .    2    .    3]" 1 
         61 1 27 ARG H    1 27 ARG HB2  2.900 . 4.000 3.378 3.073 3.513     .  0 0 "[    .    1    .    2    .    3]" 1 
         62 1 27 ARG H    1 27 ARG HA   2.500 . 3.300 2.851 2.835 2.861     .  0 0 "[    .    1    .    2    .    3]" 1 
         63 1 27 ARG H    1 27 ARG QD   3.500 . 5.000 4.306 4.153 4.464     .  0 0 "[    .    1    .    2    .    3]" 1 
         64 1 28 LEU H    1 28 LEU HA   2.600 . 3.400 2.728 2.706 2.750     .  0 0 "[    .    1    .    2    .    3]" 1 
         65 1 28 LEU H    1 28 LEU HB3  2.100 . 5.500 3.456 3.421 3.512     .  0 0 "[    .    1    .    2    .    3]" 1 
         66 1 28 LEU H    1 28 LEU HB2  2.500 . 3.300 2.156 2.086 2.278     .  0 0 "[    .    1    .    2    .    3]" 1 
         67 1 28 LEU H    1 28 LEU QD   2.600 . 3.400 2.272 1.786 2.756 0.114 17 0 "[    .    1    .    2    .    3]" 1 
         68 1 29 PHE H    1 29 PHE HA   2.400 . 3.100 2.635 2.605 2.658     .  0 0 "[    .    1    .    2    .    3]" 1 
         69 1 29 PHE H    1 29 PHE HB3  2.900 . 4.000 3.304 3.225 3.364     .  0 0 "[    .    1    .    2    .    3]" 1 
         70 1 29 PHE H    1 29 PHE HB2  2.400 . 5.500 2.128 2.088 2.166     .  0 0 "[    .    1    .    2    .    3]" 1 
         71 1 31 LEU H    1 31 LEU HA   2.500 . 3.300 2.855 2.844 2.866     .  0 0 "[    .    1    .    2    .    3]" 1 
         72 1 31 LEU H    1 31 LEU HB3  2.400 . 5.500 3.487 3.348 3.527     .  0 0 "[    .    1    .    2    .    3]" 1 
         73 1 31 LEU H    1 31 LEU HG   2.100 . 2.700 1.455 1.414 1.491 0.086 30 0 "[    .    1    .    2    .    3]" 1 
         74 1 31 LEU H    1 31 LEU QD   2.700 . 3.600 2.680 2.643 2.711     .  0 0 "[    .    1    .    2    .    3]" 1 
         75 1 32 ILE H    1 32 ILE MD   2.700 . 3.600 3.457 3.328 3.530     .  0 0 "[    .    1    .    2    .    3]" 1 
         76 1 33 GLN H    1 33 GLN HA   2.500 . 3.300 2.841 2.831 2.851     .  0 0 "[    .    1    .    2    .    3]" 1 
         77 1 33 GLN H    1 33 GLN QG   3.200 . 4.500 3.986 3.905 4.033     .  0 0 "[    .    1    .    2    .    3]" 1 
         78 1 33 GLN H    1 33 GLN HB3  2.300 . 3.000 2.389 2.242 2.524     .  0 0 "[    .    1    .    2    .    3]" 1 
         79 1 34 ALA H    1 34 ALA MB   1.900 . 2.400 2.175 2.055 2.275     .  0 0 "[    .    1    .    2    .    3]" 1 
         80 1 35 MET H    1 35 MET HA   2.600 . 3.400 2.939 2.930 2.942     .  0 0 "[    .    1    .    2    .    3]" 1 
         81 1 35 MET H    1 35 MET HG3  2.900 . 4.000 2.251 2.111 3.041     .  0 0 "[    .    1    .    2    .    3]" 1 
         82 1 35 MET H    1 35 MET HG2  2.900 . 4.000 3.270 2.178 3.457     .  0 0 "[    .    1    .    2    .    3]" 1 
         83 1 35 MET H    1 35 MET HB2  2.400 . 3.100 2.704 2.642 2.781     .  0 0 "[    .    1    .    2    .    3]" 1 
         84 1 35 MET H    1 35 MET HB3  2.600 . 5.500 3.688 3.678 3.699     .  0 0 "[    .    1    .    2    .    3]" 1 
         85 1 36 HIS H    1 36 HIS HA   2.700 . 3.600 2.794 2.777 2.847     .  0 0 "[    .    1    .    2    .    3]" 1 
         86 1 36 HIS H    1 36 HIS HB2  2.900 . 4.000 3.460 3.323 3.524     .  0 0 "[    .    1    .    2    .    3]" 1 
         87 1 36 HIS H    1 36 HIS HB3  2.600 . 3.400 2.151 2.007 2.238     .  0 0 "[    .    1    .    2    .    3]" 1 
         88 1 36 HIS H    1 36 HIS HD2  3.600 . 5.200 4.542 3.287 5.337 0.137 28 0 "[    .    1    .    2    .    3]" 1 
         89 1 38 THR H    1 38 THR HA   3.000 . 4.100 2.888 2.874 2.934     .  0 0 "[    .    1    .    2    .    3]" 1 
         90 1 38 THR H    1 38 THR HB   2.900 . 4.000 2.626 2.387 3.032     .  0 0 "[    .    1    .    2    .    3]" 1 
         91 1 38 THR H    1 38 THR MG   2.800 . 3.800 3.754 3.610 3.781     .  0 0 "[    .    1    .    2    .    3]" 1 
         92 1 38 THR H    1 39 LEU H    3.100 . 4.300 3.066 2.503 3.286     .  0 0 "[    .    1    .    2    .    3]" 1 
         93 1 39 LEU HA   1 40 ALA H    2.700 . 3.600 2.604 2.478 2.931     .  0 0 "[    .    1    .    2    .    3]" 1 
         94 1 40 ALA H    1 40 ALA HA   2.400 . 3.100 2.720 2.640 2.840     .  0 0 "[    .    1    .    2    .    3]" 1 
         95 1 39 LEU HB3  1 40 ALA H    3.100 . 5.500 4.307 4.119 4.468     .  0 0 "[    .    1    .    2    .    3]" 1 
         96 1 40 ALA H    1 40 ALA MB   2.000 . 2.500 2.208 2.050 2.283     .  0 0 "[    .    1    .    2    .    3]" 1 
         97 1 32 ILE MG   1 40 ALA H    2.800 . 3.800 3.590 3.420 3.867 0.067 21 0 "[    .    1    .    2    .    3]" 1 
         98 1 39 LEU MD2  1 40 ALA H    3.400 . 4.800 4.673 4.070 5.616 0.816 28 8 "[* * .  * 1    .    -*   ** + 3]" 1 
         99 1 41 GLY H    1 41 GLY HA3  2.300 . 3.000 2.380 2.291 2.948     .  0 0 "[    .    1    .    2    .    3]" 1 
        100 1 42 LYS H    1 42 LYS HA   2.800 . 3.800 2.860 2.770 2.881     .  0 0 "[    .    1    .    2    .    3]" 1 
        101 1 42 LYS H    1 42 LYS HB3  2.500 . 3.300 2.664 2.472 2.946     .  0 0 "[    .    1    .    2    .    3]" 1 
        102 1 42 LYS H    1 42 LYS QG   3.400 . 4.800 4.094 4.007 4.125     .  0 0 "[    .    1    .    2    .    3]" 1 
        103 1 43 ILE H    1 43 ILE HA   2.700 . 3.600 2.769 2.749 2.796     .  0 0 "[    .    1    .    2    .    3]" 1 
        104 1 43 ILE H    1 43 ILE HB   2.700 . 3.600 2.795 2.642 2.981     .  0 0 "[    .    1    .    2    .    3]" 1 
        105 1 43 ILE H    1 43 ILE MD   2.700 . 3.600 3.464 3.261 3.614 0.014 11 0 "[    .    1    .    2    .    3]" 1 
        106 1 44 THR H    1 44 THR HA   2.200 . 2.800 2.749 2.726 2.777     .  0 0 "[    .    1    .    2    .    3]" 1 
        107 1 44 THR H    1 44 THR HB   2.600 . 3.400 2.488 2.170 2.565     .  0 0 "[    .    1    .    2    .    3]" 1 
        108 1 44 THR H    1 44 THR MG   2.700 . 3.600 2.208 2.028 3.625 0.025 29 0 "[    .    1    .    2    .    3]" 1 
        109 1 45 GLY H    1 45 GLY QA   2.400 . 3.100 2.183 2.176 2.188     .  0 0 "[    .    1    .    2    .    3]" 1 
        110 1 47 LEU H    1 47 LEU HA   2.500 . 3.300 2.867 2.808 2.879     .  0 0 "[    .    1    .    2    .    3]" 1 
        111 1 47 LEU H    1 47 LEU HB3  2.200 . 5.500 3.588 3.497 3.615     .  0 0 "[    .    1    .    2    .    3]" 1 
        112 1 47 LEU H    1 47 LEU HB2  2.500 . 3.300 2.398 2.203 2.568     .  0 0 "[    .    1    .    2    .    3]" 1 
        113 1 47 LEU H    1 47 LEU QD   2.400 . 3.100 1.952 1.688 2.486 0.012 19 0 "[    .    1    .    2    .    3]" 1 
        114 1 46 MET H    1 46 MET HA   2.600 . 3.400 2.771 2.744 2.872     .  0 0 "[    .    1    .    2    .    3]" 1 
        115 1 46 MET H    1 46 MET QG   2.500 . 3.300 1.498 1.337 1.822 0.363 27 0 "[    .    1    .    2    .    3]" 1 
        116 1 46 MET H    1 46 MET QB   2.400 . 4.000 2.879 2.736 2.966     .  0 0 "[    .    1    .    2    .    3]" 1 
        117 1 48 LEU H    1 48 LEU HA   2.400 . 3.100 2.833 2.806 2.850     .  0 0 "[    .    1    .    2    .    3]" 1 
        118 1 48 LEU H    1 48 LEU HB3  2.200 . 5.500 3.063 2.937 3.294     .  0 0 "[    .    1    .    2    .    3]" 1 
        119 1 48 LEU H    1 48 LEU HB2  2.500 . 3.300 2.145 2.089 2.192     .  0 0 "[    .    1    .    2    .    3]" 1 
        120 1 48 LEU H    1 48 LEU QD   3.200 . 3.800 3.301 3.184 3.626     .  0 0 "[    .    1    .    2    .    3]" 1 
        121 1 49 GLU H    1 49 GLU HA   2.500 . 3.300 2.877 2.852 2.916     .  0 0 "[    .    1    .    2    .    3]" 1 
        122 1 49 GLU H    1 49 GLU HG3  2.400 . 5.500 2.982 1.970 3.590     .  0 0 "[    .    1    .    2    .    3]" 1 
        123 1 49 GLU H    1 49 GLU HB2  2.300 . 3.000 2.473 2.281 3.520 0.520 21 1 "[    .    1    .    2+   .    3]" 1 
        124 1 50 ILE H    1 50 ILE HA   2.400 . 3.100 2.885 2.869 2.890     .  0 0 "[    .    1    .    2    .    3]" 1 
        125 1 50 ILE H    1 50 ILE HB   2.300 . 3.000 2.240 2.118 2.325     .  0 0 "[    .    1    .    2    .    3]" 1 
        126 1 95 VAL H    1 95 VAL QG   2.400 . 3.100 2.062 1.700 2.468     .  0 0 "[    .    1    .    2    .    3]" 1 
        127 1 50 ILE H    1 50 ILE MD   2.600 . 5.500 4.184 4.019 4.325     .  0 0 "[    .    1    .    2    .    3]" 1 
        128 1 51 ASP H    1 51 ASP HA   2.500 . 3.300 2.841 2.826 2.874     .  0 0 "[    .    1    .    2    .    3]" 1 
        129 1 51 ASP H    1 51 ASP HB2  2.300 . 3.000 2.246 2.228 2.272     .  0 0 "[    .    1    .    2    .    3]" 1 
        130 1 51 ASP H    1 51 ASP HB3  2.400 . 5.500 3.529 3.521 3.542     .  0 0 "[    .    1    .    2    .    3]" 1 
        131 1 51 ASP HA   1 52 ASN H    1.900 . 2.400 2.314 2.172 2.368     .  0 0 "[    .    1    .    2    .    3]" 1 
        132 1 52 ASN H    1 52 ASN HB3  2.700 . 3.600 3.410 2.780 3.549     .  0 0 "[    .    1    .    2    .    3]" 1 
        133 1 52 ASN H    1 52 ASN HB2  2.700 . 3.600 2.236 2.174 2.348     .  0 0 "[    .    1    .    2    .    3]" 1 
        134 1 52 ASN H    1 52 ASN QD   3.500 . 5.000 4.477 3.849 4.645     .  0 0 "[    .    1    .    2    .    3]" 1 
        135 1 53 SER H    1 53 SER HA   2.400 . 3.100 2.875 2.866 2.880     .  0 0 "[    .    1    .    2    .    3]" 1 
        136 1 53 SER H    1 53 SER QB   2.100 . 2.700 2.196 2.091 2.428     .  0 0 "[    .    1    .    2    .    3]" 1 
        137 1 54 GLU H    1 54 GLU HA   2.300 . 3.000 2.869 2.857 2.880     .  0 0 "[    .    1    .    2    .    3]" 1 
        138 1 54 GLU H    1 54 GLU QG   2.700 . 3.600 2.882 2.566 3.186     .  0 0 "[    .    1    .    2    .    3]" 1 
        139 1 54 GLU H    1 54 GLU QB   2.200 . 2.800 2.222 2.102 2.368     .  0 0 "[    .    1    .    2    .    3]" 1 
        140 1 55 LEU H    1 55 LEU HA   2.800 . 3.800 2.801 2.785 2.832     .  0 0 "[    .    1    .    2    .    3]" 1 
        141 1 55 LEU H    1 55 LEU HB3  2.400 . 3.100 2.231 2.181 2.321     .  0 0 "[    .    1    .    2    .    3]" 1 
        142 1 55 LEU H    1 55 LEU HG   2.300 . 3.000 2.918 2.770 3.007 0.007 30 0 "[    .    1    .    2    .    3]" 1 
        143 1 55 LEU H    1 55 LEU HB2  3.000 . 4.100 3.515 3.481 3.566     .  0 0 "[    .    1    .    2    .    3]" 1 
        144 1 55 LEU H    1 55 LEU QD   2.900 . 4.000 3.281 3.236 3.336     .  0 0 "[    .    1    .    2    .    3]" 1 
        145 1 56 LEU H    1 56 LEU HA   2.500 . 3.300 2.796 2.767 2.820     .  0 0 "[    .    1    .    2    .    3]" 1 
        146 1 56 LEU H    1 56 LEU QB   2.200 . 2.800 2.236 2.061 2.713     .  0 0 "[    .    1    .    2    .    3]" 1 
        147 1 55 LEU HG   1 56 LEU H    2.400 . 3.100 1.780 1.714 1.855     .  0 0 "[    .    1    .    2    .    3]" 1 
        148 1 55 LEU QD   1 56 LEU H    2.800 . 3.800 2.692 2.612 2.759     .  0 0 "[    .    1    .    2    .    3]" 1 
        149 1 57 HIS H    1 57 HIS HA   2.400 . 3.100 2.803 2.770 2.837     .  0 0 "[    .    1    .    2    .    3]" 1 
        150 1 57 HIS H    1 57 HIS HB2  2.200 . 2.800 2.170 2.066 2.489     .  0 0 "[    .    1    .    2    .    3]" 1 
        151 1 57 HIS H    1 57 HIS HB3  2.200 . 5.500 3.203 2.564 3.556     .  0 0 "[    .    1    .    2    .    3]" 1 
        152 1 58 MET H    1 58 MET HA   2.800 . 3.800 2.836 2.784 2.883     .  0 0 "[    .    1    .    2    .    3]" 1 
        153 1 58 MET H    1 58 MET HG2  2.400 . 3.100 2.856 2.196 3.155 0.055 19 0 "[    .    1    .    2    .    3]" 1 
        154 1 58 MET H    1 58 MET HB2  2.300 . 3.000 2.371 2.283 2.479     .  0 0 "[    .    1    .    2    .    3]" 1 
        155 1 59 LEU H    1 59 LEU HA   2.400 . 3.100 2.828 2.802 2.850     .  0 0 "[    .    1    .    2    .    3]" 1 
        156 1 59 LEU H    1 59 LEU QB   2.200 . 3.300 2.302 2.049 2.738     .  0 0 "[    .    1    .    2    .    3]" 1 
        157 1 59 LEU H    1 59 LEU HG   2.300 . 5.500 4.018 2.069 4.558     .  0 0 "[    .    1    .    2    .    3]" 1 
        158 1 60 GLU H    1 60 GLU HA   2.400 . 3.100 2.928 2.904 2.941     .  0 0 "[    .    1    .    2    .    3]" 1 
        159 1 60 GLU H    1 60 GLU QG   2.300 . 5.500 2.750 2.183 3.957     .  0 0 "[    .    1    .    2    .    3]" 1 
        160 1 60 GLU H    1 60 GLU QB   2.100 . 2.700 2.509 2.164 2.674     .  0 0 "[    .    1    .    2    .    3]" 1 
        161 1 61 SER H    1 61 SER HA   2.500 . 3.300 2.945 2.940 2.949     .  0 0 "[    .    1    .    2    .    3]" 1 
        162 1 61 SER H    1 61 SER QB   2.300 . 3.000 2.501 2.421 2.562     .  0 0 "[    .    1    .    2    .    3]" 1 
        163 1 63 GLU H    1 63 GLU HA   2.400 . 3.100 2.872 2.867 2.877     .  0 0 "[    .    1    .    2    .    3]" 1 
        164 1 63 GLU H    1 63 GLU HG3  2.600 . 3.400 3.043 2.026 4.356 0.956  7 3 "[    . +  1 -  .    2    .    *]" 1 
        165 1 63 GLU H    1 63 GLU QB   2.100 . 2.700 2.368 2.090 2.605     .  0 0 "[    .    1    .    2    .    3]" 1 
        166 1 64 SER H    1 64 SER HA   2.400 . 3.100 2.839 2.825 2.855     .  0 0 "[    .    1    .    2    .    3]" 1 
        167 1 64 SER H    1 64 SER HB2  2.200 . 2.800 2.511 2.282 2.747     .  0 0 "[    .    1    .    2    .    3]" 1 
        168 1 65 LEU H    1 65 LEU HA   2.600 . 3.400 2.791 2.758 2.869     .  0 0 "[    .    1    .    2    .    3]" 1 
        169 1 65 LEU H    1 65 LEU HB3  2.300 . 3.000 2.191 2.064 2.302     .  0 0 "[    .    1    .    2    .    3]" 1 
        170 1 65 LEU H    1 65 LEU HB2  2.300 . 3.000 2.830 2.656 3.046 0.046  6 0 "[    .    1    .    2    .    3]" 1 
        171 1 65 LEU H    1 65 LEU HG   3.500 . 5.000 4.382 3.953 4.635     .  0 0 "[    .    1    .    2    .    3]" 1 
        172 1 65 LEU H    1 65 LEU QD   3.000 . 4.100 3.571 3.367 3.726     .  0 0 "[    .    1    .    2    .    3]" 1 
        173 1 66 ARG H    1 66 ARG HA   2.400 . 3.100 2.741 2.721 2.763     .  0 0 "[    .    1    .    2    .    3]" 1 
        174 1 66 ARG H    1 66 ARG QD   3.500 . 5.000 4.438 3.638 4.932     .  0 0 "[    .    1    .    2    .    3]" 1 
        175 1 67 SER H    1 67 SER HA   2.300 . 3.000 2.842 2.808 2.858     .  0 0 "[    .    1    .    2    .    3]" 1 
        176 1 67 SER H    1 67 SER HB2  2.100 . 2.700 2.260 2.079 2.722 0.022  6 0 "[    .    1    .    2    .    3]" 1 
        177 1 68 LYS H    1 68 LYS HA   2.600 . 3.400 2.825 2.816 2.832     .  0 0 "[    .    1    .    2    .    3]" 1 
        178 1 68 LYS H    1 68 LYS QB   2.300 . 3.000 2.162 2.089 2.239     .  0 0 "[    .    1    .    2    .    3]" 1 
        179 1 68 LYS H    1 68 LYS QG   3.500 . 4.300 3.526 2.951 3.978     .  0 0 "[    .    1    .    2    .    3]" 1 
        180 1 69 VAL H    1 69 VAL HA   2.500 . 3.300 2.810 2.771 2.843     .  0 0 "[    .    1    .    2    .    3]" 1 
        181 1 69 VAL H    1 69 VAL HB   2.100 . 2.700 2.423 2.344 2.515     .  0 0 "[    .    1    .    2    .    3]" 1 
        182 1 69 VAL H    1 69 VAL QG   2.600 . 2.800 2.350 2.146 2.501     .  0 0 "[    .    1    .    2    .    3]" 1 
        183 1 70 ASP H    1 70 ASP HA   2.300 . 3.000 2.805 2.787 2.821     .  0 0 "[    .    1    .    2    .    3]" 1 
        184 1 70 ASP H    1 70 ASP HB2  2.200 . 2.800 2.623 2.357 2.752     .  0 0 "[    .    1    .    2    .    3]" 1 
        185 1 70 ASP H    1 70 ASP HB3  2.400 . 3.100 2.476 2.369 2.746     .  0 0 "[    .    1    .    2    .    3]" 1 
        186 1 71 GLU H    1 71 GLU HA   2.400 . 3.100 2.852 2.841 2.857     .  0 0 "[    .    1    .    2    .    3]" 1 
        187 1 71 GLU H    1 71 GLU HG3  3.000 . 5.500 4.391 4.347 4.427     .  0 0 "[    .    1    .    2    .    3]" 1 
        188 1 71 GLU H    1 71 GLU HB3  2.400 . 3.100 2.668 2.599 2.739     .  0 0 "[    .    1    .    2    .    3]" 1 
        189 1 71 GLU H    1 71 GLU HB2  2.400 . 3.100 2.430 2.366 2.502     .  0 0 "[    .    1    .    2    .    3]" 1 
        190 1 72 ALA H    1 72 ALA HA   2.600 . 3.400 2.806 2.784 2.834     .  0 0 "[    .    1    .    2    .    3]" 1 
        191 1 72 ALA H    1 72 ALA MB   2.200 . 2.800 2.088 2.028 2.150     .  0 0 "[    .    1    .    2    .    3]" 1 
        192 1 73 VAL H    1 73 VAL HA   2.500 . 3.300 2.822 2.793 2.845     .  0 0 "[    .    1    .    2    .    3]" 1 
        193 1 73 VAL H    1 73 VAL HB   2.900 . 4.000 3.065 2.271 3.644     .  0 0 "[    .    1    .    2    .    3]" 1 
        194 1 73 VAL H    1 73 VAL QG   2.500 . 2.800 2.130 1.750 2.549     .  0 0 "[    .    1    .    2    .    3]" 1 
        195 1 74 ALA H    1 74 ALA HA   2.400 . 3.100 2.842 2.823 2.875     .  0 0 "[    .    1    .    2    .    3]" 1 
        196 1 74 ALA H    1 74 ALA MB   2.100 . 2.700 2.211 2.047 2.252     .  0 0 "[    .    1    .    2    .    3]" 1 
        197 1 75 VAL H    1 75 VAL HA   2.800 . 3.800 2.809 2.788 2.853     .  0 0 "[    .    1    .    2    .    3]" 1 
        198 1 75 VAL H    1 75 VAL HB   2.400 . 5.500 3.540 2.343 3.625     .  0 0 "[    .    1    .    2    .    3]" 1 
        199 1 75 VAL H    1 75 VAL QG   2.500 . 3.300 1.796 1.681 2.326 0.219  9 0 "[    .    1    .    2    .    3]" 1 
        200 1 76 LEU H    1 76 LEU HA   2.700 . 3.600 2.851 2.806 2.868     .  0 0 "[    .    1    .    2    .    3]" 1 
        201 1 76 LEU H    1 76 LEU QB   2.500 . 3.300 2.243 2.153 2.591     .  0 0 "[    .    1    .    2    .    3]" 1 
        202 1 76 LEU H    1 76 LEU QD   3.100 . 4.300 3.058 1.930 3.670     .  0 0 "[    .    1    .    2    .    3]" 1 
        203 1 77 GLN H    1 77 GLN HA   2.500 . 3.300 2.775 2.757 2.816     .  0 0 "[    .    1    .    2    .    3]" 1 
        204 1 77 GLN H    1 77 GLN QG   2.600 . 3.400 2.481 2.104 2.733     .  0 0 "[    .    1    .    2    .    3]" 1 
        205 1 77 GLN H    1 77 GLN QB   2.400 . 3.100 2.301 2.186 2.515     .  0 0 "[    .    1    .    2    .    3]" 1 
        206 1 78 ALA H    1 78 ALA MB   2.600 . 3.400 2.176 2.084 2.275     .  0 0 "[    .    1    .    2    .    3]" 1 
        207 1 79 HIS H    1 79 HIS HA   2.600 . 3.400 2.823 2.792 2.874     .  0 0 "[    .    1    .    2    .    3]" 1 
        208 1 79 HIS H    1 79 HIS HB3  2.400 . 3.100 2.671 2.362 3.108 0.008 24 0 "[    .    1    .    2    .    3]" 1 
        209 1 79 HIS H    1 79 HIS HB2  2.400 . 3.100 2.436 2.130 2.758     .  0 0 "[    .    1    .    2    .    3]" 1 
        210 1 79 HIS H    1 79 HIS HD2  4.100 . 5.500 5.096 4.140 5.451     .  0 0 "[    .    1    .    2    .    3]" 1 
        211 1 80 GLN H    1 80 GLN HA   2.500 . 3.300 2.851 2.790 2.892     .  0 0 "[    .    1    .    2    .    3]" 1 
        212 1 80 GLN H    1 80 GLN HG3  2.800 . 3.800 2.991 1.906 4.563 0.763  9 2 "[    .   +1    .    2-   .    3]" 1 
        213 1 80 GLN H    1 80 GLN HG2  3.300 . 4.700 3.727 3.002 4.560     .  0 0 "[    .    1    .    2    .    3]" 1 
        214 1 80 GLN H    1 80 GLN HB3  2.900 . 4.000 3.398 2.138 3.616     .  0 0 "[    .    1    .    2    .    3]" 1 
        215 1 80 GLN H    1 80 GLN HB2  2.800 . 3.800 2.373 2.071 3.186     .  0 0 "[    .    1    .    2    .    3]" 1 
        216 1 81 ALA H    1 81 ALA MB   2.200 . 2.800 2.163 2.032 2.269     .  0 0 "[    .    1    .    2    .    3]" 1 
        217 1 83 GLU H    1 83 GLU HA   2.300 . 3.000 2.881 2.844 2.923     .  0 0 "[    .    1    .    2    .    3]" 1 
        218 1 83 GLU H    1 83 GLU QB   2.200 . 2.800 2.199 2.068 2.333     .  0 0 "[    .    1    .    2    .    3]" 1 
        219 1 83 GLU H    1 83 GLU HG3  2.700 . 5.500 4.309 3.724 4.575     .  0 0 "[    .    1    .    2    .    3]" 1 
        220 1 83 GLU H    1 83 GLU HG2  2.800 . 5.500 4.366 2.923 4.707     .  0 0 "[    .    1    .    2    .    3]" 1 
        221 1 87 LYS H    1 87 LYS HB3  2.800 . 3.800 3.243 2.800 3.667     .  0 0 "[    .    1    .    2    .    3]" 1 
        222 1 87 LYS H    1 87 LYS HB2  2.500 . 3.300 2.351 2.112 3.511 0.211 19 0 "[    .    1    .    2    .    3]" 1 
        223 1 84 ALA H    1 84 ALA HA   2.500 . 3.300 2.852 2.810 2.881     .  0 0 "[    .    1    .    2    .    3]" 1 
        224 1 84 ALA H    1 84 ALA MB   2.200 . 2.800 2.163 2.031 2.274     .  0 0 "[    .    1    .    2    .    3]" 1 
        225 1 85 ALA H    1 85 ALA HA   2.400 . 3.100 2.851 2.804 2.909     .  0 0 "[    .    1    .    2    .    3]" 1 
        226 1 85 ALA H    1 85 ALA MB   2.100 . 2.700 2.129 2.028 2.241     .  0 0 "[    .    1    .    2    .    3]" 1 
        227 1 86 GLN H    1 86 GLN HG2  2.900 . 4.000 3.215 1.694 4.603 0.603 24 2 "[    . -  1    .    2   +.    3]" 1 
        228 1 86 GLN H    1 86 GLN HB3  2.800 . 3.800 3.369 2.229 3.664     .  0 0 "[    .    1    .    2    .    3]" 1 
        229 1 86 GLN H    1 86 GLN HB2  2.600 . 3.400 2.583 2.095 3.611 0.211  2 0 "[    .    1    .    2    .    3]" 1 
        230 1 88 ALA H    1 88 ALA HA   2.900 . 4.000 2.887 2.834 2.910     .  0 0 "[    .    1    .    2    .    3]" 1 
        231 1 87 LYS HA   1 88 ALA H    2.700 . 3.600 2.739 2.140 3.570     .  0 0 "[    .    1    .    2    .    3]" 1 
        232 1 87 LYS HB3  1 88 ALA H    3.400 . 4.800 3.519 1.984 4.502 0.016 10 0 "[    .    1    .    2    .    3]" 1 
        233 1 87 LYS HB2  1 88 ALA H    3.300 . 4.700 3.960 2.361 4.650     .  0 0 "[    .    1    .    2    .    3]" 1 
        234 1 88 ALA H    1 88 ALA MB   2.400 . 3.100 2.180 2.051 2.300     .  0 0 "[    .    1    .    2    .    3]" 1 
        235 1 89 VAL H    1 89 VAL HA   2.700 . 3.600 2.916 2.872 2.939     .  0 0 "[    .    1    .    2    .    3]" 1 
        236 1 89 VAL H    1 89 VAL HB   2.600 . 3.400 3.043 2.629 3.499 0.099 13 0 "[    .    1    .    2    .    3]" 1 
        237 1 89 VAL H    1 89 VAL MG1  2.600 . 3.400 3.160 1.800 3.835 0.435 10 0 "[    .    1    .    2    .    3]" 1 
        238 1 90 ASN H    1 90 ASN HB3  3.600 . 5.200 3.182 2.560 3.722     .  0 0 "[    .    1    .    2    .    3]" 1 
        239 1 90 ASN H    1 90 ASN HB2  3.300 . 4.700 2.580 2.139 3.665     .  0 0 "[    .    1    .    2    .    3]" 1 
        240 1 91 SER H    1 91 SER HB3  4.300 . 5.500 3.224 2.199 3.649     .  0 0 "[    .    1    .    2    .    3]" 1 
        241 1 91 SER H    1 91 SER HB2  4.400 . 5.500 2.834 2.089 3.644     .  0 0 "[    .    1    .    2    .    3]" 1 
        242 1 92 ALA H    1 92 ALA MB   3.100 . 4.300 2.187 2.032 2.316     .  0 0 "[    .    1    .    2    .    3]" 1 
        243 1 93 THR H    1 93 THR HB   4.200 . 5.500 3.453 2.878 3.752     .  0 0 "[    .    1    .    2    .    3]" 1 
        244 1 93 THR H    1 93 THR MG   4.000 . 5.500 3.030 2.030 3.839     .  0 0 "[    .    1    .    2    .    3]" 1 
        245 1 95 VAL H    1 95 VAL HB   3.100 . 4.300 2.997 2.542 3.712     .  0 0 "[    .    1    .    2    .    3]" 1 
        246 1 96 PRO HA   1 97 THR H    2.900 . 4.000 2.709 2.149 3.576     .  0 0 "[    .    1    .    2    .    3]" 1 
        247 1 82 LYS H    1 82 LYS HA   2.400 . 3.100 2.854 2.777 2.881     .  0 0 "[    .    1    .    2    .    3]" 1 
        248 1 82 LYS H    1 82 LYS QB   2.100 . 2.700 2.340 2.056 2.706 0.006 24 0 "[    .    1    .    2    .    3]" 1 
        249 1 82 LYS H    1 82 LYS QG   2.800 . 3.800 2.704 1.834 3.785     .  0 0 "[    .    1    .    2    .    3]" 1 
        250 1 18 GLN H    1 18 GLN HG2  3.500 . 5.000 3.675 2.278 4.460     .  0 0 "[    .    1    .    2    .    3]" 1 
        251 1 24 LEU H    1 24 LEU HG   3.500 . 5.000 3.249 1.938 4.144 0.062 11 0 "[    .    1    .    2    .    3]" 1 
        252 1 24 LEU H    1 24 LEU HB3  2.700 . 3.600 2.364 2.077 2.774     .  0 0 "[    .    1    .    2    .    3]" 1 
        253 1 31 LEU H    1 31 LEU HB2  2.700 . 3.600 3.168 3.055 3.404     .  0 0 "[    .    1    .    2    .    3]" 1 
        254 1 32 ILE H    1 32 ILE HB   2.300 . 3.000 3.035 2.976 3.129 0.129 28 0 "[    .    1    .    2    .    3]" 1 
        255 1 50 ILE H    1 50 ILE HG13 2.300 . 5.500 4.052 3.818 4.209     .  0 0 "[    .    1    .    2    .    3]" 1 
        256 1 26 GLU H    1 26 GLU QG   2.400 . 5.500 3.872 2.921 3.971     .  0 0 "[    .    1    .    2    .    3]" 1 
        257 1 25 GLY HA2  1 26 GLU H    2.400 . 5.500 3.300 3.276 3.314     .  0 0 "[    .    1    .    2    .    3]" 1 
        258 1 42 LYS H    1 42 LYS QD   3.800 . 5.500 4.125 4.000 4.265     .  0 0 "[    .    1    .    2    .    3]" 1 
        259 1 47 LEU H    1 47 LEU HG   2.400 . 5.500 3.802 2.672 4.049     .  0 0 "[    .    1    .    2    .    3]" 1 
        260 1 68 LYS H    1 68 LYS HD2  3.800 . 5.500 5.153 4.549 5.940 0.440 22 0 "[    .    1    .    2    .    3]" 1 
        261 1 68 LYS H    1 68 LYS QE   5.200 . 5.500 4.616 4.142 5.192     .  0 0 "[    .    1    .    2    .    3]" 1 
        262 1 76 LEU H    1 76 LEU HG   2.500 . 5.500 4.031 2.003 4.624     .  0 0 "[    .    1    .    2    .    3]" 1 
        263 1 24 LEU QD   1 52 ASN QD   3.700 . 5.200 4.440 4.126 4.571     .  0 0 "[    .    1    .    2    .    3]" 1 
        264 1 20 GLN QB   1 52 ASN QD   3.500 . 4.100 3.281 2.726 3.503     .  0 0 "[    .    1    .    2    .    3]" 1 
        265 1 52 ASN HB2  1 52 ASN QD   2.800 . 3.800 3.169 2.335 3.320     .  0 0 "[    .    1    .    2    .    3]" 1 
        266 1 52 ASN HB3  1 52 ASN QD   2.800 . 3.800 2.385 2.100 3.356     .  0 0 "[    .    1    .    2    .    3]" 1 
        267 1 21 LYS QG   1 52 ASN QD   4.100 . 5.500 5.043 4.581 5.374     .  0 0 "[    .    1    .    2    .    3]" 1 
        268 1 21 LYS HB3  1 52 ASN QD   3.900 . 5.500 5.088 4.764 5.351     .  0 0 "[    .    1    .    2    .    3]" 1 
        269 1 21 LYS HA   1 52 ASN QD   4.100 . 5.500 5.050 4.513 5.301     .  0 0 "[    .    1    .    2    .    3]" 1 
        270 1 26 GLU HA   1 52 ASN QD   4.200 . 5.500 3.056 2.474 3.330     .  0 0 "[    .    1    .    2    .    3]" 1 
        271 1 20 GLN QB   1 20 GLN QE   3.200 . 4.300 2.659 1.357 3.613 0.543 23 1 "[    .    1    .    2  + .    3]" 1 
        272 1 20 GLN QE   1 20 GLN HG2  3.000 . 4.100 2.882 2.099 3.349     .  0 0 "[    .    1    .    2    .    3]" 1 
        273 1 20 GLN QE   1 20 GLN QG   3.300 . 4.700 2.296 2.064 2.775     .  0 0 "[    .    1    .    2    .    3]" 1 
        274 1 20 GLN QE   2 17 VAL HA   3.500 . 5.500 5.071 4.687 5.357     .  0 0 "[    .    1    .    2    .    3]" 1 
        275 1  3 LEU QB   1  4 GLY H    4.000 . 5.500 3.172 1.991 3.896 0.009  3 0 "[    .    1    .    2    .    3]" 1 
        276 1  3 LEU HA   1  4 GLY H    2.800 . 3.800 2.721 2.141 3.572     .  0 0 "[    .    1    .    2    .    3]" 1 
        277 1  3 LEU H    1  4 GLY H    3.700 . 5.400 3.613 2.337 4.587     .  0 0 "[    .    1    .    2    .    3]" 1 
        278 1  4 GLY H    1  5 SER H    3.700 . 5.400 3.221 2.113 4.431     .  0 0 "[    .    1    .    2    .    3]" 1 
        279 1  3 LEU QB   1  5 SER H    4.800 . 5.500 4.159 2.418 5.216     .  0 0 "[    .    1    .    2    .    3]" 1 
        280 1  4 GLY QA   1  5 SER H    2.500 . 3.300 2.546 2.109 2.915     .  0 0 "[    .    1    .    2    .    3]" 1 
        281 1  7 LEU H    1  8 THR H    3.200 . 4.500 3.603 2.176 4.540 0.040 16 0 "[    .    1    .    2    .    3]" 1 
        282 1  8 THR H    1  9 ALA H    3.400 . 4.800 2.303 2.261 2.350     .  0 0 "[    .    1    .    2    .    3]" 1 
        283 1  8 THR H    1 33 GLN HB2  4.300 . 5.500 4.472 4.040 4.894     .  0 0 "[    .    1    .    2    .    3]" 1 
        284 1  8 THR H    1 11 MET HB2  2.400 . 5.500 5.337 5.136 5.468     .  0 0 "[    .    1    .    2    .    3]" 1 
        285 1  8 THR H    1 11 MET HG2  3.300 . 5.500 5.487 5.395 5.522 0.022  5 0 "[    .    1    .    2    .    3]" 1 
        286 1  8 THR H    1 11 MET HG3  2.900 . 4.000 4.055 4.011 4.080 0.080 17 0 "[    .    1    .    2    .    3]" 1 
        287 1  9 ALA H    1 11 MET H    4.100 . 5.500 3.876 3.779 3.966     .  0 0 "[    .    1    .    2    .    3]" 1 
        288 1  9 ALA H    1 12 LEU H    4.400 . 5.500 4.665 4.600 4.710     .  0 0 "[    .    1    .    2    .    3]" 1 
        289 1  9 ALA H    1 10 SER H    3.100 . 4.300 2.573 2.549 2.598     .  0 0 "[    .    1    .    2    .    3]" 1 
        290 1  8 THR HA   1  9 ALA H    2.100 . 5.500 3.493 3.461 3.515     .  0 0 "[    .    1    .    2    .    3]" 1 
        291 1  9 ALA H    1 12 LEU QD   2.900 . 5.500 4.145 3.939 4.352     .  0 0 "[    .    1    .    2    .    3]" 1 
        292 1  8 THR MG   1  9 ALA H    2.800 . 3.800 2.039 1.863 2.410     .  0 0 "[    .    1    .    2    .    3]" 1 
        293 1  9 ALA HA   1 10 SER H    3.500 . 5.000 3.505 3.487 3.523     .  0 0 "[    .    1    .    2    .    3]" 1 
        294 1  8 THR MG   1 10 SER H    4.600 . 5.500 4.256 4.124 4.462     .  0 0 "[    .    1    .    2    .    3]" 1 
        295 1  9 ALA MB   1 10 SER H    2.900 . 4.000 2.653 2.559 2.718     .  0 0 "[    .    1    .    2    .    3]" 1 
        296 1 11 MET H    1 12 LEU H    2.300 . 3.000 2.575 2.540 2.615     .  0 0 "[    .    1    .    2    .    3]" 1 
        297 1  8 THR H    1 11 MET H    3.200 . 4.500 4.539 4.516 4.563 0.063 30 0 "[    .    1    .    2    .    3]" 1 
        298 1 10 SER H    1 11 MET H    2.900 . 4.000 2.466 2.420 2.514     .  0 0 "[    .    1    .    2    .    3]" 1 
        299 1 10 SER HA   1 11 MET H    2.600 . 5.500 3.518 3.502 3.530     .  0 0 "[    .    1    .    2    .    3]" 1 
        300 1  9 ALA MB   1 11 MET H    3.300 . 4.700 4.428 4.344 4.498     .  0 0 "[    .    1    .    2    .    3]" 1 
        301 1  8 THR MG   1 11 MET H    3.400 . 4.800 4.695 4.569 4.793     .  0 0 "[    .    1    .    2    .    3]" 1 
        302 1 10 SER H    1 12 LEU H    4.200 . 5.500 3.941 3.862 4.027     .  0 0 "[    .    1    .    2    .    3]" 1 
        303 1 11 MET HB2  1 12 LEU H    2.800 . 3.800 2.692 2.621 2.765     .  0 0 "[    .    1    .    2    .    3]" 1 
        304 1 11 MET HB3  1 12 LEU H    2.900 . 4.000 3.841 3.772 3.909     .  0 0 "[    .    1    .    2    .    3]" 1 
        305 1 11 MET HG2  1 12 LEU H    3.400 . 4.800 4.569 4.514 4.635     .  0 0 "[    .    1    .    2    .    3]" 1 
        306 1  9 ALA HA   1 12 LEU H    2.800 . 3.800 3.342 3.237 3.434     .  0 0 "[    .    1    .    2    .    3]" 1 
        307 1 11 MET HA   1 12 LEU H    2.900 . 4.000 3.510 3.497 3.524     .  0 0 "[    .    1    .    2    .    3]" 1 
        308 1 10 SER QB   1 12 LEU H    3.400 . 4.800 4.687 4.608 4.792     .  0 0 "[    .    1    .    2    .    3]" 1 
        309 1 13 ALA H    1 14 SER H    2.400 . 3.100 2.561 2.522 2.598     .  0 0 "[    .    1    .    2    .    3]" 1 
        310 1 10 SER H    1 13 ALA H    4.700 . 5.500 5.103 5.067 5.140     .  0 0 "[    .    1    .    2    .    3]" 1 
        311 1 12 LEU QD   1 13 ALA H    3.800 . 5.500 3.942 3.841 4.049     .  0 0 "[    .    1    .    2    .    3]" 1 
        312 1 12 LEU QB   1 13 ALA H    2.200 . 2.800 2.431 2.245 2.619     .  0 0 "[    .    1    .    2    .    3]" 1 
        313 1 11 MET HB2  1 13 ALA H    4.000 . 5.500 5.232 5.102 5.351     .  0 0 "[    .    1    .    2    .    3]" 1 
        314 1 10 SER HA   1 13 ALA H    3.600 . 5.200 3.500 3.423 3.559     .  0 0 "[    .    1    .    2    .    3]" 1 
        315 1 10 SER QB   1 13 ALA H    2.600 . 5.500 5.134 5.039 5.186     .  0 0 "[    .    1    .    2    .    3]" 1 
        316 1 12 LEU HA   1 13 ALA H    3.600 . 5.200 3.547 3.536 3.555     .  0 0 "[    .    1    .    2    .    3]" 1 
        317 1 10 SER QB   1 14 SER H    3.500 . 5.500 5.317 5.017 5.482     .  0 0 "[    .    1    .    2    .    3]" 1 
        318 1 11 MET HA   1 14 SER H    3.200 . 4.500 3.088 3.041 3.164     .  0 0 "[    .    1    .    2    .    3]" 1 
        319 1 13 ALA HA   1 14 SER H    2.700 . 3.600 3.490 3.456 3.518     .  0 0 "[    .    1    .    2    .    3]" 1 
        320 1 12 LEU QD   1 14 SER H    4.000 . 5.500 5.077 4.892 5.212     .  0 0 "[    .    1    .    2    .    3]" 1 
        321 1 13 ALA MB   1 14 SER H    2.500 . 3.300 2.868 2.761 2.951     .  0 0 "[    .    1    .    2    .    3]" 1 
        322 1 12 LEU QB   1 14 SER H    3.300 . 4.700 4.361 4.205 4.542     .  0 0 "[    .    1    .    2    .    3]" 1 
        323 1 11 MET HB2  1 14 SER H    4.300 . 5.500 5.135 5.020 5.293     .  0 0 "[    .    1    .    2    .    3]" 1 
        324 1 11 MET HG2  1 14 SER H    4.300 . 5.500 5.516 5.479 5.552 0.052 23 0 "[    .    1    .    2    .    3]" 1 
        325 1 14 SER H    1 15 ALA H    2.700 . 3.600 2.685 2.508 3.090     .  0 0 "[    .    1    .    2    .    3]" 1 
        326 1 13 ALA H    1 15 ALA H    3.200 . 4.500 4.206 4.032 4.555 0.055 13 0 "[    .    1    .    2    .    3]" 1 
        327 1 14 SER HA   1 15 ALA H    2.700 . 3.600 3.030 2.756 3.150     .  0 0 "[    .    1    .    2    .    3]" 1 
        328 1 13 ALA HA   1 15 ALA H    2.800 . 3.800 3.794 3.697 3.875 0.075 10 0 "[    .    1    .    2    .    3]" 1 
        329 1 14 SER QB   1 15 ALA H    2.900 . 4.000 3.786 3.620 4.007 0.007 29 0 "[    .    1    .    2    .    3]" 1 
        330 1 12 LEU QD   1 15 ALA H    3.600 . 5.500 5.127 4.891 5.378     .  0 0 "[    .    1    .    2    .    3]" 1 
        331 1 13 ALA MB   1 15 ALA H    3.100 . 5.500 4.389 4.339 4.463     .  0 0 "[    .    1    .    2    .    3]" 1 
        332 1 12 LEU QB   1 15 ALA H    3.900 . 5.500 4.916 4.755 5.288     .  0 0 "[    .    1    .    2    .    3]" 1 
        333 1 15 ALA H    1 23 MET ME   3.500 . 5.000 3.957 3.704 4.425     .  0 0 "[    .    1    .    2    .    3]" 1 
        334 1 15 ALA H    1 19 GLU QG   4.200 . 5.500 5.316 5.255 5.372     .  0 0 "[    .    1    .    2    .    3]" 1 
        335 1 15 ALA H    1 23 MET HG2  3.400 . 4.800 4.817 4.623 4.880 0.080  5 0 "[    .    1    .    2    .    3]" 1 
        336 1 18 GLN H    1 19 GLU H    2.500 . 5.500 3.172 2.496 4.006     .  0 0 "[    .    1    .    2    .    3]" 1 
        337 1 19 GLU H    1 22 GLN H    4.000 . 5.500 5.459 5.306 5.547 0.047 11 0 "[    .    1    .    2    .    3]" 1 
        338 1 19 GLU H    1 20 GLN H    2.300 . 3.000 2.503 2.278 2.717     .  0 0 "[    .    1    .    2    .    3]" 1 
        339 1 15 ALA HA   1 19 GLU H    4.700 . 5.500 5.372 4.911 5.546 0.046  5 0 "[    .    1    .    2    .    3]" 1 
        340 1 18 GLN HA   1 19 GLU H    2.800 . 3.800 2.895 2.339 3.410     .  0 0 "[    .    1    .    2    .    3]" 1 
        341 1 15 ALA MB   1 19 GLU H    3.300 . 4.700 3.889 3.419 4.239     .  0 0 "[    .    1    .    2    .    3]" 1 
        342 1 18 GLN QB   1 19 GLU H    2.500 . 5.500 3.597 3.049 3.920     .  0 0 "[    .    1    .    2    .    3]" 1 
        343 1 18 GLN HG3  1 19 GLU H    3.000 . 5.500 4.959 2.669 5.951 0.451 16 0 "[    .    1    .    2    .    3]" 1 
        344 1 18 GLN H    1 20 GLN H    3.800 . 5.500 4.878 4.233 5.409     .  0 0 "[    .    1    .    2    .    3]" 1 
        345 1 20 GLN H    1 21 LYS H    2.700 . 3.600 3.068 2.757 3.233     .  0 0 "[    .    1    .    2    .    3]" 1 
        346 1 20 GLN H    1 24 LEU QD   5.000 . 5.500 4.073 3.981 4.215     .  0 0 "[    .    1    .    2    .    3]" 1 
        347 1 15 ALA MB   1 20 GLN H    2.900 . 5.500 4.817 4.430 5.224     .  0 0 "[    .    1    .    2    .    3]" 1 
        348 1 19 GLU HB2  1 20 GLN H    2.700 . 5.500 4.084 3.716 4.351     .  0 0 "[    .    1    .    2    .    3]" 1 
        349 1 18 GLN QB   1 20 GLN H    3.500 . 5.000 4.167 3.714 4.613     .  0 0 "[    .    1    .    2    .    3]" 1 
        350 1 19 GLU HB3  1 20 GLN H    2.800 . 5.500 3.921 3.687 4.127     .  0 0 "[    .    1    .    2    .    3]" 1 
        351 1 18 GLN HA   1 20 GLN H    3.800 . 5.500 3.156 2.924 3.403     .  0 0 "[    .    1    .    2    .    3]" 1 
        352 1 19 GLU HA   1 20 GLN H    3.000 . 4.100 3.143 3.055 3.223     .  0 0 "[    .    1    .    2    .    3]" 1 
        353 1 21 LYS H    1 52 ASN QD   4.700 . 5.500 4.840 4.109 5.077     .  0 0 "[    .    1    .    2    .    3]" 1 
        354 1 21 LYS H    1 22 GLN H    2.600 . 3.400 2.784 2.742 2.821     .  0 0 "[    .    1    .    2    .    3]" 1 
        355 1 20 GLN QE   1 21 LYS H    2.600 . 3.400 2.005 1.614 2.426 0.186 25 0 "[    .    1    .    2    .    3]" 1 
        356 1 21 LYS H    1 23 MET H    3.700 . 5.400 5.368 5.154 5.440 0.040  9 0 "[    .    1    .    2    .    3]" 1 
        357 1 21 LYS H    1 24 LEU QD   3.600 . 5.200 4.117 4.011 4.262     .  0 0 "[    .    1    .    2    .    3]" 1 
        358 1 20 GLN QB   1 21 LYS H    2.400 . 4.000 2.748 2.342 3.284     .  0 0 "[    .    1    .    2    .    3]" 1 
        359 1 20 GLN HG3  1 21 LYS H    3.100 . 4.300 2.593 1.736 3.815 0.164 22 0 "[    .    1    .    2    .    3]" 1 
        360 1 20 GLN HA   1 21 LYS H    2.900 . 4.000 3.563 3.543 3.584     .  0 0 "[    .    1    .    2    .    3]" 1 
        361 1 18 GLN HA   1 21 LYS H    3.100 . 5.500 5.345 4.894 5.560 0.060 13 0 "[    .    1    .    2    .    3]" 1 
        362 1 19 GLU HA   1 21 LYS H    3.500 . 5.000 4.296 3.997 4.564     .  0 0 "[    .    1    .    2    .    3]" 1 
        363 1 20 GLN QE   1 22 GLN H    3.900 . 5.500 4.453 4.175 4.733     .  0 0 "[    .    1    .    2    .    3]" 1 
        364 1 22 GLN H    1 23 MET H    2.500 . 3.300 3.014 2.965 3.052     .  0 0 "[    .    1    .    2    .    3]" 1 
        365 1 22 GLN H    1 25 GLY H    4.200 . 5.500 4.350 4.246 4.471     .  0 0 "[    .    1    .    2    .    3]" 1 
        366 1 20 GLN H    1 22 GLN H    3.300 . 4.700 3.998 3.840 4.143     .  0 0 "[    .    1    .    2    .    3]" 1 
        367 1 21 LYS QE   1 22 GLN H    4.500 . 5.500 3.098 1.986 4.322 0.014 27 0 "[    .    1    .    2    .    3]" 1 
        368 1 21 LYS HA   1 22 GLN H    2.900 . 4.000 3.445 3.416 3.483     .  0 0 "[    .    1    .    2    .    3]" 1 
        369 1 19 GLU HA   1 22 GLN H    2.700 . 3.600 3.394 3.244 3.495     .  0 0 "[    .    1    .    2    .    3]" 1 
        370 1 21 LYS HD2  1 22 GLN H    3.500 . 5.000 3.387 1.645 4.711 0.355 18 0 "[    .    1    .    2    .    3]" 1 
        371 1 21 LYS HB3  1 22 GLN H    2.600 . 5.500 4.324 3.090 4.411     .  0 0 "[    .    1    .    2    .    3]" 1 
        372 1 21 LYS HG2  1 22 GLN H    3.500 . 5.000 4.473 4.119 4.668     .  0 0 "[    .    1    .    2    .    3]" 1 
        373 1 21 LYS HB2  1 22 GLN H    2.500 . 5.500 3.680 3.507 4.214     .  0 0 "[    .    1    .    2    .    3]" 1 
        374 1 20 GLN H    1 23 MET H    4.600 . 5.500 5.403 5.145 5.548 0.048 12 0 "[    .    1    .    2    .    3]" 1 
        375 1 23 MET H    1 25 GLY H    4.000 . 5.500 3.771 3.704 3.843     .  0 0 "[    .    1    .    2    .    3]" 1 
        376 1 22 GLN HA   1 23 MET H    2.900 . 4.000 3.534 3.520 3.556     .  0 0 "[    .    1    .    2    .    3]" 1 
        377 1 19 GLU HA   1 23 MET H    3.400 . 5.500 4.682 4.204 5.033     .  0 0 "[    .    1    .    2    .    3]" 1 
        378 1 12 LEU QD   1 23 MET H    3.700 . 5.400 4.840 4.511 5.159     .  0 0 "[    .    1    .    2    .    3]" 1 
        379 1 22 GLN HB3  1 23 MET H    2.600 . 3.400 1.962 1.835 2.083     .  0 0 "[    .    1    .    2    .    3]" 1 
        380 1 22 GLN QG   1 23 MET H    2.700 . 3.600 2.661 2.499 2.902     .  0 0 "[    .    1    .    2    .    3]" 1 
        381 1 23 MET H    1 24 LEU H    2.800 . 3.800 3.420 3.365 3.483     .  0 0 "[    .    1    .    2    .    3]" 1 
        382 1 12 LEU QD   1 24 LEU H    2.900 . 4.000 2.640 2.336 2.976     .  0 0 "[    .    1    .    2    .    3]" 1 
        383 1 23 MET ME   1 24 LEU H    2.700 . 3.600 3.315 3.008 3.606 0.006 23 0 "[    .    1    .    2    .    3]" 1 
        384 1 11 MET ME   1 24 LEU H    3.400 . 4.800 4.082 3.981 4.194     .  0 0 "[    .    1    .    2    .    3]" 1 
        385 1 23 MET HB2  1 24 LEU H    2.600 . 5.500 1.727 1.653 1.840     .  0 0 "[    .    1    .    2    .    3]" 1 
        386 1 22 GLN HB3  1 24 LEU H    4.000 . 5.500 5.303 5.178 5.462     .  0 0 "[    .    1    .    2    .    3]" 1 
        387 1 23 MET HG2  1 24 LEU H    3.600 . 5.200 3.460 3.324 3.654     .  0 0 "[    .    1    .    2    .    3]" 1 
        388 1 23 MET HG3  1 24 LEU H    3.500 . 5.000 3.397 2.718 3.617     .  0 0 "[    .    1    .    2    .    3]" 1 
        389 1 20 GLN HA   1 24 LEU H    3.300 . 4.700 4.179 3.875 4.407     .  0 0 "[    .    1    .    2    .    3]" 1 
        390 1 25 GLY H    2 13 PHE QE   3.800 . 5.500 3.454 3.097 3.693     .  0 0 "[    .    1    .    2    .    3]" 1 
        391 1 25 GLY H    1 29 PHE QD   3.900 . 5.500 5.130 4.710 5.506 0.006 28 0 "[    .    1    .    2    .    3]" 1 
        392 1 24 LEU H    1 25 GLY H    2.600 . 3.400 2.945 2.909 3.007     .  0 0 "[    .    1    .    2    .    3]" 1 
        393 1 25 GLY H    1 26 GLU H    2.700 . 5.500 4.400 4.383 4.422     .  0 0 "[    .    1    .    2    .    3]" 1 
        394 1 24 LEU HA   1 25 GLY H    3.100 . 4.300 3.309 3.281 3.338     .  0 0 "[    .    1    .    2    .    3]" 1 
        395 1 21 LYS HA   1 25 GLY H    3.100 . 4.300 3.917 3.757 4.084     .  0 0 "[    .    1    .    2    .    3]" 1 
        396 1 25 GLY H    1 48 LEU QD   2.900 . 5.500 3.874 3.676 4.171     .  0 0 "[    .    1    .    2    .    3]" 1 
        397 1 24 LEU QD   1 25 GLY H    3.000 . 4.100 2.199 1.992 2.400     .  0 0 "[    .    1    .    2    .    3]" 1 
        398 1 12 LEU QD   1 25 GLY H    3.800 . 5.500 4.858 4.594 5.140     .  0 0 "[    .    1    .    2    .    3]" 1 
        399 1 24 LEU HB3  1 25 GLY H    2.900 . 5.500 4.315 4.117 4.578     .  0 0 "[    .    1    .    2    .    3]" 1 
        400 1 24 LEU HG   1 25 GLY H    3.000 . 4.100 4.035 3.901 4.123 0.023 21 0 "[    .    1    .    2    .    3]" 1 
        401 1 24 LEU HB2  1 25 GLY H    2.600 . 5.500 4.370 4.136 4.533     .  0 0 "[    .    1    .    2    .    3]" 1 
        402 1 23 MET HB3  1 25 GLY H    4.000 . 5.500 4.570 4.172 4.717     .  0 0 "[    .    1    .    2    .    3]" 1 
        403 1 23 MET HB2  1 25 GLY H    3.800 . 5.500 4.255 4.172 4.337     .  0 0 "[    .    1    .    2    .    3]" 1 
        404 1 26 GLU H    2 13 PHE QE   3.300 . 5.000 5.062 4.947 5.146 0.146 19 0 "[    .    1    .    2    .    3]" 1 
        405 1 24 LEU HA   1 26 GLU H    4.000 . 5.500 5.474 5.431 5.519 0.019  8 0 "[    .    1    .    2    .    3]" 1 
        406 1 26 GLU H    1 48 LEU QD   4.200 . 5.500 2.228 1.836 2.629 0.164 23 0 "[    .    1    .    2    .    3]" 1 
        407 1 27 ARG H    1 28 LEU H    2.200 . 5.500 1.390 1.320 1.446     .  0 0 "[    .    1    .    2    .    3]" 1 
        408 1 26 GLU H    1 27 ARG H    2.500 . 3.300 2.524 2.426 2.568     .  0 0 "[    .    1    .    2    .    3]" 1 
        409 1 27 ARG H    1 29 PHE H    3.400 . 4.800 4.609 4.449 4.810 0.010 20 0 "[    .    1    .    2    .    3]" 1 
        410 1 26 GLU QG   1 27 ARG H    3.300 . 4.700 4.046 3.979 4.112     .  0 0 "[    .    1    .    2    .    3]" 1 
        411 1 25 GLY HA3  1 27 ARG H    3.400 . 4.800 4.220 4.095 4.291     .  0 0 "[    .    1    .    2    .    3]" 1 
        412 1 24 LEU HA   1 27 ARG H    2.900 . 5.500 5.533 5.509 5.571 0.071 24 0 "[    .    1    .    2    .    3]" 1 
        413 1 26 GLU HA   1 27 ARG H    3.100 . 4.300 3.514 3.508 3.523     .  0 0 "[    .    1    .    2    .    3]" 1 
        414 1 27 ARG H    1 31 LEU QD   4.600 . 5.500 3.935 3.792 4.077     .  0 0 "[    .    1    .    2    .    3]" 1 
        415 1 26 GLU HB2  1 27 ARG H    2.700 . 3.600 2.500 2.206 2.606     .  0 0 "[    .    1    .    2    .    3]" 1 
        416 1 26 GLU HB3  1 27 ARG H    2.900 . 4.000 2.411 2.254 2.823     .  0 0 "[    .    1    .    2    .    3]" 1 
        417 1 25 GLY H    1 28 LEU H    4.500 . 5.500 5.558 5.504 5.606 0.106 23 0 "[    .    1    .    2    .    3]" 1 
        418 1 28 LEU H    1 29 PHE H    2.500 . 5.500 3.287 3.161 3.431     .  0 0 "[    .    1    .    2    .    3]" 1 
        419 1 25 GLY HA2  1 28 LEU H    3.900 . 5.500 5.503 5.425 5.539 0.039  7 0 "[    .    1    .    2    .    3]" 1 
        420 1 25 GLY HA3  1 28 LEU H    3.100 . 4.300 3.980 3.866 4.021     .  0 0 "[    .    1    .    2    .    3]" 1 
        421 1 27 ARG QD   1 28 LEU H    3.700 . 5.400 4.454 4.185 4.752     .  0 0 "[    .    1    .    2    .    3]" 1 
        422 1 24 LEU HA   1 28 LEU H    3.500 . 5.000 4.795 4.659 4.912     .  0 0 "[    .    1    .    2    .    3]" 1 
        423 1 26 GLU HA   1 28 LEU H    3.300 . 4.700 4.655 4.625 4.691     .  0 0 "[    .    1    .    2    .    3]" 1 
        424 1 27 ARG HA   1 28 LEU H    3.000 . 4.100 3.112 3.066 3.162     .  0 0 "[    .    1    .    2    .    3]" 1 
        425 1 24 LEU QD   1 28 LEU H    3.500 . 5.000 4.122 3.938 4.322     .  0 0 "[    .    1    .    2    .    3]" 1 
        426 1 28 LEU H    1 31 LEU QD   3.600 . 5.200 3.493 3.285 3.684     .  0 0 "[    .    1    .    2    .    3]" 1 
        427 1 27 ARG HB2  1 28 LEU H    2.500 . 5.500 4.292 4.029 4.384     .  0 0 "[    .    1    .    2    .    3]" 1 
        428 1 27 ARG HB3  1 28 LEU H    2.700 . 5.500 3.690 3.583 3.784     .  0 0 "[    .    1    .    2    .    3]" 1 
        429 1 26 GLU HB2  1 28 LEU H    3.800 . 5.500 3.359 3.125 3.478     .  0 0 "[    .    1    .    2    .    3]" 1 
        430 1 26 GLU HB3  1 28 LEU H    4.300 . 5.500 3.695 3.502 4.124     .  0 0 "[    .    1    .    2    .    3]" 1 
        431 1 29 PHE H    1 31 LEU H    3.300 . 4.700 4.746 4.686 4.789 0.089  5 0 "[    .    1    .    2    .    3]" 1 
        432 1 29 PHE H    1 29 PHE QD   3.500 . 5.000 3.785 3.649 3.900     .  0 0 "[    .    1    .    2    .    3]" 1 
        433 1 29 PHE H    1 32 ILE H    4.100 . 5.500 4.972 4.872 5.096     .  0 0 "[    .    1    .    2    .    3]" 1 
        434 1 25 GLY H    1 29 PHE H    4.600 . 5.500 5.293 5.116 5.464     .  0 0 "[    .    1    .    2    .    3]" 1 
        435 1 25 GLY HA3  1 29 PHE H    3.500 . 5.000 4.361 4.025 4.619     .  0 0 "[    .    1    .    2    .    3]" 1 
        436 1 29 PHE H    1 44 THR HB   4.200 . 5.500 2.836 2.542 4.003     .  0 0 "[    .    1    .    2    .    3]" 1 
        437 1 28 LEU HA   1 29 PHE H    2.900 . 4.000 3.536 3.501 3.561     .  0 0 "[    .    1    .    2    .    3]" 1 
        438 1 27 ARG HA   1 29 PHE H    3.200 . 5.500 5.034 4.839 5.245     .  0 0 "[    .    1    .    2    .    3]" 1 
        439 1 28 LEU QD   1 29 PHE H    3.500 . 4.300 3.651 3.542 3.732     .  0 0 "[    .    1    .    2    .    3]" 1 
        440 1 29 PHE H    1 44 THR MG   2.800 . 3.800 3.575 2.358 3.755     .  0 0 "[    .    1    .    2    .    3]" 1 
        441 1 28 LEU HB2  1 29 PHE H    2.900 . 4.000 2.327 2.129 2.494     .  0 0 "[    .    1    .    2    .    3]" 1 
        442 1 28 LEU HB3  1 29 PHE H    2.500 . 3.300 2.314 2.068 2.507     .  0 0 "[    .    1    .    2    .    3]" 1 
        443 1 31 LEU H    1 32 ILE H    2.300 . 3.000 2.614 2.567 2.646     .  0 0 "[    .    1    .    2    .    3]" 1 
        444 1 31 LEU H    1 33 GLN H    2.900 . 4.000 3.557 3.499 3.645     .  0 0 "[    .    1    .    2    .    3]" 1 
        445 1 28 LEU HA   1 31 LEU H    3.200 . 4.500 3.888 3.723 4.065     .  0 0 "[    .    1    .    2    .    3]" 1 
        446 1 29 PHE HA   1 31 LEU H    3.000 . 5.500 4.617 4.529 4.699     .  0 0 "[    .    1    .    2    .    3]" 1 
        447 1  8 THR MG   1 31 LEU H    3.700 . 5.400 4.880 4.531 5.184     .  0 0 "[    .    1    .    2    .    3]" 1 
        448 1 81 ALA H    1 82 LYS H    2.400 . 3.100 2.779 2.533 3.021     .  0 0 "[    .    1    .    2    .    3]" 1 
        449 1 82 LYS H    1 83 GLU H    2.400 . 3.100 2.521 2.380 2.759     .  0 0 "[    .    1    .    2    .    3]" 1 
        450 1 81 ALA HA   1 82 LYS H    2.900 . 4.000 3.566 3.526 3.581     .  0 0 "[    .    1    .    2    .    3]" 1 
        451 1 79 HIS HA   1 82 LYS H    3.000 . 5.500 4.213 3.506 5.259     .  0 0 "[    .    1    .    2    .    3]" 1 
        452 1 81 ALA MB   1 82 LYS H    2.400 . 3.100 2.184 1.794 2.672     .  0 0 "[    .    1    .    2    .    3]" 1 
        453 1 33 GLN H    1 34 ALA H    2.500 . 3.300 2.488 2.393 2.548     .  0 0 "[    .    1    .    2    .    3]" 1 
        454 1 29 PHE QD   1 33 GLN H    4.200 . 5.500 4.098 3.783 4.272     .  0 0 "[    .    1    .    2    .    3]" 1 
        455 1 32 ILE H    1 33 GLN H    2.500 . 3.300 2.458 2.394 2.504     .  0 0 "[    .    1    .    2    .    3]" 1 
        456 1 33 GLN H    1 36 HIS H    4.000 . 5.500 4.939 4.629 5.024     .  0 0 "[    .    1    .    2    .    3]" 1 
        457 1 32 ILE HA   1 33 GLN H    3.100 . 4.300 3.377 3.364 3.417     .  0 0 "[    .    1    .    2    .    3]" 1 
        458 1 31 LEU HA   1 33 GLN H    3.500 . 5.000 3.791 3.703 3.911     .  0 0 "[    .    1    .    2    .    3]" 1 
        459 1 29 PHE HA   1 33 GLN H    2.600 . 5.500 4.113 4.016 4.249     .  0 0 "[    .    1    .    2    .    3]" 1 
        460 1 33 GLN H    1 40 ALA MB   2.600 . 5.500 3.506 3.351 3.742     .  0 0 "[    .    1    .    2    .    3]" 1 
        461 1  8 THR MG   1 33 GLN H    2.300 . 5.500 4.267 4.092 4.408     .  0 0 "[    .    1    .    2    .    3]" 1 
        462 1 31 LEU HB2  1 33 GLN H    4.400 . 5.500 4.589 4.500 4.703     .  0 0 "[    .    1    .    2    .    3]" 1 
        463 1 32 ILE HB   1 33 GLN H    2.500 . 5.500 3.411 3.235 3.476     .  0 0 "[    .    1    .    2    .    3]" 1 
        464 1 31 LEU HG   1 33 GLN H    3.400 . 4.800 4.824 4.694 4.871 0.071 26 0 "[    .    1    .    2    .    3]" 1 
        465 1 34 ALA H    1 35 MET H    2.300 . 3.000 2.384 2.274 2.451     .  0 0 "[    .    1    .    2    .    3]" 1 
        466 1 34 ALA H    1 36 HIS H    3.000 . 4.100 3.967 3.690 4.086     .  0 0 "[    .    1    .    2    .    3]" 1 
        467 1 33 GLN HA   1 34 ALA H    2.800 . 3.800 3.499 3.461 3.525     .  0 0 "[    .    1    .    2    .    3]" 1 
        468 1 32 ILE HA   1 34 ALA H    3.300 . 4.700 3.861 3.693 3.983     .  0 0 "[    .    1    .    2    .    3]" 1 
        469 1 34 ALA H    1 40 ALA MB   3.300 . 4.700 4.717 4.652 4.768 0.068 28 0 "[    .    1    .    2    .    3]" 1 
        470 1  8 THR MG   1 34 ALA H    2.800 . 5.500 5.546 5.366 5.596 0.096 26 0 "[    .    1    .    2    .    3]" 1 
        471 1 32 ILE HB   1 34 ALA H    4.000 . 5.500 5.227 5.017 5.340     .  0 0 "[    .    1    .    2    .    3]" 1 
        472 1 33 GLN HB3  1 34 ALA H    2.500 . 3.300 2.699 2.594 2.935     .  0 0 "[    .    1    .    2    .    3]" 1 
        473 1 33 GLN QG   1 34 ALA H    2.900 . 4.000 3.603 3.282 3.816     .  0 0 "[    .    1    .    2    .    3]" 1 
        474 1 35 MET H    1 36 HIS H    2.200 . 2.800 2.640 2.187 2.726     .  0 0 "[    .    1    .    2    .    3]" 1 
        475 1 33 GLN H    1 35 MET H    3.700 . 5.400 3.608 3.565 3.673     .  0 0 "[    .    1    .    2    .    3]" 1 
        476 1 33 GLN HA   1 35 MET H    3.400 . 4.800 3.983 3.801 4.075     .  0 0 "[    .    1    .    2    .    3]" 1 
        477 1 32 ILE HA   1 35 MET H    3.000 . 4.100 2.691 2.609 2.809     .  0 0 "[    .    1    .    2    .    3]" 1 
        478 1 34 ALA HA   1 35 MET H    2.900 . 4.000 3.467 3.420 3.485     .  0 0 "[    .    1    .    2    .    3]" 1 
        479 1 32 ILE MG   1 35 MET H    3.400 . 4.800 3.818 3.762 3.936     .  0 0 "[    .    1    .    2    .    3]" 1 
        480 1 35 MET H    1 40 ALA MB   3.700 . 5.400 4.129 4.015 4.343     .  0 0 "[    .    1    .    2    .    3]" 1 
        481 1 34 ALA MB   1 35 MET H    2.500 . 3.300 2.790 2.691 3.015     .  0 0 "[    .    1    .    2    .    3]" 1 
        482 1 35 MET H    1 35 MET ME   3.500 . 5.000 3.872 3.676 4.363     .  0 0 "[    .    1    .    2    .    3]" 1 
        483 1 33 GLN HA   1 36 HIS H    3.100 . 4.300 3.503 3.146 3.623     .  0 0 "[    .    1    .    2    .    3]" 1 
        484 1 32 ILE HA   1 36 HIS H    3.500 . 5.000 4.682 4.361 4.739     .  0 0 "[    .    1    .    2    .    3]" 1 
        485 1 34 ALA HA   1 36 HIS H    4.300 . 5.500 3.635 3.551 3.710     .  0 0 "[    .    1    .    2    .    3]" 1 
        486 1 35 MET HA   1 36 HIS H    3.200 . 4.500 2.994 2.941 3.268     .  0 0 "[    .    1    .    2    .    3]" 1 
        487 1 32 ILE MG   1 36 HIS H    3.400 . 4.800 4.534 4.441 4.805 0.005 28 0 "[    .    1    .    2    .    3]" 1 
        488 1 36 HIS H    1 40 ALA MB   3.400 . 4.800 3.693 3.469 4.203     .  0 0 "[    .    1    .    2    .    3]" 1 
        489 1 34 ALA MB   1 36 HIS H    3.500 . 5.000 4.282 4.207 4.319     .  0 0 "[    .    1    .    2    .    3]" 1 
        490 1 35 MET HB3  1 36 HIS H    2.900 . 5.500 4.524 4.397 4.555     .  0 0 "[    .    1    .    2    .    3]" 1 
        491 1 35 MET HB2  1 36 HIS H    2.600 . 5.500 3.963 3.486 4.032     .  0 0 "[    .    1    .    2    .    3]" 1 
        492 1 35 MET HG3  1 36 HIS H    3.500 . 5.000 4.617 4.465 4.797     .  0 0 "[    .    1    .    2    .    3]" 1 
        493 1 36 HIS HA   1 38 THR H    4.100 . 5.500 3.468 1.861 3.679 0.139 29 0 "[    .    1    .    2    .    3]" 1 
        494 1 35 MET HB2  1 38 THR H    2.900 . 5.500 5.150 5.015 5.278     .  0 0 "[    .    1    .    2    .    3]" 1 
        495 1 39 LEU H    1 40 ALA H    2.300 . 3.000 2.541 1.771 2.810     .  0 0 "[    .    1    .    2    .    3]" 1 
        496 1 38 THR H    1 40 ALA H    3.300 . 4.700 4.175 3.077 4.423     .  0 0 "[    .    1    .    2    .    3]" 1 
        497 1 40 ALA H    1 41 GLY H    3.200 . 4.500 3.136 2.750 4.623 0.123 13 0 "[    .    1    .    2    .    3]" 1 
        498 1 36 HIS HB2  1 40 ALA H    3.400 . 4.800 3.419 3.141 3.824     .  0 0 "[    .    1    .    2    .    3]" 1 
        499 1 33 GLN HA   1 40 ALA H    3.200 . 5.500 5.086 4.921 5.326     .  0 0 "[    .    1    .    2    .    3]" 1 
        500 1 38 THR HB   1 40 ALA H    3.100 . 5.500 3.994 3.472 4.398     .  0 0 "[    .    1    .    2    .    3]" 1 
        501 1 40 ALA H    1 43 ILE MD   3.500 . 5.000 3.310 2.701 4.244     .  0 0 "[    .    1    .    2    .    3]" 1 
        502 1 38 THR MG   1 40 ALA H    3.800 . 5.500 4.881 3.995 5.520 0.020 21 0 "[    .    1    .    2    .    3]" 1 
        503 1 35 MET HB2  1 40 ALA H    3.400 . 5.500 5.542 5.494 5.583 0.083 28 0 "[    .    1    .    2    .    3]" 1 
        504 1 36 HIS HB3  1 40 ALA H    3.500 . 5.000 4.537 4.320 4.867     .  0 0 "[    .    1    .    2    .    3]" 1 
        505 1 29 PHE QD   1 41 GLY H    3.800 . 5.000 4.958 3.771 5.092 0.092  1 0 "[    .    1    .    2    .    3]" 1 
        506 1 29 PHE QE   1 41 GLY H    2.900 . 4.000 3.491 3.204 4.078 0.078 26 0 "[    .    1    .    2    .    3]" 1 
        507 1 41 GLY H    1 42 LYS H    2.800 . 5.500 3.182 2.727 4.232     .  0 0 "[    .    1    .    2    .    3]" 1 
        508 1 40 ALA HA   1 41 GLY H    3.500 . 5.000 3.373 2.134 3.552     .  0 0 "[    .    1    .    2    .    3]" 1 
        509 1 40 ALA MB   1 41 GLY H    2.800 . 3.800 2.665 1.969 3.381     .  0 0 "[    .    1    .    2    .    3]" 1 
        510 1 29 PHE QE   1 42 LYS H    4.700 . 5.500 5.534 5.347 5.586 0.086 30 0 "[    .    1    .    2    .    3]" 1 
        511 1 29 PHE HZ   1 42 LYS H    4.500 . 5.500 5.469 5.281 5.535 0.035 22 0 "[    .    1    .    2    .    3]" 1 
        512 1 42 LYS H    1 45 GLY H    5.000 . 5.500 5.097 4.820 5.373     .  0 0 "[    .    1    .    2    .    3]" 1 
        513 1 42 LYS H    1 43 ILE H    2.800 . 5.500 2.526 2.381 2.848     .  0 0 "[    .    1    .    2    .    3]" 1 
        514 1 41 GLY QA   1 42 LYS H    2.600 . 3.400 2.536 2.145 2.672     .  0 0 "[    .    1    .    2    .    3]" 1 
        515 1 40 ALA HA   1 42 LYS H    4.500 . 5.500 4.717 4.175 5.249     .  0 0 "[    .    1    .    2    .    3]" 1 
        516 1 39 LEU MD2  1 42 LYS H    4.600 . 5.500 3.661 2.026 6.239 0.739 23 1 "[    .    1    .    2  + .    3]" 1 
        517 1 42 LYS H    1 76 LEU QD   4.000 . 5.500 3.557 2.851 4.268     .  0 0 "[    .    1    .    2    .    3]" 1 
        518 1 40 ALA MB   1 42 LYS H    4.500 . 5.500 4.973 4.721 5.386     .  0 0 "[    .    1    .    2    .    3]" 1 
        519 1 41 GLY H    1 43 ILE H    4.400 . 5.500 4.121 2.574 4.548     .  0 0 "[    .    1    .    2    .    3]" 1 
        520 1 43 ILE H    1 44 THR H    2.600 . 3.400 2.954 2.835 3.008     .  0 0 "[    .    1    .    2    .    3]" 1 
        521 1 43 ILE H    1 45 GLY H    4.200 . 5.500 4.231 4.057 4.417     .  0 0 "[    .    1    .    2    .    3]" 1 
        522 1 40 ALA HA   1 43 ILE H    3.000 . 4.100 3.663 3.432 4.040     .  0 0 "[    .    1    .    2    .    3]" 1 
        523 1 42 LYS HA   1 43 ILE H    3.200 . 4.500 3.510 3.443 3.564     .  0 0 "[    .    1    .    2    .    3]" 1 
        524 1 41 GLY QA   1 43 ILE H    3.200 . 4.500 4.112 3.569 4.383     .  0 0 "[    .    1    .    2    .    3]" 1 
        525 1 32 ILE MD   1 43 ILE H    3.200 . 4.500 4.088 3.873 4.266     .  0 0 "[    .    1    .    2    .    3]" 1 
        526 1 40 ALA MB   1 43 ILE H    3.700 . 5.400 4.780 4.597 5.296     .  0 0 "[    .    1    .    2    .    3]" 1 
        527 1 42 LYS QG   1 43 ILE H    3.000 . 5.500 4.094 3.770 4.480     .  0 0 "[    .    1    .    2    .    3]" 1 
        528 1 42 LYS QD   1 43 ILE H    3.200 . 4.500 4.331 4.186 4.445     .  0 0 "[    .    1    .    2    .    3]" 1 
        529 1 42 LYS HB3  1 43 ILE H    2.300 . 5.500 2.832 2.660 3.084     .  0 0 "[    .    1    .    2    .    3]" 1 
        530 1 29 PHE QD   1 44 THR H    3.400 . 5.500 5.200 5.032 5.494     .  0 0 "[    .    1    .    2    .    3]" 1 
        531 1 44 THR H    1 45 GLY H    2.700 . 3.600 2.835 2.728 2.960     .  0 0 "[    .    1    .    2    .    3]" 1 
        532 1 44 THR H    1 46 MET H    3.800 . 5.500 4.869 4.384 5.144     .  0 0 "[    .    1    .    2    .    3]" 1 
        533 1 43 ILE HA   1 44 THR H    3.000 . 4.100 3.577 3.545 3.593     .  0 0 "[    .    1    .    2    .    3]" 1 
        534 1 40 ALA HA   1 44 THR H    3.100 . 5.500 3.832 3.558 4.888     .  0 0 "[    .    1    .    2    .    3]" 1 
        535 1 42 LYS HA   1 44 THR H    4.200 . 5.500 4.639 4.196 4.846     .  0 0 "[    .    1    .    2    .    3]" 1 
        536 1 29 PHE HA   1 44 THR H    3.800 . 5.500 4.419 4.159 4.734     .  0 0 "[    .    1    .    2    .    3]" 1 
        537 1 41 GLY HA2  1 44 THR H    2.300 . 5.500 4.511 4.165 4.677     .  0 0 "[    .    1    .    2    .    3]" 1 
        538 1 43 ILE MD   1 44 THR H    3.400 . 4.800 4.288 3.990 4.511     .  0 0 "[    .    1    .    2    .    3]" 1 
        539 1 28 LEU QD   1 44 THR H    3.700 . 5.400 3.756 3.478 4.066     .  0 0 "[    .    1    .    2    .    3]" 1 
        540 1 32 ILE MD   1 44 THR H    2.900 . 4.000 2.443 2.274 2.782     .  0 0 "[    .    1    .    2    .    3]" 1 
        541 1 40 ALA MB   1 44 THR H    3.500 . 5.000 4.330 4.125 5.010 0.010 26 0 "[    .    1    .    2    .    3]" 1 
        542 1 28 LEU HB2  1 44 THR H    4.200 . 5.500 5.573 5.524 5.648 0.148 24 0 "[    .    1    .    2    .    3]" 1 
        543 1 43 ILE HB   1 44 THR H    2.400 . 3.100 2.279 2.078 2.469     .  0 0 "[    .    1    .    2    .    3]" 1 
        544 1 42 LYS QB   1 44 THR H    3.600 . 5.200 5.156 5.005 5.250 0.050 26 0 "[    .    1    .    2    .    3]" 1 
        545 1 45 GLY H    2 13 PHE QD   4.000 . 5.500 4.153 3.485 4.540     .  0 0 "[    .    1    .    2    .    3]" 1 
        546 1 29 PHE QD   1 45 GLY H    4.700 . 5.500 5.550 5.391 5.595 0.095 14 0 "[    .    1    .    2    .    3]" 1 
        547 1 45 GLY H    2 13 PHE H    3.000 . 5.500 4.604 4.166 4.911     .  0 0 "[    .    1    .    2    .    3]" 1 
        548 1 45 GLY H    1 47 LEU H    3.800 . 5.500 4.582 4.351 5.171     .  0 0 "[    .    1    .    2    .    3]" 1 
        549 1 45 GLY H    1 46 MET QG   3.800 . 5.500 3.873 3.730 4.124     .  0 0 "[    .    1    .    2    .    3]" 1 
        550 1 44 THR HB   1 45 GLY H    3.300 . 4.700 3.785 2.580 3.888     .  0 0 "[    .    1    .    2    .    3]" 1 
        551 1 42 LYS HA   1 45 GLY H    3.100 . 4.300 3.454 3.272 3.581     .  0 0 "[    .    1    .    2    .    3]" 1 
        552 1 44 THR HA   1 45 GLY H    3.100 . 4.300 3.538 3.509 3.557     .  0 0 "[    .    1    .    2    .    3]" 1 
        553 1 28 LEU QD   1 45 GLY H    4.400 . 5.500 4.501 4.188 4.853     .  0 0 "[    .    1    .    2    .    3]" 1 
        554 1 44 THR MG   1 45 GLY H    2.900 . 4.000 1.892 1.786 2.756 0.014 23 0 "[    .    1    .    2    .    3]" 1 
        555 1 42 LYS QD   1 45 GLY H    4.000 . 5.500 3.745 3.271 3.958     .  0 0 "[    .    1    .    2    .    3]" 1 
        556 1 42 LYS QB   1 45 GLY H    3.900 . 5.500 5.059 4.898 5.194     .  0 0 "[    .    1    .    2    .    3]" 1 
        557 1 45 GLY H    1 46 MET H    2.600 . 3.400 3.150 2.909 3.307     .  0 0 "[    .    1    .    2    .    3]" 1 
        558 1 56 LEU H    1 58 MET H    3.400 . 4.800 4.051 3.852 4.279     .  0 0 "[    .    1    .    2    .    3]" 1 
        559 1 45 GLY QA   1 46 MET H    2.700 . 3.600 2.491 2.397 2.693     .  0 0 "[    .    1    .    2    .    3]" 1 
        560 1 54 GLU HA   1 58 MET H    3.300 . 4.700 4.380 4.123 4.699     .  0 0 "[    .    1    .    2    .    3]" 1 
        561 1 55 LEU HA   1 58 MET H    3.000 . 4.100 3.478 3.270 3.627     .  0 0 "[    .    1    .    2    .    3]" 1 
        562 1 42 LYS HA   1 46 MET H    3.300 . 5.500 4.411 4.165 4.916     .  0 0 "[    .    1    .    2    .    3]" 1 
        563 1 57 HIS HB2  1 58 MET H    2.700 . 5.500 3.433 2.884 4.008     .  0 0 "[    .    1    .    2    .    3]" 1 
        564 1 57 HIS HB3  1 58 MET H    3.000 . 4.100 3.209 2.642 3.890     .  0 0 "[    .    1    .    2    .    3]" 1 
        565 1 28 LEU QD   1 46 MET H    4.000 . 5.500 5.039 4.378 5.360     .  0 0 "[    .    1    .    2    .    3]" 1 
        566 1 55 LEU HB2  1 58 MET H    4.700 . 5.500 5.325 5.103 5.474     .  0 0 "[    .    1    .    2    .    3]" 1 
        567 1 56 LEU QB   1 58 MET H    3.500 . 5.000 4.579 4.303 4.744     .  0 0 "[    .    1    .    2    .    3]" 1 
        568 1 42 LYS QD   1 46 MET H    3.500 . 4.500 3.409 3.066 3.842     .  0 0 "[    .    1    .    2    .    3]" 1 
        569 1 47 LEU H    1 49 GLU H    4.200 . 5.500 4.621 4.345 4.904     .  0 0 "[    .    1    .    2    .    3]" 1 
        570 1 46 MET QG   1 47 LEU H    3.100 . 4.300 2.675 1.969 3.339 0.031 22 0 "[    .    1    .    2    .    3]" 1 
        571 1 45 GLY QA   1 47 LEU H    4.100 . 5.500 4.361 4.134 4.810     .  0 0 "[    .    1    .    2    .    3]" 1 
        572 1 47 LEU H    1 72 ALA MB   3.500 . 5.500 4.893 4.324 5.463     .  0 0 "[    .    1    .    2    .    3]" 1 
        573 1 46 MET QB   1 47 LEU H    2.600 . 3.400 2.690 1.789 3.080 0.011  9 0 "[    .    1    .    2    .    3]" 1 
        574 1 48 LEU H    1 49 GLU H    2.600 . 3.400 2.581 2.467 2.668     .  0 0 "[    .    1    .    2    .    3]" 1 
        575 1 46 MET H    1 48 LEU H    3.000 . 4.100 3.974 3.660 4.108 0.008 13 0 "[    .    1    .    2    .    3]" 1 
        576 1 47 LEU H    1 48 LEU H    2.400 . 3.100 2.730 2.557 2.882     .  0 0 "[    .    1    .    2    .    3]" 1 
        577 1 45 GLY QA   1 48 LEU H    3.100 . 4.300 3.672 3.461 3.890     .  0 0 "[    .    1    .    2    .    3]" 1 
        578 1 47 LEU HB2  1 48 LEU H    2.900 . 4.000 3.748 3.599 3.950     .  0 0 "[    .    1    .    2    .    3]" 1 
        579 1 47 LEU HB3  1 48 LEU H    2.700 . 5.500 4.305 4.161 4.398     .  0 0 "[    .    1    .    2    .    3]" 1 
        580 1 49 GLU H    1 50 ILE H    2.400 . 5.500 2.809 2.676 3.016     .  0 0 "[    .    1    .    2    .    3]" 1 
        581 1 47 LEU HA   1 49 GLU H    2.900 . 4.000 3.140 2.807 3.531     .  0 0 "[    .    1    .    2    .    3]" 1 
        582 1 48 LEU HA   1 49 GLU H    2.800 . 3.800 3.369 3.238 3.496     .  0 0 "[    .    1    .    2    .    3]" 1 
        583 1 48 LEU QD   1 49 GLU H    4.000 . 5.400 4.032 3.923 4.407     .  0 0 "[    .    1    .    2    .    3]" 1 
        584 1 28 LEU QD   1 49 GLU H    3.400 . 4.800 4.307 3.979 4.549     .  0 0 "[    .    1    .    2    .    3]" 1 
        585 1 49 GLU H    2 11 LYS QG   3.600 . 5.200 5.218 4.588 5.272 0.072  8 0 "[    .    1    .    2    .    3]" 1 
        586 1 48 LEU HB2  1 49 GLU H    3.100 . 4.300 3.806 3.477 3.972     .  0 0 "[    .    1    .    2    .    3]" 1 
        587 1 47 LEU HB3  1 49 GLU H    3.800 . 5.500 4.743 4.382 5.127     .  0 0 "[    .    1    .    2    .    3]" 1 
        588 1 48 LEU HB3  1 49 GLU H    3.100 . 4.300 3.404 3.041 3.708     .  0 0 "[    .    1    .    2    .    3]" 1 
        589 1 50 ILE H    1 51 ASP H    3.100 . 5.500 4.593 4.549 4.609     .  0 0 "[    .    1    .    2    .    3]" 1 
        590 1 48 LEU H    1 50 ILE H    3.200 . 4.500 4.433 4.286 4.549 0.049 29 0 "[    .    1    .    2    .    3]" 1 
        591 1 47 LEU HA   1 50 ILE H    3.200 . 4.500 4.501 4.396 4.557 0.057 24 0 "[    .    1    .    2    .    3]" 1 
        592 1 49 GLU HA   1 50 ILE H    2.800 . 3.800 3.048 2.939 3.111     .  0 0 "[    .    1    .    2    .    3]" 1 
        593 1 48 LEU QD   1 50 ILE H    4.700 . 5.500 3.674 3.541 4.373     .  0 0 "[    .    1    .    2    .    3]" 1 
        594 1 28 LEU QD   1 50 ILE H    3.800 . 4.700 3.474 3.298 3.697     .  0 0 "[    .    1    .    2    .    3]" 1 
        595 1 31 LEU QD   1 32 ILE H    3.200 . 4.500 3.083 2.505 3.279     .  0 0 "[    .    1    .    2    .    3]" 1 
        596 1 47 LEU HB3  1 50 ILE H    3.500 . 5.000 4.776 4.558 4.914     .  0 0 "[    .    1    .    2    .    3]" 1 
        597 1 48 LEU HB3  1 50 ILE H    2.700 . 5.500 4.627 4.389 4.891     .  0 0 "[    .    1    .    2    .    3]" 1 
        598 1 49 GLU HB2  1 50 ILE H    3.500 . 5.000 3.924 3.819 4.326     .  0 0 "[    .    1    .    2    .    3]" 1 
        599 1 49 GLU HB3  1 50 ILE H    3.200 . 4.500 4.410 4.305 4.657 0.157 21 0 "[    .    1    .    2    .    3]" 1 
        600 1 26 GLU QG   1 50 ILE H    3.400 . 4.800 4.191 3.601 4.515     .  0 0 "[    .    1    .    2    .    3]" 1 
        601 1 51 ASP H    1 52 ASN H    3.500 . 5.000 4.620 4.523 4.633     .  0 0 "[    .    1    .    2    .    3]" 1 
        602 1 50 ILE HA   1 51 ASP H    2.100 . 2.700 2.413 2.335 2.590     .  0 0 "[    .    1    .    2    .    3]" 1 
        603 1 50 ILE MD   1 51 ASP H    3.000 . 4.100 3.908 3.490 4.114 0.014 26 0 "[    .    1    .    2    .    3]" 1 
        604 1 50 ILE MG   1 51 ASP H    2.400 . 3.100 2.545 2.311 2.729     .  0 0 "[    .    1    .    2    .    3]" 1 
        605 1 50 ILE HG13 1 51 ASP H    3.200 . 4.500 3.173 2.788 3.609     .  0 0 "[    .    1    .    2    .    3]" 1 
        606 1 50 ILE HG12 1 51 ASP H    2.800 . 3.800 2.270 1.787 2.584 0.013 29 0 "[    .    1    .    2    .    3]" 1 
        607 1 51 ASP H    1 54 GLU QB       . . 3.600 3.251 2.920 3.526     .  0 0 "[    .    1    .    2    .    3]" 1 
        608 1 51 ASP H    1 54 GLU QG   3.700 . 5.400 3.098 2.011 3.998     .  0 0 "[    .    1    .    2    .    3]" 1 
        609 1 52 ASN H    1 54 GLU H    3.900 . 5.500 3.716 3.587 3.915     .  0 0 "[    .    1    .    2    .    3]" 1 
        610 1 51 ASP HB2  1 52 ASN H    3.000 . 5.500 3.951 3.847 4.393     .  0 0 "[    .    1    .    2    .    3]" 1 
        611 1 51 ASP HB3  1 52 ASN H    3.000 . 4.100 2.657 2.499 3.412     .  0 0 "[    .    1    .    2    .    3]" 1 
        612 1 52 ASN H    1 55 LEU QD   3.400 . 4.800 4.214 4.131 4.343     .  0 0 "[    .    1    .    2    .    3]" 1 
        613 1 50 ILE MG   1 52 ASN H    4.700 . 5.500 4.589 4.177 4.689     .  0 0 "[    .    1    .    2    .    3]" 1 
        614 1 52 ASN H    1 55 LEU HB3  4.200 . 5.500 4.893 4.794 4.941     .  0 0 "[    .    1    .    2    .    3]" 1 
        615 1 53 SER H    1 54 GLU H    2.300 . 3.000 2.364 2.316 2.423     .  0 0 "[    .    1    .    2    .    3]" 1 
        616 1 51 ASP H    1 53 SER H    4.200 . 5.500 5.497 5.239 5.547 0.047 11 0 "[    .    1    .    2    .    3]" 1 
        617 1 53 SER H    1 55 LEU H    3.300 . 4.700 3.764 3.641 3.822     .  0 0 "[    .    1    .    2    .    3]" 1 
        618 1 52 ASN HB2  1 53 SER H    2.800 . 3.800 3.164 3.022 3.789     .  0 0 "[    .    1    .    2    .    3]" 1 
        619 1 51 ASP HB3  1 53 SER H    2.700 . 3.600 2.431 2.204 2.763     .  0 0 "[    .    1    .    2    .    3]" 1 
        620 1 51 ASP HB2  1 53 SER H    3.100 . 4.300 3.952 3.612 4.303 0.003 29 0 "[    .    1    .    2    .    3]" 1 
        621 1 52 ASN HB3  1 53 SER H    2.600 . 5.500 3.496 2.884 3.723     .  0 0 "[    .    1    .    2    .    3]" 1 
        622 1 50 ILE MG   1 53 SER H    4.000 . 5.500 5.393 5.138 5.518 0.018  7 0 "[    .    1    .    2    .    3]" 1 
        623 1 51 ASP H    1 54 GLU H    3.600 . 5.200 4.508 4.329 4.609     .  0 0 "[    .    1    .    2    .    3]" 1 
        624 1 54 GLU H    1 55 LEU H    2.300 . 3.000 2.416 2.360 2.472     .  0 0 "[    .    1    .    2    .    3]" 1 
        625 1 54 GLU H    1 56 LEU H    3.200 . 4.500 4.343 4.263 4.424     .  0 0 "[    .    1    .    2    .    3]" 1 
        626 1 51 ASP HB3  1 54 GLU H    2.700 . 5.500 2.294 1.995 2.489     .  0 0 "[    .    1    .    2    .    3]" 1 
        627 1 51 ASP HB2  1 54 GLU H    2.900 . 4.000 2.740 2.541 2.845     .  0 0 "[    .    1    .    2    .    3]" 1 
        628 1 52 ASN HB2  1 54 GLU H    5.100 . 5.500 5.166 5.033 5.555 0.055 29 0 "[    .    1    .    2    .    3]" 1 
        629 1 52 ASN HB3  1 54 GLU H    4.000 . 5.500 5.286 4.962 5.513 0.013 26 0 "[    .    1    .    2    .    3]" 1 
        630 1 53 SER QB   1 54 GLU H    2.500 . 3.300 2.847 2.690 3.035     .  0 0 "[    .    1    .    2    .    3]" 1 
        631 1 53 SER HA   1 54 GLU H    2.700 . 3.600 3.481 3.462 3.508     .  0 0 "[    .    1    .    2    .    3]" 1 
        632 1 50 ILE MG   1 54 GLU H    3.000 . 5.500 4.477 4.238 4.651     .  0 0 "[    .    1    .    2    .    3]" 1 
        633 1 53 SER QB   1 55 LEU H    3.600 . 5.200 4.666 4.460 4.836     .  0 0 "[    .    1    .    2    .    3]" 1 
        634 1 53 SER HA   1 55 LEU H    3.700 . 5.400 4.122 3.989 4.198     .  0 0 "[    .    1    .    2    .    3]" 1 
        635 1 52 ASN HA   1 55 LEU H    2.700 . 3.600 3.173 3.105 3.258     .  0 0 "[    .    1    .    2    .    3]" 1 
        636 1 50 ILE MG   1 55 LEU H    3.100 . 4.300 3.657 3.499 3.848     .  0 0 "[    .    1    .    2    .    3]" 1 
        637 1 27 ARG HB3  1 55 LEU H    3.900 . 5.500 5.582 5.261 6.060 0.560 30 1 "[    .    1    .    2    .    +]" 1 
        638 1 54 GLU QB   1 55 LEU H    2.800 . 3.800 3.138 2.821 3.554     .  0 0 "[    .    1    .    2    .    3]" 1 
        639 1 54 GLU QG   1 55 LEU H    3.900 . 5.500 3.503 2.125 4.464     .  0 0 "[    .    1    .    2    .    3]" 1 
        640 1 52 ASN HB2  1 55 LEU H    4.300 . 5.500 5.465 5.413 5.526 0.026  6 0 "[    .    1    .    2    .    3]" 1 
        641 1 56 LEU H    1 57 HIS H    2.600 . 3.400 2.740 2.643 2.856     .  0 0 "[    .    1    .    2    .    3]" 1 
        642 1 55 LEU H    1 56 LEU H    2.600 . 3.400 2.727 2.637 2.779     .  0 0 "[    .    1    .    2    .    3]" 1 
        643 1 53 SER H    1 56 LEU H    3.700 . 5.400 5.142 5.064 5.224     .  0 0 "[    .    1    .    2    .    3]" 1 
        644 1 31 LEU QD   1 66 ARG H    3.900 . 5.500 4.868 4.621 5.046     .  0 0 "[    .    1    .    2    .    3]" 1 
        645 1 55 LEU HB2  1 56 LEU H    2.800 . 3.800 3.874 3.845 3.898 0.098 24 0 "[    .    1    .    2    .    3]" 1 
        646 1 55 LEU HB3  1 56 LEU H    2.900 . 4.000 3.540 3.466 3.595     .  0 0 "[    .    1    .    2    .    3]" 1 
        647 1 55 LEU H    1 57 HIS H    3.400 . 4.800 4.139 3.970 4.319     .  0 0 "[    .    1    .    2    .    3]" 1 
        648 1 57 HIS H    1 58 MET H    2.400 . 3.100 2.687 2.578 2.822     .  0 0 "[    .    1    .    2    .    3]" 1 
        649 1 56 LEU HA   1 57 HIS H    2.800 . 3.800 3.543 3.514 3.563     .  0 0 "[    .    1    .    2    .    3]" 1 
        650 1 53 SER HA   1 57 HIS H    3.300 . 5.500 4.794 4.696 4.911     .  0 0 "[    .    1    .    2    .    3]" 1 
        651 1 55 LEU HA   1 57 HIS H    3.600 . 5.200 4.483 4.293 4.659     .  0 0 "[    .    1    .    2    .    3]" 1 
        652 1 54 GLU HA   1 57 HIS H    2.600 . 3.400 3.288 3.140 3.418 0.018 20 0 "[    .    1    .    2    .    3]" 1 
        653 1 56 LEU MD2  1 57 HIS H    3.200 . 4.500 4.024 3.000 4.561 0.061  1 0 "[    .    1    .    2    .    3]" 1 
        654 1 56 LEU MD1  1 57 HIS H    3.200 . 4.500 3.950 2.362 4.561 0.061 19 0 "[    .    1    .    2    .    3]" 1 
        655 1 56 LEU QB   1 57 HIS H    2.900 . 4.000 2.608 2.308 3.386     .  0 0 "[    .    1    .    2    .    3]" 1 
        656 1 54 GLU QG   1 57 HIS H    4.800 . 5.500 5.186 4.724 5.306     .  0 0 "[    .    1    .    2    .    3]" 1 
        657 1 55 LEU HG   1 57 HIS H    3.200 . 5.500 4.509 4.377 4.636     .  0 0 "[    .    1    .    2    .    3]" 1 
        658 1 58 MET H    1 59 LEU H    2.600 . 3.400 2.705 2.548 2.918     .  0 0 "[    .    1    .    2    .    3]" 1 
        659 1 58 MET HA   1 59 LEU H    3.100 . 4.300 3.560 3.507 3.607     .  0 0 "[    .    1    .    2    .    3]" 1 
        660 1 55 LEU HA   1 59 LEU H    3.400 . 4.800 4.583 4.257 4.842 0.042 19 0 "[    .    1    .    2    .    3]" 1 
        661 1 57 HIS HA   1 59 LEU H    3.500 . 5.000 4.624 4.197 5.053 0.053 20 0 "[    .    1    .    2    .    3]" 1 
        662 1 31 LEU QD   1 59 LEU H    4.000 . 5.500 3.624 3.229 4.020     .  0 0 "[    .    1    .    2    .    3]" 1 
        663 1 58 MET HB2  1 59 LEU H    2.500 . 3.300 2.511 2.326 2.714     .  0 0 "[    .    1    .    2    .    3]" 1 
        664 1 58 MET QG   1 59 LEU H    3.300 . 4.700 4.192 3.956 4.384     .  0 0 "[    .    1    .    2    .    3]" 1 
        665 1 59 LEU H    1 60 GLU H    2.300 . 3.000 2.588 2.479 2.665     .  0 0 "[    .    1    .    2    .    3]" 1 
        666 1 58 MET H    1 60 GLU H    3.500 . 5.000 3.748 3.502 4.014     .  0 0 "[    .    1    .    2    .    3]" 1 
        667 1 57 HIS HB3  1 60 GLU H    4.200 . 5.500 5.175 4.828 5.467     .  0 0 "[    .    1    .    2    .    3]" 1 
        668 1 58 MET HA   1 60 GLU H    3.100 . 4.300 3.809 3.612 3.993     .  0 0 "[    .    1    .    2    .    3]" 1 
        669 1 59 LEU HA   1 60 GLU H    2.700 . 3.600 3.380 3.269 3.460     .  0 0 "[    .    1    .    2    .    3]" 1 
        670 1 57 HIS HA   1 60 GLU H    2.800 . 5.500 3.497 3.231 3.811     .  0 0 "[    .    1    .    2    .    3]" 1 
        671 1 59 LEU QD   1 60 GLU H    3.200 . 4.500 3.497 2.095 4.239     .  0 0 "[    .    1    .    2    .    3]" 1 
        672 1 59 LEU QB   1 60 GLU H    2.800 . 5.500 3.304 2.900 3.844     .  0 0 "[    .    1    .    2    .    3]" 1 
        673 1 59 LEU H    1 61 SER H    3.000 . 4.100 3.978 3.859 4.074     .  0 0 "[    .    1    .    2    .    3]" 1 
        674 1 61 SER H    1 64 SER H    3.800 . 5.500 5.506 5.424 5.545 0.045  3 0 "[    .    1    .    2    .    3]" 1 
        675 1 61 SER H    1 65 LEU H    3.800 . 5.500 4.520 4.351 4.871     .  0 0 "[    .    1    .    2    .    3]" 1 
        676 1 58 MET H    1 61 SER H    4.200 . 5.500 4.666 4.401 4.855     .  0 0 "[    .    1    .    2    .    3]" 1 
        677 1 58 MET HA   1 61 SER H    2.600 . 3.400 3.251 3.143 3.419 0.019 29 0 "[    .    1    .    2    .    3]" 1 
        678 1 60 GLU HA   1 61 SER H    2.600 . 3.400 3.326 3.231 3.413 0.013 23 0 "[    .    1    .    2    .    3]" 1 
        679 1 57 HIS HA   1 61 SER H    3.400 . 4.800 4.540 4.259 4.721     .  0 0 "[    .    1    .    2    .    3]" 1 
        680 1 60 GLU QG   1 61 SER H    2.900 . 4.000 3.545 2.735 4.070 0.070 19 0 "[    .    1    .    2    .    3]" 1 
        681 1 61 SER H    1 63 GLU H    4.600 . 5.500 5.495 5.414 5.533 0.033 30 0 "[    .    1    .    2    .    3]" 1 
        682 1 63 GLU H    1 64 SER H    2.500 . 3.300 2.563 2.503 2.593     .  0 0 "[    .    1    .    2    .    3]" 1 
        683 1 63 GLU H    1 65 LEU H    3.300 . 4.700 4.079 3.696 4.245     .  0 0 "[    .    1    .    2    .    3]" 1 
        684 1 63 GLU H    1 66 ARG H    4.000 . 5.500 4.847 4.765 5.011     .  0 0 "[    .    1    .    2    .    3]" 1 
        685 1 61 SER QB   1 63 GLU H    4.200 . 5.500 3.955 3.598 4.245     .  0 0 "[    .    1    .    2    .    3]" 1 
        686 1 61 SER HA   1 63 GLU H    3.100 . 4.300 3.483 3.395 3.556     .  0 0 "[    .    1    .    2    .    3]" 1 
        687 1 64 SER H    1 65 LEU H    2.300 . 3.000 2.654 2.474 2.736     .  0 0 "[    .    1    .    2    .    3]" 1 
        688 1 64 SER H    1 66 ARG H    3.400 . 4.800 4.590 4.397 4.804 0.004  5 0 "[    .    1    .    2    .    3]" 1 
        689 1 61 SER QB   1 64 SER H    3.200 . 4.000 2.707 2.289 3.116     .  0 0 "[    .    1    .    2    .    3]" 1 
        690 1 63 GLU HA   1 64 SER H    2.900 . 4.000 3.561 3.548 3.570     .  0 0 "[    .    1    .    2    .    3]" 1 
        691 1 61 SER HA   1 64 SER H    3.700 . 5.400 3.931 3.791 4.144     .  0 0 "[    .    1    .    2    .    3]" 1 
        692 1 63 GLU QB   1 64 SER H    3.100 . 3.300 2.608 2.324 3.168     .  0 0 "[    .    1    .    2    .    3]" 1 
        693 1 63 GLU QG   1 64 SER H    3.000 . 4.100 3.351 1.980 4.101 0.001 16 0 "[    .    1    .    2    .    3]" 1 
        694 1 65 LEU H    1 68 LYS H    3.500 . 5.000 4.726 4.547 5.028 0.028 23 0 "[    .    1    .    2    .    3]" 1 
        695 1 65 LEU H    1 66 ARG H    2.500 . 3.300 2.964 2.715 3.065     .  0 0 "[    .    1    .    2    .    3]" 1 
        696 1 61 SER QB   1 65 LEU H    4.000 . 5.200 2.478 2.252 2.968     .  0 0 "[    .    1    .    2    .    3]" 1 
        697 1 58 MET HA   1 65 LEU H    3.200 . 4.500 3.777 3.487 4.372     .  0 0 "[    .    1    .    2    .    3]" 1 
        698 1 64 SER HB2  1 65 LEU H    2.500 . 3.300 2.601 2.205 3.888 0.588 22 2 "[    .    1    .    2 +  . -  3]" 1 
        699 1 64 SER HA   1 65 LEU H    2.700 . 3.600 3.531 3.438 3.557     .  0 0 "[    .    1    .    2    .    3]" 1 
        700 1 58 MET HB3  1 65 LEU H    3.300 . 5.500 5.076 4.832 5.383     .  0 0 "[    .    1    .    2    .    3]" 1 
        701 1 58 MET QG   1 65 LEU H    4.200 . 5.500 5.223 4.664 5.561 0.061 23 0 "[    .    1    .    2    .    3]" 1 
        702 1 66 ARG H    1 68 LYS H    3.700 . 5.400 4.282 4.127 4.479     .  0 0 "[    .    1    .    2    .    3]" 1 
        703 1 66 ARG H    1 67 SER H    2.500 . 3.300 2.817 2.737 2.871     .  0 0 "[    .    1    .    2    .    3]" 1 
        704 1 66 ARG H    1 69 VAL H    3.800 . 5.500 4.928 4.826 5.087     .  0 0 "[    .    1    .    2    .    3]" 1 
        705 1 53 SER HA   1 56 LEU H    2.800 . 3.800 3.774 3.697 3.823 0.023  1 0 "[    .    1    .    2    .    3]" 1 
        706 1 65 LEU HG   1 66 ARG H    3.100 . 4.300 3.486 2.029 4.317 0.017  7 0 "[    .    1    .    2    .    3]" 1 
        707 1 65 LEU H    1 67 SER H    3.200 . 4.500 4.012 3.706 4.185     .  0 0 "[    .    1    .    2    .    3]" 1 
        708 1 67 SER H    1 70 ASP H    4.000 . 5.500 4.503 4.428 4.594     .  0 0 "[    .    1    .    2    .    3]" 1 
        709 1 67 SER H    1 69 VAL H    3.300 . 4.700 4.389 4.248 4.596     .  0 0 "[    .    1    .    2    .    3]" 1 
        710 1 66 ARG QD   1 67 SER H    3.900 . 5.500 4.866 3.842 5.460     .  0 0 "[    .    1    .    2    .    3]" 1 
        711 1 66 ARG HA   1 67 SER H    2.900 . 4.000 3.497 3.470 3.526     .  0 0 "[    .    1    .    2    .    3]" 1 
        712 1 65 LEU HA   1 67 SER H    3.700 . 5.400 4.143 4.033 4.299     .  0 0 "[    .    1    .    2    .    3]" 1 
        713 1 63 GLU HA   1 67 SER H    3.200 . 4.500 4.361 4.050 4.506 0.006 13 0 "[    .    1    .    2    .    3]" 1 
        714 1 64 SER HA   1 67 SER H    2.800 . 5.500 3.904 3.702 4.337     .  0 0 "[    .    1    .    2    .    3]" 1 
        715 1 65 LEU QD   1 67 SER H    4.100 . 5.500 4.117 3.802 4.609     .  0 0 "[    .    1    .    2    .    3]" 1 
        716 1 66 ARG QG   1 67 SER H    3.200 . 4.500 4.364 4.024 4.516 0.016 21 0 "[    .    1    .    2    .    3]" 1 
        717 1 66 ARG HB3  1 67 SER H    2.300 . 3.000 2.916 2.778 3.037 0.037  1 0 "[    .    1    .    2    .    3]" 1 
        718 1 67 SER H    1 68 LYS H    2.600 . 3.400 2.552 2.475 2.709     .  0 0 "[    .    1    .    2    .    3]" 1 
        719 1 66 ARG HA   1 68 LYS H    4.100 . 5.500 4.288 4.176 4.389     .  0 0 "[    .    1    .    2    .    3]" 1 
        720 1 67 SER QB   1 68 LYS H    2.600 . 3.400 2.643 2.437 2.782     .  0 0 "[    .    1    .    2    .    3]" 1 
        721 1 65 LEU HA   1 68 LYS H    3.200 . 4.500 3.317 3.142 3.514     .  0 0 "[    .    1    .    2    .    3]" 1 
        722 1 67 SER HA   1 68 LYS H    3.100 . 4.300 3.521 3.493 3.543     .  0 0 "[    .    1    .    2    .    3]" 1 
        723 1 68 LYS H    1 69 VAL H    2.400 . 3.100 2.785 2.687 2.898     .  0 0 "[    .    1    .    2    .    3]" 1 
        724 1 69 VAL H    1 72 ALA H    4.200 . 5.500 4.625 4.526 4.722     .  0 0 "[    .    1    .    2    .    3]" 1 
        725 1 69 VAL H    1 70 ASP H    2.400 . 3.100 2.629 2.527 2.748     .  0 0 "[    .    1    .    2    .    3]" 1 
        726 1 66 ARG HA   1 69 VAL H    2.800 . 3.800 3.592 3.477 3.663     .  0 0 "[    .    1    .    2    .    3]" 1 
        727 1 67 SER QB   1 69 VAL H    3.500 . 5.000 5.004 4.900 5.040 0.040 19 0 "[    .    1    .    2    .    3]" 1 
        728 1 65 LEU HA   1 69 VAL H    3.400 . 4.800 4.014 3.823 4.257     .  0 0 "[    .    1    .    2    .    3]" 1 
        729 1 68 LYS HA   1 69 VAL H    2.900 . 4.000 3.567 3.546 3.588     .  0 0 "[    .    1    .    2    .    3]" 1 
        730 1 69 VAL H    2  6 LEU QD   4.500 . 5.500 3.970 3.497 4.569     .  0 0 "[    .    1    .    2    .    3]" 1 
        731 1 65 LEU QD   1 69 VAL H    2.800 . 3.800 2.819 2.512 3.215     .  0 0 "[    .    1    .    2    .    3]" 1 
        732 1 31 LEU QD   1 69 VAL H    3.400 . 5.500 4.397 4.145 4.652     .  0 0 "[    .    1    .    2    .    3]" 1 
        733 1 68 LYS QG   1 69 VAL H    3.900 . 5.500 3.914 3.056 4.259     .  0 0 "[    .    1    .    2    .    3]" 1 
        734 1 66 ARG QG   1 69 VAL H    3.700 . 5.400 5.130 5.020 5.230     .  0 0 "[    .    1    .    2    .    3]" 1 
        735 1 68 LYS QB   1 69 VAL H    2.600 . 3.600 2.248 2.105 2.411     .  0 0 "[    .    1    .    2    .    3]" 1 
        736 1 70 ASP H    1 72 ALA H    3.500 . 5.000 3.625 3.513 3.778     .  0 0 "[    .    1    .    2    .    3]" 1 
        737 1 70 ASP H    1 71 GLU H    2.500 . 3.300 2.713 2.648 2.763     .  0 0 "[    .    1    .    2    .    3]" 1 
        738 1 68 LYS H    1 70 ASP H    3.200 . 4.500 3.639 3.531 3.756     .  0 0 "[    .    1    .    2    .    3]" 1 
        739 1 69 VAL HA   1 70 ASP H    3.000 . 4.100 3.429 3.396 3.455     .  0 0 "[    .    1    .    2    .    3]" 1 
        740 1 66 ARG HA   1 70 ASP H    3.000 . 4.100 3.943 3.743 4.081     .  0 0 "[    .    1    .    2    .    3]" 1 
        741 1 69 VAL QG   1 70 ASP H    2.800 . 5.500 3.472 3.372 3.519     .  0 0 "[    .    1    .    2    .    3]" 1 
        742 1 66 ARG QG   1 70 ASP H    3.600 . 5.200 4.589 4.182 4.835     .  0 0 "[    .    1    .    2    .    3]" 1 
        743 1 35 MET ME   1 70 ASP H    3.200 . 4.500 3.806 3.004 4.161     .  0 0 "[    .    1    .    2    .    3]" 1 
        744 1 69 VAL HB   1 70 ASP H    2.300 . 5.500 3.219 3.147 3.307     .  0 0 "[    .    1    .    2    .    3]" 1 
        745 1 71 GLU H    1 72 ALA H    2.500 . 3.300 2.452 2.422 2.506     .  0 0 "[    .    1    .    2    .    3]" 1 
        746 1 71 GLU H    1 73 VAL H    3.400 . 4.800 4.324 4.048 4.559     .  0 0 "[    .    1    .    2    .    3]" 1 
        747 1 69 VAL H    1 71 GLU H    3.300 . 4.700 4.558 4.500 4.652     .  0 0 "[    .    1    .    2    .    3]" 1 
        748 1 70 ASP HB2  1 71 GLU H    2.700 . 5.500 3.802 3.619 3.881     .  0 0 "[    .    1    .    2    .    3]" 1 
        749 1 69 VAL HA   1 71 GLU H    3.600 . 5.200 4.180 4.138 4.247     .  0 0 "[    .    1    .    2    .    3]" 1 
        750 1 68 LYS HA   1 71 GLU H    2.600 . 5.500 3.798 3.637 3.908     .  0 0 "[    .    1    .    2    .    3]" 1 
        751 1 70 ASP HA   1 71 GLU H    3.100 . 4.300 3.547 3.537 3.553     .  0 0 "[    .    1    .    2    .    3]" 1 
        752 1 69 VAL QG   1 71 GLU H    4.400 . 5.500 4.622 4.567 4.697     .  0 0 "[    .    1    .    2    .    3]" 1 
        753 1 70 ASP HB3  1 71 GLU H    2.900 . 4.000 2.426 2.365 2.496     .  0 0 "[    .    1    .    2    .    3]" 1 
        754 1 72 ALA H    1 74 ALA H    3.400 . 4.800 3.852 3.733 4.003     .  0 0 "[    .    1    .    2    .    3]" 1 
        755 1 72 ALA H    1 73 VAL H    2.600 . 3.400 2.729 2.574 2.865     .  0 0 "[    .    1    .    2    .    3]" 1 
        756 1 69 VAL HA   1 72 ALA H    2.800 . 3.800 2.746 2.685 2.788     .  0 0 "[    .    1    .    2    .    3]" 1 
        757 1 71 GLU HA   1 72 ALA H    3.000 . 4.100 3.462 3.411 3.498     .  0 0 "[    .    1    .    2    .    3]" 1 
        758 1 68 LYS HA   1 72 ALA H    3.200 . 5.500 4.857 4.696 5.050     .  0 0 "[    .    1    .    2    .    3]" 1 
        759 1 70 ASP HA   1 72 ALA H    3.900 . 5.500 4.095 3.872 4.266     .  0 0 "[    .    1    .    2    .    3]" 1 
        760 1 69 VAL QG   1 72 ALA H    4.200 . 5.500 3.586 3.471 3.718     .  0 0 "[    .    1    .    2    .    3]" 1 
        761 1 72 ALA H    2  6 LEU QB   3.400 . 5.500 4.702 3.748 5.525 0.025  3 0 "[    .    1    .    2    .    3]" 1 
        762 1 71 GLU HB3  1 72 ALA H    2.400 . 3.100 2.903 2.733 3.099     .  0 0 "[    .    1    .    2    .    3]" 1 
        763 1 71 GLU HG3  1 72 ALA H    3.400 . 4.800 4.659 4.474 4.939 0.139  6 0 "[    .    1    .    2    .    3]" 1 
        764 1 73 VAL H    1 74 ALA H    2.400 . 3.100 2.535 2.454 2.610     .  0 0 "[    .    1    .    2    .    3]" 1 
        765 1 69 VAL HA   1 73 VAL H    3.400 . 4.800 4.085 3.941 4.244     .  0 0 "[    .    1    .    2    .    3]" 1 
        766 1 72 ALA HA   1 73 VAL H    3.100 . 4.300 3.554 3.503 3.588     .  0 0 "[    .    1    .    2    .    3]" 1 
        767 1 71 GLU HA   1 73 VAL H    3.700 . 5.400 4.300 3.980 4.625     .  0 0 "[    .    1    .    2    .    3]" 1 
        768 1 70 ASP HA   1 73 VAL H    2.800 . 3.800 3.617 3.427 3.756     .  0 0 "[    .    1    .    2    .    3]" 1 
        769 1 69 VAL QG   1 73 VAL H    4.100 . 4.700 3.135 2.902 3.382     .  0 0 "[    .    1    .    2    .    3]" 1 
        770 1 72 ALA MB   1 73 VAL H    2.300 . 3.000 2.555 2.338 2.762     .  0 0 "[    .    1    .    2    .    3]" 1 
        771 1 74 ALA H    1 75 VAL H    2.700 . 3.600 2.580 2.373 2.651     .  0 0 "[    .    1    .    2    .    3]" 1 
        772 1 74 ALA H    1 76 LEU H    3.700 . 5.400 4.059 3.947 4.205     .  0 0 "[    .    1    .    2    .    3]" 1 
        773 1 73 VAL HA   1 74 ALA H    3.100 . 4.300 3.475 3.446 3.505     .  0 0 "[    .    1    .    2    .    3]" 1 
        774 1 72 ALA HA   1 74 ALA H    3.900 . 5.500 4.004 3.897 4.103     .  0 0 "[    .    1    .    2    .    3]" 1 
        775 1 71 GLU HA   1 74 ALA H    3.000 . 4.100 3.208 3.022 3.382     .  0 0 "[    .    1    .    2    .    3]" 1 
        776 1 70 ASP HA   1 74 ALA H    3.500 . 5.000 4.906 4.816 4.973     .  0 0 "[    .    1    .    2    .    3]" 1 
        777 1 73 VAL QG   1 74 ALA H    3.000 . 3.800 2.661 2.088 3.251     .  0 0 "[    .    1    .    2    .    3]" 1 
        778 1 73 VAL HB   1 74 ALA H    2.900 . 4.000 3.545 2.835 4.078 0.078 22 0 "[    .    1    .    2    .    3]" 1 
        779 1 75 VAL H    1 77 GLN H    4.300 . 5.500 4.327 4.071 4.511     .  0 0 "[    .    1    .    2    .    3]" 1 
        780 1 72 ALA HA   1 75 VAL H    3.200 . 4.500 3.149 2.727 3.248     .  0 0 "[    .    1    .    2    .    3]" 1 
        781 1 71 GLU HA   1 75 VAL H    3.700 . 5.400 4.480 4.368 4.797     .  0 0 "[    .    1    .    2    .    3]" 1 
        782 1 74 ALA HA   1 75 VAL H    3.400 . 4.800 3.530 3.473 3.550     .  0 0 "[    .    1    .    2    .    3]" 1 
        783 1 74 ALA MB   1 75 VAL H    2.600 . 3.400 2.700 2.575 2.897     .  0 0 "[    .    1    .    2    .    3]" 1 
        784 1 76 LEU H    1 77 GLN H    2.600 . 3.400 2.599 2.470 2.708     .  0 0 "[    .    1    .    2    .    3]" 1 
        785 1 75 VAL H    1 76 LEU H    2.600 . 3.400 2.617 2.493 2.719     .  0 0 "[    .    1    .    2    .    3]" 1 
        786 1 73 VAL HA   1 76 LEU H    3.000 . 4.100 3.592 3.365 3.762     .  0 0 "[    .    1    .    2    .    3]" 1 
        787 1 75 VAL HA   1 76 LEU H    3.100 . 4.300 3.483 3.458 3.524     .  0 0 "[    .    1    .    2    .    3]" 1 
        788 1 72 ALA HA   1 76 LEU H    3.500 . 5.000 4.744 4.378 4.951     .  0 0 "[    .    1    .    2    .    3]" 1 
        789 1 74 ALA HA   1 76 LEU H    4.200 . 5.500 3.967 3.764 4.255     .  0 0 "[    .    1    .    2    .    3]" 1 
        790 1 43 ILE MD   1 76 LEU H    4.100 . 5.500 3.976 3.619 4.315     .  0 0 "[    .    1    .    2    .    3]" 1 
        791 1 73 VAL QG   1 76 LEU H    3.900 . 5.500 4.397 4.213 4.629     .  0 0 "[    .    1    .    2    .    3]" 1 
        792 1 75 VAL QG   1 76 LEU H    3.000 . 4.100 2.244 1.943 3.223     .  0 0 "[    .    1    .    2    .    3]" 1 
        793 1 46 MET ME   1 76 LEU H    3.100 . 4.300 4.162 3.389 4.326 0.026  2 0 "[    .    1    .    2    .    3]" 1 
        794 1 77 GLN H    1 78 ALA H    2.600 . 3.400 2.712 2.610 2.774     .  0 0 "[    .    1    .    2    .    3]" 1 
        795 1 77 GLN H    1 79 HIS H    3.800 . 5.500 3.894 3.745 4.078     .  0 0 "[    .    1    .    2    .    3]" 1 
        796 1 73 VAL HA   1 77 GLN H    3.400 . 4.800 4.651 4.203 4.866 0.066 11 0 "[    .    1    .    2    .    3]" 1 
        797 1 75 VAL HA   1 77 GLN H    4.000 . 5.500 4.676 4.464 4.942     .  0 0 "[    .    1    .    2    .    3]" 1 
        798 1 74 ALA HA   1 77 GLN H    3.000 . 4.100 3.209 2.952 3.612     .  0 0 "[    .    1    .    2    .    3]" 1 
        799 1 43 ILE MD   1 77 GLN H    5.300 . 5.500 5.018 4.536 5.506 0.006 11 0 "[    .    1    .    2    .    3]" 1 
        800 1 73 VAL QG   1 77 GLN H    3.500 . 5.000 4.282 3.918 4.566     .  0 0 "[    .    1    .    2    .    3]" 1 
        801 1 76 LEU QD   1 77 GLN H    3.600 . 5.200 3.154 2.427 3.851     .  0 0 "[    .    1    .    2    .    3]" 1 
        802 1 75 VAL QG   1 77 GLN H    4.600 . 5.500 4.245 4.066 4.681     .  0 0 "[    .    1    .    2    .    3]" 1 
        803 1 76 LEU QB   1 77 GLN H    3.000 . 3.800 2.363 2.118 2.536     .  0 0 "[    .    1    .    2    .    3]" 1 
        804 1 76 LEU HG   1 77 GLN H    3.300 . 4.700 4.477 3.417 4.827 0.127 28 0 "[    .    1    .    2    .    3]" 1 
        805 1 80 GLN H    1 81 ALA H    2.600 . 3.400 2.584 2.333 2.740     .  0 0 "[    .    1    .    2    .    3]" 1 
        806 1 75 VAL HA   1 78 ALA H    4.100 . 5.500 3.555 3.293 3.791     .  0 0 "[    .    1    .    2    .    3]" 1 
        807 1 77 GLN QB   1 78 ALA H    3.700 . 3.800 2.823 2.667 3.456     .  0 0 "[    .    1    .    2    .    3]" 1 
        808 1 80 GLN HB2  1 81 ALA H    3.000 . 4.100 3.487 2.473 4.190 0.090 21 0 "[    .    1    .    2    .    3]" 1 
        809 1 77 GLN QG   1 78 ALA H    4.600 . 5.500 4.002 1.966 4.406 0.034 22 0 "[    .    1    .    2    .    3]" 1 
        810 1 80 GLN HG2  1 81 ALA H    5.000 . 5.500 5.007 2.813 5.608 0.108 24 0 "[    .    1    .    2    .    3]" 1 
        811 1 79 HIS HA   1 81 ALA H    3.900 . 5.500 3.893 3.251 5.386     .  0 0 "[    .    1    .    2    .    3]" 1 
        812 1 79 HIS HD2  1 80 GLN H    4.100 . 5.500 4.925 3.747 5.514 0.014 24 0 "[    .    1    .    2    .    3]" 1 
        813 1 80 GLN H    1 82 LYS H    3.900 . 5.500 4.932 3.869 5.530 0.030 11 0 "[    .    1    .    2    .    3]" 1 
        814 1 79 HIS H    1 80 GLN H    2.700 . 3.600 2.732 2.457 3.056     .  0 0 "[    .    1    .    2    .    3]" 1 
        815 1 79 HIS HB3  1 80 GLN H    2.700 . 5.500 2.512 1.930 3.377     .  0 0 "[    .    1    .    2    .    3]" 1 
        816 1 78 ALA HA   1 80 GLN H    3.700 . 5.400 4.462 3.594 5.077     .  0 0 "[    .    1    .    2    .    3]" 1 
        817 1 79 HIS HA   1 80 GLN H    3.100 . 4.300 3.533 3.361 3.573     .  0 0 "[    .    1    .    2    .    3]" 1 
        818 1 79 HIS HB2  1 80 GLN H    3.100 . 4.300 3.713 3.194 4.092     .  0 0 "[    .    1    .    2    .    3]" 1 
        819 1 78 ALA H    1 79 HIS H    2.500 . 3.300 2.342 2.279 2.404     .  0 0 "[    .    1    .    2    .    3]" 1 
        820 1 76 LEU H    1 79 HIS H    4.200 . 5.500 4.390 4.237 4.759     .  0 0 "[    .    1    .    2    .    3]" 1 
        821 1 75 VAL QG   1 79 HIS H    3.800 . 5.500 4.352 4.122 4.581     .  0 0 "[    .    1    .    2    .    3]" 1 
        822 1 76 LEU QD   1 79 HIS H    4.100 . 5.500 4.090 3.477 4.798     .  0 0 "[    .    1    .    2    .    3]" 1 
        823 1 78 ALA MB   1 79 HIS H    2.600 . 3.400 2.916 2.728 3.082     .  0 0 "[    .    1    .    2    .    3]" 1 
        824 1 76 LEU QB   1 79 HIS H    3.700 . 5.400 4.513 4.259 4.858     .  0 0 "[    .    1    .    2    .    3]" 1 
        825 1 75 VAL HA   1 79 HIS H    3.800 . 5.500 4.261 4.062 4.581     .  0 0 "[    .    1    .    2    .    3]" 1 
        826 1 76 LEU HA   1 79 HIS H    2.800 . 3.800 3.069 2.812 3.388     .  0 0 "[    .    1    .    2    .    3]" 1 
        827 1 78 ALA HA   1 79 HIS H    3.000 . 4.100 3.458 3.406 3.501     .  0 0 "[    .    1    .    2    .    3]" 1 
        828 1 81 ALA MB   1 83 GLU H    3.500 . 5.000 4.012 3.783 4.433     .  0 0 "[    .    1    .    2    .    3]" 1 
        829 1 82 LYS HA   1 83 GLU H    2.600 . 5.500 3.408 3.300 3.531     .  0 0 "[    .    1    .    2    .    3]" 1 
        830 1 81 ALA HA   1 83 GLU H    3.400 . 4.800 4.192 3.902 4.622     .  0 0 "[    .    1    .    2    .    3]" 1 
        831 1 79 HIS HA   1 83 GLU H    3.500 . 5.000 4.461 3.666 5.006 0.006 18 0 "[    .    1    .    2    .    3]" 1 
        832 1 86 GLN HB2  1 87 LYS H    3.100 . 4.300 3.261 1.915 4.365 0.065 28 0 "[    .    1    .    2    .    3]" 1 
        833 1 86 GLN HB3  1 87 LYS H    3.100 . 4.300 3.275 1.887 4.380 0.080 28 0 "[    .    1    .    2    .    3]" 1 
        834 1 84 ALA H    1 85 ALA H    2.500 . 3.300 2.586 2.402 2.814     .  0 0 "[    .    1    .    2    .    3]" 1 
        835 1 81 ALA MB   1 84 ALA H    3.900 . 5.500 4.805 4.498 5.037     .  0 0 "[    .    1    .    2    .    3]" 1 
        836 1 83 GLU QB   1 84 ALA H    2.800 . 3.800 2.703 2.296 3.371     .  0 0 "[    .    1    .    2    .    3]" 1 
        837 1 83 GLU HG2  1 84 ALA H    3.700 . 5.400 4.305 2.502 5.433 0.033 30 0 "[    .    1    .    2    .    3]" 1 
        838 1 83 GLU HG3  1 84 ALA H    3.600 . 5.200 4.462 2.432 5.409 0.209 13 0 "[    .    1    .    2    .    3]" 1 
        839 1 81 ALA HA   1 84 ALA H    3.100 . 4.300 3.970 3.406 4.338 0.038 11 0 "[    .    1    .    2    .    3]" 1 
        840 1 83 GLU QB   1 85 ALA H    3.800 . 5.500 4.450 4.196 4.847     .  0 0 "[    .    1    .    2    .    3]" 1 
        841 1 83 GLU HA   1 85 ALA H    3.600 . 5.200 3.833 2.987 4.950     .  0 0 "[    .    1    .    2    .    3]" 1 
        842 1 84 ALA HA   1 85 ALA H    2.700 . 3.600 3.361 3.099 3.555     .  0 0 "[    .    1    .    2    .    3]" 1 
        843 1 84 ALA HA   1 86 GLN H    3.800 . 5.500 4.142 3.127 5.505 0.005 30 0 "[    .    1    .    2    .    3]" 1 
        844 1 83 GLU HA   1 86 GLN H    3.300 . 4.700 4.260 3.331 7.328 2.628 30 1 "[    .    1    .    2    .    +]" 1 
        845 1 85 ALA MB   1 86 GLN H    2.700 . 3.600 2.800 1.904 3.702 0.102 28 0 "[    .    1    .    2    .    3]" 1 
        846 1 88 ALA MB   1 89 VAL H    2.800 . 3.800 3.542 3.228 3.721     .  0 0 "[    .    1    .    2    .    3]" 1 
        847 1 87 LYS HA   1 89 VAL H    3.500 . 5.000 4.194 2.941 5.013 0.013 28 0 "[    .    1    .    2    .    3]" 1 
        848 1 88 ALA HA   1 89 VAL H    2.500 . 3.300 2.688 2.187 3.306 0.006 11 0 "[    .    1    .    2    .    3]" 1 
        849 1 89 VAL H    1 90 ASN H    3.300 . 4.700 3.643 2.110 4.594     .  0 0 "[    .    1    .    2    .    3]" 1 
        850 1 89 VAL MG2  1 90 ASN H    3.600 . 5.200 3.725 2.075 4.424     .  0 0 "[    .    1    .    2    .    3]" 1 
        851 1 89 VAL HB   1 90 ASN H    3.500 . 5.000 3.720 2.195 4.533     .  0 0 "[    .    1    .    2    .    3]" 1 
        852 1 89 VAL HA   1 90 ASN H    2.900 . 4.000 2.640 2.139 3.523     .  0 0 "[    .    1    .    2    .    3]" 1 
        853 1 92 ALA H    1 93 THR H    4.000 . 5.500 3.985 2.535 4.611     .  0 0 "[    .    1    .    2    .    3]" 1 
        854 1 93 THR H    1 94 GLY H    3.700 . 5.400 3.680 2.075 4.571     .  0 0 "[    .    1    .    2    .    3]" 1 
        855 1 92 ALA MB   1 93 THR H    3.800 . 5.500 3.012 2.066 3.718     .  0 0 "[    .    1    .    2    .    3]" 1 
        856 1 92 ALA HA   1 93 THR H    3.400 . 4.800 2.544 2.151 3.571     .  0 0 "[    .    1    .    2    .    3]" 1 
        857 1 93 THR MG   1 94 GLY H    4.400 . 5.500 3.573 2.132 4.449     .  0 0 "[    .    1    .    2    .    3]" 1 
        858 1 93 THR HA   1 94 GLY H    3.300 . 4.700 2.760 2.140 3.573     .  0 0 "[    .    1    .    2    .    3]" 1 
        859 1 94 GLY H    1 95 VAL H    3.600 . 5.200 3.524 2.272 4.618     .  0 0 "[    .    1    .    2    .    3]" 1 
        860 1 94 GLY QA   1 95 VAL H    2.800 . 3.800 2.384 2.106 2.914     .  0 0 "[    .    1    .    2    .    3]" 1 
        861 1 31 LEU HB2  1 32 ILE H    3.400 . 4.800 2.668 2.535 2.988     .  0 0 "[    .    1    .    2    .    3]" 1 
        862 1 31 LEU HG   1 32 ILE H    3.500 . 5.000 3.300 3.018 3.414     .  0 0 "[    .    1    .    2    .    3]" 1 
        863 1 97 THR H    1 98 VAL H    4.300 . 5.500 3.587 2.006 4.610     .  0 0 "[    .    1    .    2    .    3]" 1 
        864 1 97 THR HA   1 98 VAL H    3.400 . 4.800 2.791 2.139 3.571     .  0 0 "[    .    1    .    2    .    3]" 1 
        865 2  2 VAL H    2  2 VAL HA   3.000 . 4.100 2.909 2.878 2.934     .  0 0 "[    .    1    .    2    .    3]" 1 
        866 2  2 VAL H    2  2 VAL HB   2.900 . 4.000 2.948 2.587 3.662     .  0 0 "[    .    1    .    2    .    3]" 1 
        867 2  3 LYS H    2  3 LYS HA   2.900 . 4.000 2.904 2.865 2.926     .  0 0 "[    .    1    .    2    .    3]" 1 
        868 2  3 LYS H    2  3 LYS HB3  2.600 . 5.500 3.313 2.361 3.673     .  0 0 "[    .    1    .    2    .    3]" 1 
        869 2  3 LYS H    2  3 LYS HB2  3.300 . 4.700 2.712 2.093 3.649     .  0 0 "[    .    1    .    2    .    3]" 1 
        870 2  3 LYS H    2  3 LYS HG2  3.100 . 4.300 3.262 1.637 4.646 0.346  7 0 "[    .    1    .    2    .    3]" 1 
        871 2  3 LYS HA   2  4 SER H    2.300 . 3.000 2.395 2.134 3.068 0.068 25 0 "[    .    1    .    2    .    3]" 1 
        872 2  4 SER H    2  4 SER QB   3.100 . 4.000 2.570 2.173 2.985     .  0 0 "[    .    1    .    2    .    3]" 1 
        873 2  5 ASN H    2  5 ASN HA   2.300 . 3.000 2.940 2.933 2.947     .  0 0 "[    .    1    .    2    .    3]" 1 
        874 2  5 ASN H    2  5 ASN HB3  2.800 . 3.800 3.523 2.879 3.763     .  0 0 "[    .    1    .    2    .    3]" 1 
        875 2  6 LEU H    2  6 LEU HA   2.800 . 3.800 2.840 2.808 2.891     .  0 0 "[    .    1    .    2    .    3]" 1 
        876 2  6 LEU H    2  6 LEU QB   2.300 . 3.000 2.155 2.034 2.582     .  0 0 "[    .    1    .    2    .    3]" 1 
        877 2  6 LEU H    2  6 LEU QD   3.000 . 4.100 3.316 2.860 3.703     .  0 0 "[    .    1    .    2    .    3]" 1 
        878 2  7 ASN H    2  7 ASN HA   3.000 . 4.100 2.887 2.861 2.922     .  0 0 "[    .    1    .    2    .    3]" 1 
        879 2  7 ASN H    2  7 ASN HB2  2.700 . 3.600 2.267 2.193 2.379     .  0 0 "[    .    1    .    2    .    3]" 1 
        880 2  7 ASN H    2  7 ASN HB3  2.700 . 3.600 2.960 2.897 3.085     .  0 0 "[    .    1    .    2    .    3]" 1 
        881 2  9 ASN H    2  9 ASN HA   2.900 . 4.000 2.946 2.944 2.949     .  0 0 "[    .    1    .    2    .    3]" 1 
        882 2  9 ASN H    2  9 ASN HB3  2.700 . 5.500 3.797 3.746 3.825     .  0 0 "[    .    1    .    2    .    3]" 1 
        883 2  9 ASN H    2  9 ASN HB2  2.600 . 3.400 2.702 2.583 2.839     .  0 0 "[    .    1    .    2    .    3]" 1 
        884 2 10 ALA H    2 10 ALA HA   2.500 . 3.300 2.794 2.755 2.814     .  0 0 "[    .    1    .    2    .    3]" 1 
        885 2 10 ALA H    2 10 ALA MB   2.200 . 2.800 2.131 2.020 2.231     .  0 0 "[    .    1    .    2    .    3]" 1 
        886 2 11 LYS H    2 11 LYS HA   3.000 . 4.100 2.948 2.939 2.951     .  0 0 "[    .    1    .    2    .    3]" 1 
        887 2 11 LYS H    2 11 LYS HB3  2.700 . 3.600 3.670 2.427 3.872 0.272  9 0 "[    .    1    .    2    .    3]" 1 
        888 2 11 LYS H    2 11 LYS HB2  2.700 . 5.500 3.000 2.674 3.639     .  0 0 "[    .    1    .    2    .    3]" 1 
        889 2 11 LYS H    2 11 LYS QG   2.500 . 3.300 2.569 1.740 3.400 0.100 15 0 "[    .    1    .    2    .    3]" 1 
        890 2 12 GLU H    2 12 GLU QG   2.700 . 5.500 3.069 1.634 3.868     .  0 0 "[    .    1    .    2    .    3]" 1 
        891 2 12 GLU H    2 12 GLU HB2  2.200 . 2.800 2.327 2.061 2.822 0.022 24 0 "[    .    1    .    2    .    3]" 1 
        892 2 13 PHE H    2 13 PHE HA   2.600 . 3.400 2.908 2.901 2.935     .  0 0 "[    .    1    .    2    .    3]" 1 
        893 2 13 PHE H    2 13 PHE HB3  2.700 . 3.600 2.726 2.566 2.936     .  0 0 "[    .    1    .    2    .    3]" 1 
        894 2 13 PHE H    2 13 PHE HB2  2.900 . 4.000 2.479 2.251 2.787     .  0 0 "[    .    1    .    2    .    3]" 1 
        895 2 14 VAL H    2 14 VAL HA   2.900 . 4.000 2.942 2.928 2.955     .  0 0 "[    .    1    .    2    .    3]" 1 
        896 2 14 VAL H    2 14 VAL HB   2.700 . 3.600 3.349 2.637 3.750 0.150 20 0 "[    .    1    .    2    .    3]" 1 
        897 2 14 VAL H    2 14 VAL QG   2.600 . 3.400 2.076 1.597 2.780 0.203  1 0 "[    .    1    .    2    .    3]" 1 
        898 2 16 GLY H    2 16 GLY HA3  2.700 . 3.600 2.892 2.859 2.919     .  0 0 "[    .    1    .    2    .    3]" 1 
        899 2 16 GLY H    2 16 GLY HA2  2.500 . 3.300 2.327 2.306 2.349     .  0 0 "[    .    1    .    2    .    3]" 1 
        900 2 17 VAL H    2 17 VAL HA   2.500 . 3.300 2.935 2.921 2.951     .  0 0 "[    .    1    .    2    .    3]" 1 
        901 2 17 VAL H    2 17 VAL HB   2.900 . 4.000 3.463 2.546 3.789     .  0 0 "[    .    1    .    2    .    3]" 1 
        902 2 17 VAL H    2 17 VAL MG1  2.400 . 3.100 2.924 2.336 3.890 0.790 18 4 "[  * .*   1    .  +-2    .    3]" 1 
        903 2 18 LYS H    2 18 LYS HA   2.800 . 3.800 2.813 2.790 2.869     .  0 0 "[    .    1    .    2    .    3]" 1 
        904 2 18 LYS H    2 18 LYS QB   2.300 . 3.000 2.558 2.039 2.815     .  0 0 "[    .    1    .    2    .    3]" 1 
        905 2 18 LYS H    2 18 LYS HG3  2.900 . 4.000 2.783 1.752 3.699 0.048 18 0 "[    .    1    .    2    .    3]" 1 
        906 2 13 PHE H    2 13 PHE QD   3.300 . 4.700 4.204 4.146 4.258     .  0 0 "[    .    1    .    2    .    3]" 1 
        907 2 19 TYR H    2 19 TYR HA   2.700 . 3.600 2.867 2.819 2.897     .  0 0 "[    .    1    .    2    .    3]" 1 
        908 2 19 TYR H    2 19 TYR HB3  2.500 . 5.500 2.902 2.672 3.257     .  0 0 "[    .    1    .    2    .    3]" 1 
        909 2 19 TYR H    2 19 TYR HB2  2.600 . 5.500 2.275 2.064 2.468     .  0 0 "[    .    1    .    2    .    3]" 1 
        910 2 19 TYR H    2 19 TYR QD   3.200 . 4.500 3.996 3.227 4.183     .  0 0 "[    .    1    .    2    .    3]" 1 
        911 2 20 GLY H    2 20 GLY HA3  2.800 . 3.800 2.905 2.859 2.927     .  0 0 "[    .    1    .    2    .    3]" 1 
        912 2 20 GLY H    2 20 GLY HA2  2.700 . 3.600 2.339 2.306 2.365     .  0 0 "[    .    1    .    2    .    3]" 1 
        913 2 21 ASN H    2 21 ASN HB3  3.700 . 5.400 2.858 2.464 3.589     .  0 0 "[    .    1    .    2    .    3]" 1 
        914 2 21 ASN H    2 21 ASN HB2  3.200 . 4.500 2.824 2.293 3.697     .  0 0 "[    .    1    .    2    .    3]" 1 
        915 2 22 ILE H    2 22 ILE HB   3.400 . 4.800 3.081 2.707 3.802     .  0 0 "[    .    1    .    2    .    3]" 1 
        916 2 22 ILE H    2 22 ILE QG   4.200 . 5.500 2.800 2.019 4.129     .  0 0 "[    .    1    .    2    .    3]" 1 
        917 2 22 ILE H    2 22 ILE MG   3.700 . 5.400 3.306 2.074 3.926     .  0 0 "[    .    1    .    2    .    3]" 1 
        918 2 22 ILE H    2 22 ILE MD   3.900 . 5.500 3.599 2.000 4.618     .  0 0 "[    .    1    .    2    .    3]" 1 
        919 2  1 VAL HA   2  2 VAL H    2.300 . 3.000 2.440 2.139 3.032 0.032  4 0 "[    .    1    .    2    .    3]" 1 
        920 2  2 VAL MG1  2  3 LYS H    2.800 . 3.800 3.233 1.973 3.964 0.164  4 0 "[    .    1    .    2    .    3]" 1 
        921 2  2 VAL HB   2  3 LYS H    3.300 . 4.700 3.717 1.972 4.581     .  0 0 "[    .    1    .    2    .    3]" 1 
        922 2  2 VAL HA   2  3 LYS H    2.200 . 2.800 2.289 2.141 2.830 0.030 23 0 "[    .    1    .    2    .    3]" 1 
        923 2  4 SER H    2  5 ASN H    3.900 . 5.500 4.500 4.230 4.624     .  0 0 "[    .    1    .    2    .    3]" 1 
        924 2  2 VAL QG   2  4 SER H    3.800 . 5.500 3.733 2.157 5.061     .  0 0 "[    .    1    .    2    .    3]" 1 
        925 2  3 LYS QG   2  4 SER H    3.800 . 5.500 4.101 3.131 4.779     .  0 0 "[    .    1    .    2    .    3]" 1 
        926 2  3 LYS HB3  2  4 SER H    3.200 . 4.500 3.964 1.606 4.655 0.294 15 0 "[    .    1    .    2    .    3]" 1 
        927 2  5 ASN H    2  6 LEU H    2.900 . 4.000 2.375 2.085 2.883     .  0 0 "[    .    1    .    2    .    3]" 1 
        928 1 47 LEU QD   2  5 ASN H    3.900 . 5.500 4.169 3.750 4.629     .  0 0 "[    .    1    .    2    .    3]" 1 
        929 2  4 SER QB   2  5 ASN H    3.700 . 5.400 2.586 1.982 3.323 0.018 12 0 "[    .    1    .    2    .    3]" 1 
        930 2  4 SER HA   2  5 ASN H    2.500 . 3.300 2.571 2.169 2.979     .  0 0 "[    .    1    .    2    .    3]" 1 
        931 2  5 ASN QB   2  6 LEU H    3.400 . 4.800 2.336 1.999 2.791 0.001 10 0 "[    .    1    .    2    .    3]" 1 
        932 2  4 SER QB   2  6 LEU H    3.600 . 5.000 3.768 2.577 4.289     .  0 0 "[    .    1    .    2    .    3]" 1 
        933 2  6 LEU H    2  7 ASN H    3.500 . 5.000 3.105 2.932 3.298     .  0 0 "[    .    1    .    2    .    3]" 1 
        934 1 47 LEU QD   2  7 ASN H    2.700 . 5.500 1.918 1.536 2.126     .  0 0 "[    .    1    .    2    .    3]" 1 
        935 2  6 LEU QD   2  7 ASN H    3.300 . 4.600 3.417 2.742 3.681     .  0 0 "[    .    1    .    2    .    3]" 1 
        936 2  7 ASN H    2 10 ALA MB   3.800 . 5.000 4.586 4.078 4.830     .  0 0 "[    .    1    .    2    .    3]" 1 
        937 1 47 LEU HB3  2  7 ASN H    3.000 . 5.000 4.949 4.446 5.077 0.077 21 0 "[    .    1    .    2    .    3]" 1 
        938 2  6 LEU HA   2  7 ASN H    2.700 . 3.600 3.543 3.516 3.568     .  0 0 "[    .    1    .    2    .    3]" 1 
        939 2  7 ASN HD21 2 10 ALA MB   4.000 . 5.500 4.615 4.445 4.983     .  0 0 "[    .    1    .    2    .    3]" 1 
        940 2  7 ASN HD21 2  9 ASN HB2  4.100 . 5.500 2.312 2.018 2.590     .  0 0 "[    .    1    .    2    .    3]" 1 
        941 2  7 ASN HB3  2  7 ASN HD21 3.200 . 4.500 2.244 2.120 2.483     .  0 0 "[    .    1    .    2    .    3]" 1 
        942 2  7 ASN HB2  2  7 ASN HD21 3.100 . 4.300 3.447 3.168 3.543     .  0 0 "[    .    1    .    2    .    3]" 1 
        943 2  7 ASN HD21 2 10 ALA HA   3.700 . 5.400 4.030 3.599 4.639     .  0 0 "[    .    1    .    2    .    3]" 1 
        944 2  7 ASN HD22 2  9 ASN HB3  3.500 . 5.000 4.196 3.892 4.731     .  0 0 "[    .    1    .    2    .    3]" 1 
        945 2  7 ASN HB2  2  7 ASN HD22 3.500 . 5.000 4.044 3.900 4.094     .  0 0 "[    .    1    .    2    .    3]" 1 
        946 2  8 PRO HA   2  9 ASN H    2.900 . 4.000 3.310 3.181 3.402     .  0 0 "[    .    1    .    2    .    3]" 1 
        947 2  4 SER QB   2  9 ASN H    3.400 . 4.800 4.537 4.354 4.634     .  0 0 "[    .    1    .    2    .    3]" 1 
        948 2  7 ASN HD22 2  9 ASN H    3.400 . 4.800 3.082 2.789 3.574     .  0 0 "[    .    1    .    2    .    3]" 1 
        949 2  9 ASN H    2 10 ALA H    2.500 . 5.500 2.909 2.463 3.242     .  0 0 "[    .    1    .    2    .    3]" 1 
        950 2  7 ASN HD22 2 10 ALA H    3.700 . 5.400 5.411 5.329 5.450 0.050 21 0 "[    .    1    .    2    .    3]" 1 
        951 2 10 ALA H    2 11 LYS H    3.300 . 4.700 4.231 4.102 4.298     .  0 0 "[    .    1    .    2    .    3]" 1 
        952 1 47 LEU QD   2 10 ALA H    4.300 . 5.000 4.866 4.353 5.056 0.056 29 0 "[    .    1    .    2    .    3]" 1 
        953 1 46 MET QB   2 10 ALA H    4.700 . 5.500 4.520 4.189 4.803     .  0 0 "[    .    1    .    2    .    3]" 1 
        954 2  9 ASN HB2  2 10 ALA H    3.000 . 5.500 4.296 4.054 4.447     .  0 0 "[    .    1    .    2    .    3]" 1 
        955 2  9 ASN HA   2 10 ALA H    2.900 . 4.000 2.694 2.505 2.956     .  0 0 "[    .    1    .    2    .    3]" 1 
        956 2 10 ALA HA   2 11 LYS H    2.100 . 2.700 2.230 2.202 2.298     .  0 0 "[    .    1    .    2    .    3]" 1 
        957 2 11 LYS H    2 12 GLU H    3.500 . 5.000 4.400 4.256 4.524     .  0 0 "[    .    1    .    2    .    3]" 1 
        958 2 12 GLU H    2 14 VAL QG   4.000 . 5.500 4.128 3.584 4.667     .  0 0 "[    .    1    .    2    .    3]" 1 
        959 2 11 LYS HB2  2 12 GLU H    2.800 . 3.800 3.558 2.084 4.148 0.348 21 0 "[    .    1    .    2    .    3]" 1 
        960 2 11 LYS HA   2 12 GLU H    2.100 . 5.500 2.287 2.141 2.645     .  0 0 "[    .    1    .    2    .    3]" 1 
        961 2 12 GLU H    2 13 PHE H    3.600 . 5.200 4.627 4.570 4.647     .  0 0 "[    .    1    .    2    .    3]" 1 
        962 2 13 PHE H    2 14 VAL H    3.700 . 5.400 4.061 3.636 4.409     .  0 0 "[    .    1    .    2    .    3]" 1 
        963 2 12 GLU HB3  2 13 PHE H    2.700 . 3.600 2.708 2.050 3.254     .  0 0 "[    .    1    .    2    .    3]" 1 
        964 2 12 GLU QG   2 13 PHE H    3.200 . 4.500 2.942 1.883 4.112 0.017 30 0 "[    .    1    .    2    .    3]" 1 
        965 1 45 GLY QA   2 13 PHE H    3.700 . 5.400 2.472 1.961 2.959 0.039 29 0 "[    .    1    .    2    .    3]" 1 
        966 2 12 GLU HA   2 13 PHE H    2.400 . 3.100 2.440 2.360 2.544     .  0 0 "[    .    1    .    2    .    3]" 1 
        967 1 42 LYS HA   2 13 PHE H    3.400 . 5.500 4.932 4.462 5.165     .  0 0 "[    .    1    .    2    .    3]" 1 
        968 2 13 PHE QD   2 14 VAL H    3.100 . 4.300 2.766 1.899 3.392 0.001 18 0 "[    .    1    .    2    .    3]" 1 
        969 1 48 LEU HB3  2 14 VAL H    3.600 . 5.200 5.189 4.741 5.421 0.221 24 0 "[    .    1    .    2    .    3]" 1 
        970 2 13 PHE HB2  2 14 VAL H    3.200 . 4.500 4.582 4.425 4.662 0.162 13 0 "[    .    1    .    2    .    3]" 1 
        971 2 13 PHE HB3  2 14 VAL H    3.400 . 4.800 4.326 4.187 4.425     .  0 0 "[    .    1    .    2    .    3]" 1 
        972 2 13 PHE HA   2 14 VAL H    2.300 . 3.000 2.249 2.128 2.488     .  0 0 "[    .    1    .    2    .    3]" 1 
        973 2 13 PHE QE   2 16 GLY H    3.500 . 5.000 4.062 3.070 5.081 0.081  2 0 "[    .    1    .    2    .    3]" 1 
        974 2 16 GLY H    2 17 VAL H    2.900 . 4.000 3.079 2.736 3.478     .  0 0 "[    .    1    .    2    .    3]" 1 
        975 2 16 GLY H    2 17 VAL QG   3.200 . 4.500 4.239 3.794 4.571 0.071 18 0 "[    .    1    .    2    .    3]" 1 
        976 2 16 GLY HA2  2 17 VAL H    3.000 . 4.100 3.490 3.350 3.569     .  0 0 "[    .    1    .    2    .    3]" 1 
        977 2 17 VAL H    2 18 LYS H    3.700 . 5.400 4.449 4.281 4.506     .  0 0 "[    .    1    .    2    .    3]" 1 
        978 2 18 LYS H    2 19 TYR H    3.400 . 4.800 4.203 4.103 4.437     .  0 0 "[    .    1    .    2    .    3]" 1 
        979 2 17 VAL HB   2 18 LYS H    3.300 . 4.700 2.488 1.859 3.739 0.041 20 0 "[    .    1    .    2    .    3]" 1 
        980 2 17 VAL HA   2 18 LYS H    2.100 . 5.500 2.546 2.208 2.850     .  0 0 "[    .    1    .    2    .    3]" 1 
        981 2 19 TYR H    2 20 GLY H    3.600 . 5.200 4.416 4.203 4.548     .  0 0 "[    .    1    .    2    .    3]" 1 
        982 2 17 VAL MG2  2 19 TYR H    4.100 . 5.500 4.498 3.593 6.039 0.539 18 1 "[    .    1    .  + 2    .    3]" 1 
        983 2 18 LYS QB   2 19 TYR H    3.200 . 4.500 3.693 3.425 3.805     .  0 0 "[    .    1    .    2    .    3]" 1 
        984 2 18 LYS HA   2 19 TYR H    2.100 . 5.500 2.216 2.149 2.255     .  0 0 "[    .    1    .    2    .    3]" 1 
        985 2 18 LYS QB   2 20 GLY H    4.100 . 5.500 4.893 4.327 5.309     .  0 0 "[    .    1    .    2    .    3]" 1 
        986 2 19 TYR HB2  2 20 GLY H    3.500 . 5.000 4.516 4.387 4.633     .  0 0 "[    .    1    .    2    .    3]" 1 
        987 2 19 TYR HB3  2 20 GLY H    3.500 . 5.000 4.049 3.656 4.324     .  0 0 "[    .    1    .    2    .    3]" 1 
        988 2 19 TYR HA   2 20 GLY H    2.600 . 3.400 2.155 2.137 2.197     .  0 0 "[    .    1    .    2    .    3]" 1 
        989 2 20 GLY HA2  2 21 ASN H    3.100 . 4.300 2.708 2.191 3.567     .  0 0 "[    .    1    .    2    .    3]" 1 
        990 2 20 GLY HA3  2 21 ASN H    3.200 . 4.500 3.490 2.633 3.570     .  0 0 "[    .    1    .    2    .    3]" 1 
        991 2 21 ASN H    2 22 ILE H    3.500 . 5.000 3.103 2.103 4.569     .  0 0 "[    .    1    .    2    .    3]" 1 
        992 2 21 ASN HB2  2 22 ILE H    4.100 . 5.500 3.852 2.052 4.666     .  0 0 "[    .    1    .    2    .    3]" 1 
        993 2 21 ASN HB3  2 22 ILE H    3.800 . 5.500 3.638 2.075 4.537     .  0 0 "[    .    1    .    2    .    3]" 1 
        994 2 21 ASN HA   2 22 ILE H    2.600 . 3.400 2.959 2.138 3.535 0.135 22 0 "[    .    1    .    2    .    3]" 1 
        995 1  8 THR HA   1  8 THR MG   2.100 . 5.500 3.216 3.201 3.230     .  0 0 "[    .    1    .    2    .    3]" 1 
        996 1  8 THR MG   1 33 GLN HB2  2.800 . 3.800 2.436 2.116 2.666     .  0 0 "[    .    1    .    2    .    3]" 1 
        997 1  8 THR MG   1 23 MET HB3  2.800 . 5.500 5.435 5.280 5.530 0.030 24 0 "[    .    1    .    2    .    3]" 1 
        998 1  8 THR MG   1 33 GLN QG   2.700 . 3.600 2.886 2.465 3.267     .  0 0 "[    .    1    .    2    .    3]" 1 
        999 1  8 THR MG   1 23 MET HB2  3.300 . 4.700 4.669 4.503 4.727 0.027  3 0 "[    .    1    .    2    .    3]" 1 
       1000 1  8 THR MG   1 11 MET HG3  3.200 . 4.500 4.480 4.433 4.512 0.012 27 0 "[    .    1    .    2    .    3]" 1 
       1001 1  8 THR HB   1  8 THR MG   1.800 . 2.200 2.078 2.069 2.116     .  0 0 "[    .    1    .    2    .    3]" 1 
       1002 1  8 THR MG   1  9 ALA HA   3.700 . 5.400 3.410 3.178 3.722     .  0 0 "[    .    1    .    2    .    3]" 1 
       1003 1  8 THR MG   1 24 LEU HA   3.300 . 4.700 3.719 3.410 4.035     .  0 0 "[    .    1    .    2    .    3]" 1 
       1004 1  9 ALA HA   1 12 LEU QD   2.200 . 2.800 2.231 1.914 2.387     .  0 0 "[    .    1    .    2    .    3]" 1 
       1005 1  9 ALA HA   1  9 ALA MB   1.800 . 2.200 2.109 2.090 2.129     .  0 0 "[    .    1    .    2    .    3]" 1 
       1006 1  9 ALA HA   1 12 LEU HB2  2.400 . 3.100 2.797 2.492 3.130 0.030 24 0 "[    .    1    .    2    .    3]" 1 
       1007 1  9 ALA MB   1 12 LEU QD   2.500 . 3.300 3.169 3.002 3.255     .  0 0 "[    .    1    .    2    .    3]" 1 
       1008 1  9 ALA MB   1 10 SER HA   2.900 . 4.000 3.825 3.761 3.899     .  0 0 "[    .    1    .    2    .    3]" 1 
       1009 1  8 THR HA   1  9 ALA MB   3.500 . 5.000 4.986 4.955 5.007 0.007  6 0 "[    .    1    .    2    .    3]" 1 
       1010 1 10 SER HA   1 13 ALA MB   2.300 . 3.000 3.030 3.004 3.056 0.056 12 0 "[    .    1    .    2    .    3]" 1 
       1011 1 10 SER HA   1 10 SER QB   2.000 . 2.500 2.429 2.287 2.524 0.024 27 0 "[    .    1    .    2    .    3]" 1 
       1012 1  9 ALA MB   1 10 SER QB   2.800 . 3.800 3.806 3.754 3.834 0.034 20 0 "[    .    1    .    2    .    3]" 1 
       1013 1  7 LEU HA   1 10 SER QB   3.500 . 5.000 4.117 3.339 4.881     .  0 0 "[    .    1    .    2    .    3]" 1 
       1014 1 10 SER QB   1 11 MET HA   3.200 . 4.500 4.049 3.862 4.374     .  0 0 "[    .    1    .    2    .    3]" 1 
       1015 1 11 MET HB2  1 12 LEU QD   3.100 . 3.300 3.269 3.085 3.315 0.015 17 0 "[    .    1    .    2    .    3]" 1 
       1016 1 11 MET HB2  1 23 MET HG3  2.800 . 5.500 4.423 3.949 4.886     .  0 0 "[    .    1    .    2    .    3]" 1 
       1017 1 11 MET HB2  1 23 MET HA   2.600 . 5.500 4.232 4.018 4.434     .  0 0 "[    .    1    .    2    .    3]" 1 
       1018 1 11 MET HA   1 11 MET HB2  2.600 . 3.400 3.023 3.017 3.029     .  0 0 "[    .    1    .    2    .    3]" 1 
       1019 1 11 MET HB2  1 11 MET HG3  2.200 . 2.800 2.244 2.232 2.256     .  0 0 "[    .    1    .    2    .    3]" 1 
       1020 1 11 MET ME   1 11 MET HG3  2.100 . 2.700 2.286 2.124 2.472     .  0 0 "[    .    1    .    2    .    3]" 1 
       1021 1 11 MET HB2  1 23 MET HB3  2.000 . 2.500 2.297 2.026 2.513 0.013  9 0 "[    .    1    .    2    .    3]" 1 
       1022 1 11 MET HA   1 11 MET HG2  2.300 . 3.000 2.505 2.439 2.551     .  0 0 "[    .    1    .    2    .    3]" 1 
       1023 1 55 LEU HB3  1 55 LEU QD   4.200 . 5.500 2.041 1.990 2.162 0.010 13 0 "[    .    1    .    2    .    3]" 1 
       1024 1  8 THR MG   1 11 MET ME   2.900 . 4.000 4.057 4.016 4.087 0.087 25 0 "[    .    1    .    2    .    3]" 1 
       1025 1 11 MET ME   1 22 GLN QG   2.500 . 3.300 3.254 3.185 3.318 0.018 25 0 "[    .    1    .    2    .    3]" 1 
       1026 1 11 MET ME   1 24 LEU HA   3.700 . 5.400 4.722 4.538 4.900     .  0 0 "[    .    1    .    2    .    3]" 1 
       1027 1 11 MET ME   1 23 MET HA   3.800 . 5.500 1.743 1.576 1.990     .  0 0 "[    .    1    .    2    .    3]" 1 
       1028 1 11 MET HA   1 11 MET ME   3.300 . 4.700 4.561 4.324 4.729 0.029 17 0 "[    .    1    .    2    .    3]" 1 
       1029 1  8 THR HB   1 11 MET ME   2.500 . 3.300 3.015 2.789 3.290     .  0 0 "[    .    1    .    2    .    3]" 1 
       1030 1 12 LEU HA   1 12 LEU QB   2.000 . 2.500 2.469 2.357 2.535 0.035  4 0 "[    .    1    .    2    .    3]" 1 
       1031 1 12 LEU HA   1 12 LEU QD       . . 2.200 2.027 1.791 2.186     .  0 0 "[    .    1    .    2    .    3]" 1 
       1032 1 12 LEU HA   1 15 ALA MB   2.400 . 3.100 2.713 2.441 2.998     .  0 0 "[    .    1    .    2    .    3]" 1 
       1033 1 12 LEU HA   1 23 MET ME   3.000 . 5.500 2.062 1.566 3.410     .  0 0 "[    .    1    .    2    .    3]" 1 
       1034 1 12 LEU MD1  1 12 LEU MD2  1.800 . 2.200 2.025 1.910 2.088     .  0 0 "[    .    1    .    2    .    3]" 1 
       1035 1  8 THR MG   1 12 LEU QD   4.200 . 5.500 3.334 3.049 3.624     .  0 0 "[    .    1    .    2    .    3]" 1 
       1036 1 12 LEU QD   1 15 ALA MB   2.300 . 5.500 3.570 3.329 3.784     .  0 0 "[    .    1    .    2    .    3]" 1 
       1037 1 11 MET HB3  1 12 LEU QD   3.400 . 4.800 4.288 4.135 4.421     .  0 0 "[    .    1    .    2    .    3]" 1 
       1038 1 12 LEU QD   1 27 ARG HA   3.200 . 4.500 4.222 4.112 4.315     .  0 0 "[    .    1    .    2    .    3]" 1 
       1039 1 13 ALA MB   1 14 SER HA   3.100 . 4.300 3.922 3.870 3.981     .  0 0 "[    .    1    .    2    .    3]" 1 
       1040 1 14 SER HA   1 15 ALA MB   3.800 . 5.500 4.636 4.472 4.693     .  0 0 "[    .    1    .    2    .    3]" 1 
       1041 1 11 MET HA   1 14 SER HB2  2.600 . 3.400 3.084 2.096 4.384 0.984 14 7 "[*  -.   *1   +.    *    .  **3]" 1 
       1042 1 14 SER QB   1 15 ALA MB   3.800 . 5.500 4.091 3.721 4.593     .  0 0 "[    .    1    .    2    .    3]" 1 
       1043 1 13 ALA MB   1 14 SER HB2  3.400 . 4.800 4.340 3.709 4.961 0.161  4 0 "[    .    1    .    2    .    3]" 1 
       1044 1 15 ALA HA   1 19 GLU QG   3.300 . 4.700 2.964 2.631 3.369     .  0 0 "[    .    1    .    2    .    3]" 1 
       1045 1 15 ALA HA   1 19 GLU HB3  3.000 . 4.100 3.670 3.128 4.115 0.015 24 0 "[    .    1    .    2    .    3]" 1 
       1046 1 11 MET HB3  1 15 ALA HA   2.800 . 5.500 5.566 5.364 5.640 0.140 17 0 "[    .    1    .    2    .    3]" 1 
       1047 1 15 ALA HA   1 23 MET ME   3.100 . 4.300 4.186 3.989 4.312 0.012  5 0 "[    .    1    .    2    .    3]" 1 
       1048 1 15 ALA HA   1 15 ALA MB   2.000 . 2.500 2.099 2.070 2.120     .  0 0 "[    .    1    .    2    .    3]" 1 
       1049 1 14 SER HB3  1 15 ALA HA   1.900 . 5.500 4.958 4.427 5.859 0.359 20 0 "[    .    1    .    2    .    3]" 1 
       1050 1 15 ALA MB   1 23 MET ME   2.100 . 2.700 1.814 1.650 2.047     .  0 0 "[    .    1    .    2    .    3]" 1 
       1051 1 15 ALA MB   1 19 GLU HB2  2.200 . 2.800 2.532 1.737 3.275 0.475 26 0 "[    .    1    .    2    .    3]" 1 
       1052 1 11 MET HB3  1 15 ALA MB   2.800 . 3.800 3.287 2.951 3.768     .  0 0 "[    .    1    .    2    .    3]" 1 
       1053 1 11 MET ME   1 15 ALA MB   2.600 . 5.500 4.666 4.290 5.059     .  0 0 "[    .    1    .    2    .    3]" 1 
       1054 1 15 ALA MB   1 19 GLU HB3  2.100 . 5.500 1.830 1.522 2.299     .  0 0 "[    .    1    .    2    .    3]" 1 
       1055 1 15 ALA MB   1 19 GLU QG   2.200 . 2.800 2.268 1.847 2.730     .  0 0 "[    .    1    .    2    .    3]" 1 
       1056 1 15 ALA MB   1 22 GLN QG   2.200 . 5.500 4.159 3.523 4.898     .  0 0 "[    .    1    .    2    .    3]" 1 
       1057 1 15 ALA MB   1 23 MET HG2  2.200 . 2.800 2.055 1.888 2.270     .  0 0 "[    .    1    .    2    .    3]" 1 
       1058 1 15 ALA MB   1 23 MET HG3  3.200 . 4.500 2.706 2.191 3.054     .  0 0 "[    .    1    .    2    .    3]" 1 
       1059 1 18 GLN HA   1 18 GLN HG3  2.500 . 3.300 2.931 2.128 3.612 0.312 16 0 "[    .    1    .    2    .    3]" 1 
       1060 1 18 GLN HA   1 18 GLN HG2  2.700 . 3.600 2.657 2.113 3.712 0.112 22 0 "[    .    1    .    2    .    3]" 1 
       1061 1 15 ALA MB   1 19 GLU HA   3.400 . 4.800 4.273 4.177 4.436     .  0 0 "[    .    1    .    2    .    3]" 1 
       1062 1 19 GLU QG   1 23 MET ME   1.900 . 5.500 3.938 3.278 4.504     .  0 0 "[    .    1    .    2    .    3]" 1 
       1063 1 19 GLU QG   1 23 MET HG2  2.700 . 5.500 4.030 3.091 4.733     .  0 0 "[    .    1    .    2    .    3]" 1 
       1064 1 19 GLU QG   1 23 MET HG3  2.900 . 4.000 3.400 2.604 4.092 0.092 18 0 "[    .    1    .    2    .    3]" 1 
       1065 1 19 GLU HA   1 19 GLU QG   2.200 . 2.800 2.488 2.154 2.784     .  0 0 "[    .    1    .    2    .    3]" 1 
       1066 1 20 GLN HA   1 20 GLN HG3  2.100 . 5.500 3.561 3.328 4.133     .  0 0 "[    .    1    .    2    .    3]" 1 
       1067 1 20 GLN HA   1 55 LEU QD   2.200 . 5.500 4.989 4.730 5.180     .  0 0 "[    .    1    .    2    .    3]" 1 
       1068 1 20 GLN HA   1 24 LEU HG   3.200 . 4.500 4.093 3.162 4.600 0.100 17 0 "[    .    1    .    2    .    3]" 1 
       1069 1 20 GLN HA   1 21 LYS HB3  3.000 . 5.500 4.867 4.670 5.538 0.038 26 0 "[    .    1    .    2    .    3]" 1 
       1070 1 20 GLN HA   1 23 MET ME   2.400 . 3.100 2.763 1.760 3.119 0.019 29 0 "[    .    1    .    2    .    3]" 1 
       1071 1 20 GLN HA   1 20 GLN QB   2.300 . 3.000 2.158 2.145 2.175     .  0 0 "[    .    1    .    2    .    3]" 1 
       1072 1 20 GLN HA   1 23 MET HG3  3.300 . 4.700 4.419 3.507 4.718 0.018 11 0 "[    .    1    .    2    .    3]" 1 
       1073 1 20 GLN QB   1 20 GLN HG2  2.200 . 2.800 2.193 2.123 2.487     .  0 0 "[    .    1    .    2    .    3]" 1 
       1074 1 21 LYS HA   1 48 LEU QD   2.700 . 3.600 3.539 3.313 3.615 0.015 27 0 "[    .    1    .    2    .    3]" 1 
       1075 1 21 LYS HA   1 21 LYS QE   3.800 . 5.500 4.524 3.841 4.991     .  0 0 "[    .    1    .    2    .    3]" 1 
       1076 1 21 LYS HB2  1 21 LYS HD3  2.900 . 4.000 2.928 2.346 4.095 0.095 26 0 "[    .    1    .    2    .    3]" 1 
       1077 1 21 LYS HB2  1 21 LYS HD2  2.900 . 4.000 3.072 1.980 3.869     .  0 0 "[    .    1    .    2    .    3]" 1 
       1078 1 21 LYS HD3  1 21 LYS QE   3.000 . 4.100 2.318 2.137 2.528     .  0 0 "[    .    1    .    2    .    3]" 1 
       1079 1 21 LYS HD2  1 21 LYS QE   3.000 . 4.100 2.354 2.139 2.529     .  0 0 "[    .    1    .    2    .    3]" 1 
       1080 1 21 LYS HA   1 21 LYS HD3  3.000 . 5.500 4.417 3.554 5.471     .  0 0 "[    .    1    .    2    .    3]" 1 
       1081 1 21 LYS HA   1 21 LYS HD2  3.300 . 5.500 4.590 3.705 4.974     .  0 0 "[    .    1    .    2    .    3]" 1 
       1082 1 22 GLN HA   1 22 GLN QG   2.200 . 2.800 2.686 2.482 2.787     .  0 0 "[    .    1    .    2    .    3]" 1 
       1083 1 22 GLN HA   1 22 GLN HB2  2.400 . 3.100 2.403 2.367 2.461     .  0 0 "[    .    1    .    2    .    3]" 1 
       1084 1 22 GLN HA   1 25 GLY HA2  2.700 . 5.500 5.115 4.933 5.264     .  0 0 "[    .    1    .    2    .    3]" 1 
       1085 1 21 LYS QE   1 22 GLN HA   2.800 . 5.500 3.592 2.815 4.916     .  0 0 "[    .    1    .    2    .    3]" 1 
       1086 1 23 MET HA   1 24 LEU QD   3.500 . 5.000 4.744 4.577 4.877     .  0 0 "[    .    1    .    2    .    3]" 1 
       1087 1 23 MET HA   1 23 MET HG3  2.400 . 5.500 3.370 3.320 3.446     .  0 0 "[    .    1    .    2    .    3]" 1 
       1088 1 23 MET HA   1 23 MET HB2  2.200 . 2.800 2.753 2.696 2.778     .  0 0 "[    .    1    .    2    .    3]" 1 
       1089 1 23 MET HA   1 23 MET HB3  2.000 . 2.500 2.236 2.226 2.263     .  0 0 "[    .    1    .    2    .    3]" 1 
       1090 1 12 LEU QD   1 23 MET HB2  2.700 . 3.600 2.525 2.071 2.928     .  0 0 "[    .    1    .    2    .    3]" 1 
       1091 1 12 LEU QD   1 23 MET HB3  2.900 . 4.000 3.674 3.337 4.008 0.008  4 0 "[    .    1    .    2    .    3]" 1 
       1092 1 23 MET HG3  1 24 LEU QD   3.700 . 5.400 4.083 3.215 4.467     .  0 0 "[    .    1    .    2    .    3]" 1 
       1093 1 12 LEU QD   1 23 MET HG3  3.100 . 4.300 4.142 3.868 4.298     .  0 0 "[    .    1    .    2    .    3]" 1 
       1094 1 23 MET HB3  1 23 MET HG3  2.200 . 2.800 2.582 2.463 2.844 0.044 12 0 "[    .    1    .    2    .    3]" 1 
       1095 1 23 MET HB2  1 23 MET HG3  2.300 . 3.000 2.980 2.819 3.011 0.011 18 0 "[    .    1    .    2    .    3]" 1 
       1096 1 23 MET HG2  1 24 LEU QD   3.700 . 5.400 4.270 4.068 4.573     .  0 0 "[    .    1    .    2    .    3]" 1 
       1097 1 12 LEU QD   1 23 MET HG2  2.900 . 4.000 3.153 2.569 3.976     .  0 0 "[    .    1    .    2    .    3]" 1 
       1098 1 23 MET HB2  1 23 MET HG2  2.300 . 3.000 2.572 2.457 2.843     .  0 0 "[    .    1    .    2    .    3]" 1 
       1099 1 23 MET HB3  1 23 MET HG2  2.100 . 2.700 1.990 1.892 2.138     .  0 0 "[    .    1    .    2    .    3]" 1 
       1100 1 23 MET HA   1 23 MET HG2  2.200 . 5.500 4.068 3.829 4.148     .  0 0 "[    .    1    .    2    .    3]" 1 
       1101 1 23 MET ME   1 24 LEU QD   2.800 . 3.400 2.343 1.825 2.698     .  0 0 "[    .    1    .    2    .    3]" 1 
       1102 1 12 LEU QD   1 23 MET ME   2.400 . 3.100 2.153 1.710 3.093     .  0 0 "[    .    1    .    2    .    3]" 1 
       1103 1 23 MET HA   1 23 MET ME   2.700 . 5.500 5.188 4.985 5.294     .  0 0 "[    .    1    .    2    .    3]" 1 
       1104 1 24 LEU HA   1 24 LEU HB2  2.400 . 3.100 2.386 2.257 2.569     .  0 0 "[    .    1    .    2    .    3]" 1 
       1105 1 23 MET HB3  1 24 LEU HA   3.100 . 5.500 4.674 4.525 4.830     .  0 0 "[    .    1    .    2    .    3]" 1 
       1106 1 24 LEU HA   1 24 LEU QD   2.100 . 4.000 3.259 3.190 3.324     .  0 0 "[    .    1    .    2    .    3]" 1 
       1107 1 12 LEU QD   1 24 LEU HA   2.500 . 5.500 3.519 3.349 3.773     .  0 0 "[    .    1    .    2    .    3]" 1 
       1108 1 24 LEU HA   1 24 LEU HB3  2.400 . 3.100 2.508 2.309 2.664     .  0 0 "[    .    1    .    2    .    3]" 1 
       1109 1 24 LEU HB3  1 24 LEU HG   2.600 . 3.400 2.780 2.423 3.018     .  0 0 "[    .    1    .    2    .    3]" 1 
       1110 1 24 LEU HB3  1 24 LEU QD   2.200 . 2.800 2.173 2.050 2.333     .  0 0 "[    .    1    .    2    .    3]" 1 
       1111 1 24 LEU HA   1 24 LEU HG   2.800 . 3.800 3.699 3.627 3.744     .  0 0 "[    .    1    .    2    .    3]" 1 
       1112 1 24 LEU QD   1 48 LEU QD   2.800 . 5.500 4.225 4.037 4.463     .  0 0 "[    .    1    .    2    .    3]" 1 
       1113 1 24 LEU QD   1 55 LEU QD   1.900 . 5.500 2.780 2.512 2.956     .  0 0 "[    .    1    .    2    .    3]" 1 
       1114 1 24 LEU QD   1 55 LEU HB2  2.600 . 5.500 4.507 4.380 4.675     .  0 0 "[    .    1    .    2    .    3]" 1 
       1115 1 24 LEU QD   1 28 LEU HB2  3.900 . 5.500 5.158 4.961 5.281     .  0 0 "[    .    1    .    2    .    3]" 1 
       1116 1 15 ALA MB   1 24 LEU QD   3.100 . 5.500 4.332 3.942 4.522     .  0 0 "[    .    1    .    2    .    3]" 1 
       1117 1 24 LEU QD   1 24 LEU HG   1.900 . 2.400 1.873 1.856 1.885     .  0 0 "[    .    1    .    2    .    3]" 1 
       1118 1 24 LEU HB2  1 24 LEU QD   2.200 . 3.000 2.247 2.054 2.397     .  0 0 "[    .    1    .    2    .    3]" 1 
       1119 1 20 GLN QB   1 24 LEU QD   2.600 . 3.400 2.377 1.973 2.688 0.027 12 0 "[    .    1    .    2    .    3]" 1 
       1120 1 20 GLN QG   1 24 LEU QD   3.500 . 5.000 3.798 2.739 4.168     .  0 0 "[    .    1    .    2    .    3]" 1 
       1121 1 24 LEU QD   1 25 GLY HA3  2.800 . 3.800 3.721 3.654 3.777     .  0 0 "[    .    1    .    2    .    3]" 1 
       1122 1 20 GLN HA   1 24 LEU QD   3.000 . 4.100 1.893 1.826 2.046 0.074 18 0 "[    .    1    .    2    .    3]" 1 
       1123 1 21 LYS HA   1 24 LEU QD   2.900 . 4.000 3.999 3.837 4.054 0.054  9 0 "[    .    1    .    2    .    3]" 1 
       1124 1 24 LEU QD   1 26 GLU HA   2.500 . 3.300 3.303 3.241 3.343 0.043  4 0 "[    .    1    .    2    .    3]" 1 
       1125 1 23 MET HB2  1 24 LEU QD   3.300 . 4.700 3.693 3.567 3.920     .  0 0 "[    .    1    .    2    .    3]" 1 
       1126 1 24 LEU QD   1 59 LEU QB   3.100 . 5.500 4.867 4.468 5.115     .  0 0 "[    .    1    .    2    .    3]" 1 
       1127 1 12 LEU QD   1 24 LEU QD   2.100 . 2.700 2.003 1.803 2.310     .  0 0 "[    .    1    .    2    .    3]" 1 
       1128 1 25 GLY HA3  1 48 LEU QD   2.500 . 3.300 1.917 1.691 2.223 0.009 24 0 "[    .    1    .    2    .    3]" 1 
       1129 1 25 GLY HA3  1 28 LEU QD   3.400 . 4.800 3.880 3.406 4.147     .  0 0 "[    .    1    .    2    .    3]" 1 
       1130 1 25 GLY HA3  1 44 THR MG   2.400 . 5.500 4.969 3.358 5.525 0.025 24 0 "[    .    1    .    2    .    3]" 1 
       1131 1 25 GLY HA3  1 28 LEU HB2  3.200 . 4.500 3.579 3.449 3.671     .  0 0 "[    .    1    .    2    .    3]" 1 
       1132 1 25 GLY HA2  1 48 LEU QD   2.400 . 3.100 2.476 2.261 2.696     .  0 0 "[    .    1    .    2    .    3]" 1 
       1133 1 25 GLY HA2  1 28 LEU QD   4.200 . 5.500 5.167 4.724 5.399     .  0 0 "[    .    1    .    2    .    3]" 1 
       1134 1 25 GLY HA2  1 28 LEU HB2  3.700 . 5.400 5.341 5.212 5.435 0.035 16 0 "[    .    1    .    2    .    3]" 1 
       1135 1 26 GLU HA   1 50 ILE MG   3.000 . 5.500 4.478 4.331 4.849     .  0 0 "[    .    1    .    2    .    3]" 1 
       1136 1 26 GLU HA   1 55 LEU HB2  3.300 . 4.700 3.857 3.663 4.251     .  0 0 "[    .    1    .    2    .    3]" 1 
       1137 1 26 GLU HA   1 27 ARG HB3  2.800 . 5.500 5.513 5.263 5.916 0.416  8 0 "[    .    1    .    2    .    3]" 1 
       1138 1 26 GLU HA   1 26 GLU QG   2.700 . 3.300 2.385 2.197 2.616     .  0 0 "[    .    1    .    2    .    3]" 1 
       1139 1 26 GLU HB3  1 50 ILE MD   2.600 . 5.500 4.932 4.588 5.298     .  0 0 "[    .    1    .    2    .    3]" 1 
       1140 1 26 GLU HB2  1 50 ILE MD   2.600 . 5.500 4.872 4.517 5.162     .  0 0 "[    .    1    .    2    .    3]" 1 
       1141 1 26 GLU HB3  1 50 ILE MG   2.400 . 3.100 2.703 2.517 2.897     .  0 0 "[    .    1    .    2    .    3]" 1 
       1142 1 26 GLU HB3  1 55 LEU HG   3.200 . 4.500 4.438 4.237 4.530 0.030 19 0 "[    .    1    .    2    .    3]" 1 
       1143 1 26 GLU HB3  1 26 GLU QG   2.300 . 3.000 2.170 2.152 2.371     .  0 0 "[    .    1    .    2    .    3]" 1 
       1144 1 26 GLU HB2  1 26 GLU QG   2.300 . 3.000 2.343 2.245 2.428     .  0 0 "[    .    1    .    2    .    3]" 1 
       1145 1 26 GLU HB3  1 58 MET QG   3.700 . 5.400 5.350 5.051 5.468 0.068 24 0 "[    .    1    .    2    .    3]" 1 
       1146 1 26 GLU HB2  1 28 LEU HA   3.000 . 5.500 5.365 5.120 5.494     .  0 0 "[    .    1    .    2    .    3]" 1 
       1147 1 26 GLU QG   1 52 ASN HB2  2.700 . 5.500 4.109 3.400 4.370     .  0 0 "[    .    1    .    2    .    3]" 1 
       1148 1 24 LEU HA   1 27 ARG HA   2.600 . 5.500 4.485 4.353 4.670     .  0 0 "[    .    1    .    2    .    3]" 1 
       1149 1 27 ARG HA   1 27 ARG HB2  2.300 . 3.000 2.474 2.280 2.539     .  0 0 "[    .    1    .    2    .    3]" 1 
       1150 1 27 ARG HA   1 27 ARG HB3  2.700 . 3.600 3.024 2.934 3.036     .  0 0 "[    .    1    .    2    .    3]" 1 
       1151 1 26 GLU HB3  1 27 ARG HA   3.300 . 4.700 4.554 4.490 4.793 0.093 29 0 "[    .    1    .    2    .    3]" 1 
       1152 1 24 LEU QD   1 27 ARG HA   3.200 . 4.500 2.267 1.924 2.531     .  0 0 "[    .    1    .    2    .    3]" 1 
       1153 1 27 ARG HA   1 59 LEU QD   3.300 . 4.700 4.444 4.066 4.700 0.000 16 0 "[    .    1    .    2    .    3]" 1 
       1154 1 27 ARG HB3  1 27 ARG QD   3.000 . 3.600 3.238 2.359 3.306     .  0 0 "[    .    1    .    2    .    3]" 1 
       1155 1 27 ARG HB3  1 55 LEU QD   3.500 . 3.600 2.889 2.488 3.105     .  0 0 "[    .    1    .    2    .    3]" 1 
       1156 1 24 LEU QD   1 27 ARG HB2  3.600 . 5.200 3.325 2.959 3.754     .  0 0 "[    .    1    .    2    .    3]" 1 
       1157 1 27 ARG HB2  1 31 LEU QD   2.900 . 4.000 3.820 3.652 3.953     .  0 0 "[    .    1    .    2    .    3]" 1 
       1158 1 24 LEU QD   1 27 ARG QG   2.900 . 4.000 3.505 2.537 3.868     .  0 0 "[    .    1    .    2    .    3]" 1 
       1159 1 27 ARG QG   1 59 LEU QD   2.800 . 5.500 2.072 1.433 2.845     .  0 0 "[    .    1    .    2    .    3]" 1 
       1160 1 27 ARG QG   1 31 LEU QD   2.600 . 3.400 1.784 1.388 3.297 0.412 22 0 "[    .    1    .    2    .    3]" 1 
       1161 1 24 LEU HA   1 27 ARG QD   3.700 . 5.400 4.946 4.537 5.130     .  0 0 "[    .    1    .    2    .    3]" 1 
       1162 1 27 ARG HA   1 27 ARG QD   2.400 . 3.100 1.995 1.687 2.206 0.013  8 0 "[    .    1    .    2    .    3]" 1 
       1163 1 27 ARG QD   1 59 LEU QB   3.400 . 4.700 3.616 3.126 4.066     .  0 0 "[    .    1    .    2    .    3]" 1 
       1164 1 27 ARG QD   1 27 ARG QG   2.200 . 2.800 2.071 2.040 2.090     .  0 0 "[    .    1    .    2    .    3]" 1 
       1165 1 27 ARG QD   1 55 LEU QD   2.900 . 4.000 2.936 2.363 3.620     .  0 0 "[    .    1    .    2    .    3]" 1 
       1166 1 27 ARG QD   1 59 LEU QD   2.500 . 3.300 2.549 2.166 2.904     .  0 0 "[    .    1    .    2    .    3]" 1 
       1167 1 28 LEU HB3  1 28 LEU QD   2.400 . 2.500 2.167 1.963 2.337     .  0 0 "[    .    1    .    2    .    3]" 1 
       1168 1 28 LEU HB3  1 44 THR MG   2.900 . 4.000 3.703 2.090 3.881     .  0 0 "[    .    1    .    2    .    3]" 1 
       1169 1 28 LEU HB3  1 31 LEU QD   2.700 . 5.500 3.831 3.551 3.989     .  0 0 "[    .    1    .    2    .    3]" 1 
       1170 1 25 GLY HA3  1 28 LEU HB3  3.500 . 5.000 5.100 5.040 5.178 0.178 30 0 "[    .    1    .    2    .    3]" 1 
       1171 1 28 LEU HA   1 28 LEU HB3  2.600 . 3.400 2.689 2.609 2.722     .  0 0 "[    .    1    .    2    .    3]" 1 
       1172 1 28 LEU QD   1 48 LEU QD   3.200 . 3.800 2.379 1.938 2.956 0.062 15 0 "[    .    1    .    2    .    3]" 1 
       1173 1 28 LEU QD   1 32 ILE MD   2.000 . 2.500 1.881 1.553 2.200     .  0 0 "[    .    1    .    2    .    3]" 1 
       1174 1 28 LEU QD   1 43 ILE MG   2.400 . 3.100 3.042 2.634 3.167 0.067 28 0 "[    .    1    .    2    .    3]" 1 
       1175 1 28 LEU QD   1 69 VAL QG   2.700 . 3.600 2.795 2.607 3.008     .  0 0 "[    .    1    .    2    .    3]" 1 
       1176 1 28 LEU QD   1 47 LEU HB2  2.300 . 3.000 1.920 1.619 2.368     .  0 0 "[    .    1    .    2    .    3]" 1 
       1177 1 28 LEU QD   1 47 LEU HB3  2.500 . 3.300 2.395 2.080 3.020     .  0 0 "[    .    1    .    2    .    3]" 1 
       1178 1 26 GLU HB2  1 28 LEU QD   3.100 . 5.500 2.283 2.047 2.479     .  0 0 "[    .    1    .    2    .    3]" 1 
       1179 1 28 LEU HA   1 28 LEU QD   2.700 . 3.600 2.413 1.855 2.915     .  0 0 "[    .    1    .    2    .    3]" 1 
       1180 1 29 PHE HA   1 32 ILE MD   2.600 . 3.400 3.137 2.803 3.420 0.020 29 0 "[    .    1    .    2    .    3]" 1 
       1181 1 29 PHE HA   1 44 THR MG   2.700 . 3.600 3.354 3.085 3.628 0.028 26 0 "[    .    1    .    2    .    3]" 1 
       1182 1 29 PHE HA   1 40 ALA MB   2.700 . 3.600 3.255 2.913 3.706 0.106 23 0 "[    .    1    .    2    .    3]" 1 
       1183 1 29 PHE HA   1 32 ILE HB   2.700 . 3.600 3.442 3.258 3.622 0.022 29 0 "[    .    1    .    2    .    3]" 1 
       1184 1 29 PHE HA   1 33 GLN QB   3.400 . 4.800 4.235 4.109 4.357     .  0 0 "[    .    1    .    2    .    3]" 1 
       1185 1 29 PHE HA   1 29 PHE HB2  2.300 . 3.000 2.758 2.707 2.804     .  0 0 "[    .    1    .    2    .    3]" 1 
       1186 1 29 PHE HA   1 29 PHE HB3  2.400 . 3.100 2.913 2.876 2.947     .  0 0 "[    .    1    .    2    .    3]" 1 
       1187 1 29 PHE HB3  1 44 THR MG   3.300 . 4.700 4.366 4.117 4.549     .  0 0 "[    .    1    .    2    .    3]" 1 
       1188 1 29 PHE HB2  1 44 THR MG   3.100 . 4.300 3.225 2.661 3.576     .  0 0 "[    .    1    .    2    .    3]" 1 
       1189 1 29 PHE HB3  1 40 ALA MB   2.900 . 5.500 5.052 4.786 5.538 0.038 23 0 "[    .    1    .    2    .    3]" 1 
       1190 1  8 THR MG   1 29 PHE HB3  3.100 . 4.300 2.078 1.895 2.412 0.005 16 0 "[    .    1    .    2    .    3]" 1 
       1191 1  8 THR MG   1 29 PHE HB2  3.000 . 5.500 3.571 3.357 3.887     .  0 0 "[    .    1    .    2    .    3]" 1 
       1192 1 24 LEU HA   1 29 PHE HB3  2.400 . 3.100 2.699 2.363 2.976     .  0 0 "[    .    1    .    2    .    3]" 1 
       1193 1 24 LEU HA   1 29 PHE HB2  2.400 . 5.500 2.473 2.183 2.891     .  0 0 "[    .    1    .    2    .    3]" 1 
       1194 1 31 LEU HA   1 31 LEU HB3  2.200 . 2.800 2.241 2.218 2.266     .  0 0 "[    .    1    .    2    .    3]" 1 
       1195 1 31 LEU HA   1 31 LEU HG   2.200 . 5.500 3.258 3.202 3.377     .  0 0 "[    .    1    .    2    .    3]" 1 
       1196 1 31 LEU HA   1 31 LEU QD   1.800 . 5.500 3.014 2.892 3.265     .  0 0 "[    .    1    .    2    .    3]" 1 
       1197 1 31 LEU HA   1 34 ALA MB   2.200 . 5.500 3.525 2.984 3.746     .  0 0 "[    .    1    .    2    .    3]" 1 
       1198 1 31 LEU HB2  1 65 LEU QD   2.900 . 3.300 2.430 2.284 2.523     .  0 0 "[    .    1    .    2    .    3]" 1 
       1199 1 31 LEU HB2  1 31 LEU QD   2.300 . 3.000 1.994 1.883 2.103     .  0 0 "[    .    1    .    2    .    3]" 1 
       1200 1 31 LEU HB2  1 31 LEU HG   2.400 . 3.100 2.755 2.698 2.863     .  0 0 "[    .    1    .    2    .    3]" 1 
       1201 1 31 LEU HA   1 31 LEU HB2  2.400 . 3.100 2.902 2.787 2.940     .  0 0 "[    .    1    .    2    .    3]" 1 
       1202 1 31 LEU HB3  1 31 LEU QD   2.900 . 4.000 1.973 1.886 2.084     .  0 0 "[    .    1    .    2    .    3]" 1 
       1203 1 31 LEU QD   1 31 LEU HG   1.900 . 2.400 1.872 1.856 1.889     .  0 0 "[    .    1    .    2    .    3]" 1 
       1204 1 28 LEU HA   1 31 LEU QD   2.900 . 4.000 1.639 1.417 1.893 0.383 19 0 "[    .    1    .    2    .    3]" 1 
       1205 1 32 ILE HA   1 32 ILE MD   2.100 . 5.500 3.950 3.864 4.018     .  0 0 "[    .    1    .    2    .    3]" 1 
       1206 1 32 ILE HA   1 32 ILE MG   2.100 . 2.700 2.045 1.978 2.127     .  0 0 "[    .    1    .    2    .    3]" 1 
       1207 1 32 ILE HA   1 69 VAL QG   2.700 . 3.800 2.549 2.410 2.729     .  0 0 "[    .    1    .    2    .    3]" 1 
       1208 1 31 LEU HB2  1 32 ILE HA   3.200 . 4.500 3.868 3.821 3.922     .  0 0 "[    .    1    .    2    .    3]" 1 
       1209 1 32 ILE HA   1 34 ALA MB   3.700 . 5.400 4.359 4.227 4.466     .  0 0 "[    .    1    .    2    .    3]" 1 
       1210 1 32 ILE HA   1 72 ALA MB   3.700 . 5.400 5.354 5.204 5.437 0.037  1 0 "[    .    1    .    2    .    3]" 1 
       1211 1 32 ILE HA   1 32 ILE HB   2.400 . 3.100 2.938 2.886 2.966     .  0 0 "[    .    1    .    2    .    3]" 1 
       1212 1 32 ILE HA   1 35 MET ME   2.500 . 3.300 2.803 2.553 3.301 0.001 28 0 "[    .    1    .    2    .    3]" 1 
       1213 1 32 ILE HA   1 35 MET HB2  2.600 . 3.400 2.260 2.112 2.610     .  0 0 "[    .    1    .    2    .    3]" 1 
       1214 1 32 ILE HA   1 35 MET HG2  3.000 . 4.100 4.078 2.677 4.184 0.084 16 0 "[    .    1    .    2    .    3]" 1 
       1215 1 32 ILE HA   1 35 MET HG3  2.800 . 3.800 2.579 1.714 2.726 0.086 29 0 "[    .    1    .    2    .    3]" 1 
       1216 1 31 LEU HA   1 32 ILE HA   3.700 . 5.400 4.678 4.651 4.718     .  0 0 "[    .    1    .    2    .    3]" 1 
       1217 1 32 ILE HB   1 43 ILE MD   2.500 . 5.500 3.672 3.349 3.936     .  0 0 "[    .    1    .    2    .    3]" 1 
       1218 1 32 ILE HB   1 32 ILE MD   2.200 . 2.800 2.522 2.400 2.626     .  0 0 "[    .    1    .    2    .    3]" 1 
       1219 1 32 ILE HB   1 69 VAL QG   3.800 . 4.500 3.696 3.585 3.842     .  0 0 "[    .    1    .    2    .    3]" 1 
       1220 1 32 ILE HB   1 72 ALA MB   3.400 . 5.500 5.468 5.358 5.554 0.054 29 0 "[    .    1    .    2    .    3]" 1 
       1221 1 32 ILE HB   1 33 GLN QB   2.500 . 5.500 4.682 4.489 4.737     .  0 0 "[    .    1    .    2    .    3]" 1 
       1222 1 32 ILE HB   1 40 ALA HA   3.400 . 4.800 2.578 2.221 3.359     .  0 0 "[    .    1    .    2    .    3]" 1 
       1223 1 32 ILE MD   1 32 ILE MG   2.100 . 2.700 1.697 1.550 1.999     .  0 0 "[    .    1    .    2    .    3]" 1 
       1224 1 32 ILE MG   1 69 VAL QG   2.900 . 3.000 1.976 1.841 2.144     .  0 0 "[    .    1    .    2    .    3]" 1 
       1225 1 32 ILE HB   1 32 ILE MG   2.000 . 2.500 2.117 2.097 2.127     .  0 0 "[    .    1    .    2    .    3]" 1 
       1226 1 32 ILE MG   1 35 MET HB3  2.900 . 4.000 3.491 3.370 3.706     .  0 0 "[    .    1    .    2    .    3]" 1 
       1227 1 32 ILE MG   1 40 ALA HA   2.300 . 3.000 2.230 2.004 2.744     .  0 0 "[    .    1    .    2    .    3]" 1 
       1228 1 32 ILE MD   1 43 ILE MG   2.000 . 2.500 2.066 1.925 2.203     .  0 0 "[    .    1    .    2    .    3]" 1 
       1229 1 32 ILE MD   1 69 VAL QG   2.400 . 2.700 2.384 2.247 2.472     .  0 0 "[    .    1    .    2    .    3]" 1 
       1230 1 28 LEU HB2  1 32 ILE MD   2.200 . 5.500 4.065 3.821 4.195     .  0 0 "[    .    1    .    2    .    3]" 1 
       1231 1 32 ILE MD   1 47 LEU HB2  2.600 . 5.500 3.869 3.517 4.270     .  0 0 "[    .    1    .    2    .    3]" 1 
       1232 1 32 ILE MD   1 43 ILE HB   1.900 . 2.400 1.702 1.518 2.013     .  0 0 "[    .    1    .    2    .    3]" 1 
       1233 1 32 ILE MD   1 69 VAL HB   3.400 . 5.500 4.960 4.806 5.089     .  0 0 "[    .    1    .    2    .    3]" 1 
       1234 1 32 ILE MD   1 69 VAL HA   3.200 . 4.500 4.314 4.087 4.499     .  0 0 "[    .    1    .    2    .    3]" 1 
       1235 1 32 ILE MD   1 44 THR HB   2.400 . 3.100 2.309 2.026 3.117 0.017 29 0 "[    .    1    .    2    .    3]" 1 
       1236 1 32 ILE MD   1 43 ILE HA   3.700 . 5.400 4.023 3.869 4.227     .  0 0 "[    .    1    .    2    .    3]" 1 
       1237 1 32 ILE MD   1 40 ALA HA   3.000 . 4.100 3.014 2.790 3.758     .  0 0 "[    .    1    .    2    .    3]" 1 
       1238 1 28 LEU HA   1 32 ILE MD   2.900 . 4.000 3.539 3.358 3.693     .  0 0 "[    .    1    .    2    .    3]" 1 
       1239 1 32 ILE MD   1 41 GLY HA2  3.300 . 5.500 5.482 5.095 5.557 0.057  2 0 "[    .    1    .    2    .    3]" 1 
       1240 1 33 GLN HA   1 33 GLN QG   2.900 . 3.300 2.808 2.491 3.103     .  0 0 "[    .    1    .    2    .    3]" 1 
       1241 1 33 GLN HA   1 40 ALA MB   2.200 . 2.800 2.624 2.550 2.767     .  0 0 "[    .    1    .    2    .    3]" 1 
       1242 1  8 THR MG   1 33 GLN HA   2.400 . 5.500 4.164 3.931 4.567     .  0 0 "[    .    1    .    2    .    3]" 1 
       1243 1 32 ILE HB   1 33 GLN HA   4.200 . 5.500 4.094 4.064 4.151     .  0 0 "[    .    1    .    2    .    3]" 1 
       1244 1 29 PHE HA   1 33 GLN HA   3.700 . 5.400 5.078 4.944 5.365     .  0 0 "[    .    1    .    2    .    3]" 1 
       1245 1 33 GLN HA   1 33 GLN HB2  2.300 . 3.000 2.393 2.320 2.459     .  0 0 "[    .    1    .    2    .    3]" 1 
       1246 1 29 PHE HA   1 33 GLN HB2  2.200 . 5.500 4.414 4.253 4.533     .  0 0 "[    .    1    .    2    .    3]" 1 
       1247 1 33 GLN HB2  1 33 GLN QG   2.500 . 3.300 2.307 2.130 2.497     .  0 0 "[    .    1    .    2    .    3]" 1 
       1248 1 33 GLN HB2  1 33 GLN HG2  2.300 . 3.000 2.381 2.135 2.677     .  0 0 "[    .    1    .    2    .    3]" 1 
       1249 1 33 GLN HB2  1 40 ALA MB   2.400 . 5.500 3.844 3.686 3.900     .  0 0 "[    .    1    .    2    .    3]" 1 
       1250 1 34 ALA HA   1 34 ALA MB   1.700 . 2.200 2.112 2.084 2.133     .  0 0 "[    .    1    .    2    .    3]" 1 
       1251 1 33 GLN QG   1 34 ALA HA   3.200 . 4.100 3.685 3.373 3.985     .  0 0 "[    .    1    .    2    .    3]" 1 
       1252 1 35 MET HA   1 35 MET HG3  2.200 . 5.500 3.342 3.234 3.890     .  0 0 "[    .    1    .    2    .    3]" 1 
       1253 1 35 MET HA   1 35 MET HG2  2.100 . 2.700 2.714 2.635 2.820 0.120 29 0 "[    .    1    .    2    .    3]" 1 
       1254 1 32 ILE HA   1 35 MET HA   4.100 . 5.500 4.701 4.619 4.817     .  0 0 "[    .    1    .    2    .    3]" 1 
       1255 1 34 ALA MB   1 35 MET HA   2.900 . 5.500 4.003 3.943 4.063     .  0 0 "[    .    1    .    2    .    3]" 1 
       1256 1 35 MET HA   1 35 MET HB3  2.000 . 2.500 2.362 2.328 2.386     .  0 0 "[    .    1    .    2    .    3]" 1 
       1257 1 35 MET HA   1 35 MET ME   2.900 . 5.500 4.872 4.614 4.923     .  0 0 "[    .    1    .    2    .    3]" 1 
       1258 1 35 MET HB2  1 35 MET HG2  2.300 . 3.000 2.992 2.761 3.007 0.007 26 0 "[    .    1    .    2    .    3]" 1 
       1259 1 35 MET HB2  1 35 MET HG3  2.400 . 3.100 2.423 2.207 2.464     .  0 0 "[    .    1    .    2    .    3]" 1 
       1260 1 35 MET HA   1 35 MET HB2  2.400 . 3.100 3.010 2.995 3.017     .  0 0 "[    .    1    .    2    .    3]" 1 
       1261 1 35 MET HB3  1 69 VAL QG   3.000 . 4.100 3.893 3.759 4.078     .  0 0 "[    .    1    .    2    .    3]" 1 
       1262 1 35 MET HB3  1 35 MET ME   2.900 . 4.000 4.048 3.905 4.076 0.076 23 0 "[    .    1    .    2    .    3]" 1 
       1263 1 35 MET HB3  1 35 MET HG2  2.300 . 3.000 2.458 2.406 2.871     .  0 0 "[    .    1    .    2    .    3]" 1 
       1264 1 35 MET HB3  1 35 MET HG3  2.400 . 3.100 2.994 2.764 3.007     .  0 0 "[    .    1    .    2    .    3]" 1 
       1265 1 32 ILE HA   1 35 MET HB3  3.200 . 4.500 3.914 3.801 4.001     .  0 0 "[    .    1    .    2    .    3]" 1 
       1266 1 32 ILE MG   1 35 MET HG3  4.200 . 5.500 3.700 2.329 3.936     .  0 0 "[    .    1    .    2    .    3]" 1 
       1267 1 35 MET HG3  1 69 VAL QG   3.700 . 5.400 3.327 1.981 3.620 0.019 29 0 "[    .    1    .    2    .    3]" 1 
       1268 1 34 ALA MB   1 35 MET HG3  3.100 . 4.300 2.968 2.763 4.185     .  0 0 "[    .    1    .    2    .    3]" 1 
       1269 1 35 MET ME   1 73 VAL QG   3.200 . 4.500 3.919 3.642 4.137     .  0 0 "[    .    1    .    2    .    3]" 1 
       1270 1 35 MET ME   1 65 LEU QD   2.400 . 3.100 2.729 2.457 3.025     .  0 0 "[    .    1    .    2    .    3]" 1 
       1271 1 32 ILE MG   1 35 MET ME   2.600 . 3.400 3.443 3.409 3.528 0.128 29 0 "[    .    1    .    2    .    3]" 1 
       1272 1 31 LEU QD   1 35 MET ME   3.000 . 4.100 3.560 3.081 3.888     .  0 0 "[    .    1    .    2    .    3]" 1 
       1273 1 35 MET ME   1 69 VAL QG   2.400 . 3.100 1.842 1.685 1.963 0.015 29 0 "[    .    1    .    2    .    3]" 1 
       1274 1 31 LEU HB2  1 35 MET ME   2.200 . 5.500 2.744 2.285 3.278     .  0 0 "[    .    1    .    2    .    3]" 1 
       1275 1 34 ALA MB   1 35 MET ME   3.300 . 4.700 3.494 3.304 3.868     .  0 0 "[    .    1    .    2    .    3]" 1 
       1276 1 35 MET ME   1 66 ARG QG   2.700 . 3.600 1.900 1.789 2.119 0.011 14 0 "[    .    1    .    2    .    3]" 1 
       1277 1 35 MET ME   1 69 VAL HB   3.100 . 4.300 1.975 1.878 2.126 0.022 28 0 "[    .    1    .    2    .    3]" 1 
       1278 1 35 MET ME   1 35 MET HG2  2.400 . 3.100 2.875 2.596 2.970     .  0 0 "[    .    1    .    2    .    3]" 1 
       1279 1 35 MET ME   1 35 MET HG3  2.300 . 3.000 2.213 2.111 2.359     .  0 0 "[    .    1    .    2    .    3]" 1 
       1280 1 35 MET ME   1 66 ARG QD   2.800 . 3.800 3.222 2.366 3.621     .  0 0 "[    .    1    .    2    .    3]" 1 
       1281 1 35 MET ME   1 69 VAL HA   3.600 . 5.200 4.409 4.091 4.560     .  0 0 "[    .    1    .    2    .    3]" 1 
       1282 1 31 LEU HA   1 35 MET ME   3.300 . 4.700 3.802 3.421 4.411     .  0 0 "[    .    1    .    2    .    3]" 1 
       1283 1 35 MET ME   1 70 ASP HA   3.200 . 4.500 4.247 3.443 4.535 0.035  8 0 "[    .    1    .    2    .    3]" 1 
       1284 1 35 MET HB2  1 36 HIS HA   3.200 . 4.500 4.428 4.177 4.481     .  0 0 "[    .    1    .    2    .    3]" 1 
       1285 1 36 HIS HA   1 36 HIS HB3  2.500 . 3.300 2.679 2.607 2.763     .  0 0 "[    .    1    .    2    .    3]" 1 
       1286 1 36 HIS HA   1 36 HIS HB2  2.500 . 3.300 2.256 2.233 2.295     .  0 0 "[    .    1    .    2    .    3]" 1 
       1287 1 36 HIS HB2  1 40 ALA HA   3.800 . 5.500 5.198 4.828 5.531 0.031 29 0 "[    .    1    .    2    .    3]" 1 
       1288 1 36 HIS HB2  1 40 ALA MB   4.000 . 5.500 2.525 2.088 3.160     .  0 0 "[    .    1    .    2    .    3]" 1 
       1289 1 32 ILE HB   1 36 HIS HB2  3.200 . 5.500 5.559 5.531 5.606 0.106 29 0 "[    .    1    .    2    .    3]" 1 
       1290 1 32 ILE MG   1 36 HIS HB3  2.700 . 5.500 5.168 5.006 5.305     .  0 0 "[    .    1    .    2    .    3]" 1 
       1291 1 36 HIS HB3  1 40 ALA MB   3.400 . 4.800 3.125 2.884 3.382     .  0 0 "[    .    1    .    2    .    3]" 1 
       1292 1 34 ALA MB   1 36 HIS HB3  3.200 . 5.500 5.326 5.235 5.370     .  0 0 "[    .    1    .    2    .    3]" 1 
       1293 1 32 ILE HB   1 36 HIS HB3  3.100 . 5.500 5.478 5.161 5.542 0.042  5 0 "[    .    1    .    2    .    3]" 1 
       1294 1 38 THR HB   1 38 THR MG   1.900 . 2.400 2.104 2.070 2.118     .  0 0 "[    .    1    .    2    .    3]" 1 
       1295 1 38 THR HA   1 38 THR MG   2.100 . 2.700 2.348 2.177 2.540     .  0 0 "[    .    1    .    2    .    3]" 1 
       1296 1 38 THR MG   1 39 LEU HB2  2.700 . 3.600 2.947 2.462 3.616 0.016 21 0 "[    .    1    .    2    .    3]" 1 
       1297 1 38 THR MG   1 73 VAL QG   3.000 . 5.500 2.373 1.445 3.287     .  0 0 "[    .    1    .    2    .    3]" 1 
       1298 1 38 THR MG   1 76 LEU QD   2.900 . 4.000 2.569 1.843 3.964     .  0 0 "[    .    1    .    2    .    3]" 1 
       1299 1 40 ALA MB   1 41 GLY HA2  3.200 . 4.500 3.810 3.680 4.207     .  0 0 "[    .    1    .    2    .    3]" 1 
       1300 1 38 THR HB   1 40 ALA MB   2.500 . 5.500 4.977 4.533 5.199     .  0 0 "[    .    1    .    2    .    3]" 1 
       1301 1 40 ALA HA   1 40 ALA MB   2.000 . 2.500 2.117 2.086 2.139     .  0 0 "[    .    1    .    2    .    3]" 1 
       1302 1 40 ALA MB   1 43 ILE MD   3.000 . 4.100 3.479 3.131 3.912     .  0 0 "[    .    1    .    2    .    3]" 1 
       1303 1 32 ILE MD   1 40 ALA MB   2.800 . 3.800 3.424 3.224 3.808 0.008 13 0 "[    .    1    .    2    .    3]" 1 
       1304 1 32 ILE MG   1 40 ALA MB   2.200 . 2.800 2.453 2.139 2.694     .  0 0 "[    .    1    .    2    .    3]" 1 
       1305 1  8 THR MG   1 40 ALA MB   2.100 . 5.500 4.333 4.076 4.705     .  0 0 "[    .    1    .    2    .    3]" 1 
       1306 1 32 ILE HB   1 40 ALA MB   2.400 . 3.100 1.908 1.698 2.395 0.002 24 0 "[    .    1    .    2    .    3]" 1 
       1307 1 33 GLN QB   1 40 ALA MB   2.700 . 3.600 3.679 3.549 3.721 0.121 21 0 "[    .    1    .    2    .    3]" 1 
       1308 1 35 MET HB2  1 40 ALA MB   2.500 . 5.500 4.109 3.970 4.275     .  0 0 "[    .    1    .    2    .    3]" 1 
       1309 1 41 GLY QA   1 42 LYS QD   3.700 . 5.400 5.098 4.885 5.280     .  0 0 "[    .    1    .    2    .    3]" 1 
       1310 1 41 GLY HA2  1 44 THR MG   3.800 . 5.500 2.952 2.553 3.976     .  0 0 "[    .    1    .    2    .    3]" 1 
       1311 1 42 LYS HB2  1 42 LYS QG   2.600 . 3.400 2.210 2.134 2.257     .  0 0 "[    .    1    .    2    .    3]" 1 
       1312 1 42 LYS HB3  1 42 LYS QG   2.500 . 3.300 2.149 2.131 2.162     .  0 0 "[    .    1    .    2    .    3]" 1 
       1313 1 42 LYS HE3  1 42 LYS QG   2.900 . 4.000 2.969 1.965 3.370     .  0 0 "[    .    1    .    2    .    3]" 1 
       1314 1 42 LYS HE2  1 42 LYS QG   3.100 . 4.300 2.565 2.062 3.457     .  0 0 "[    .    1    .    2    .    3]" 1 
       1315 1 42 LYS QG   2 12 GLU QG   3.400 . 4.800 4.125 3.541 4.367     .  0 0 "[    .    1    .    2    .    3]" 1 
       1316 1 42 LYS QD   1 42 LYS QG   2.300 . 3.000 2.062 2.023 2.089     .  0 0 "[    .    1    .    2    .    3]" 1 
       1317 1 42 LYS QG   1 76 LEU QD   2.600 . 5.500 2.824 2.150 3.738     .  0 0 "[    .    1    .    2    .    3]" 1 
       1318 1 42 LYS HA   1 42 LYS QD   2.500 . 3.300 1.694 1.642 1.763 0.058 17 0 "[    .    1    .    2    .    3]" 1 
       1319 1 42 LYS QD   1 42 LYS HE2  2.500 . 3.300 2.336 2.136 2.526     .  0 0 "[    .    1    .    2    .    3]" 1 
       1320 1 42 LYS QD   2 12 GLU QG   3.000 . 3.600 2.622 1.769 3.273 0.031 28 0 "[    .    1    .    2    .    3]" 1 
       1321 1 42 LYS QD   1 76 LEU QD   2.900 . 5.500 4.250 3.577 4.960     .  0 0 "[    .    1    .    2    .    3]" 1 
       1322 1 43 ILE HA   1 46 MET QG   3.400 . 4.800 2.457 1.755 2.853 0.245  4 0 "[    .    1    .    2    .    3]" 1 
       1323 1 42 LYS HB3  1 43 ILE HA   3.000 . 5.500 4.114 3.874 4.257     .  0 0 "[    .    1    .    2    .    3]" 1 
       1324 1 43 ILE HA   1 46 MET ME   3.000 . 4.100 3.504 1.874 4.109 0.026 21 0 "[    .    1    .    2    .    3]" 1 
       1325 1 43 ILE HA   1 43 ILE MD   2.700 . 5.500 3.835 3.674 3.926     .  0 0 "[    .    1    .    2    .    3]" 1 
       1326 1 43 ILE HA   1 47 LEU QD   3.000 . 4.100 3.041 2.752 4.021     .  0 0 "[    .    1    .    2    .    3]" 1 
       1327 1 43 ILE HA   1 43 ILE MG   2.200 . 2.800 2.284 2.143 2.410     .  0 0 "[    .    1    .    2    .    3]" 1 
       1328 1 43 ILE HA   1 75 VAL QG   3.500 . 3.600 3.092 2.770 3.300     .  0 0 "[    .    1    .    2    .    3]" 1 
       1329 1 42 LYS QG   1 43 ILE HA   3.100 . 5.500 4.153 3.724 4.891     .  0 0 "[    .    1    .    2    .    3]" 1 
       1330 1 43 ILE HA   1 72 ALA MB   2.800 . 5.500 4.296 4.082 4.425     .  0 0 "[    .    1    .    2    .    3]" 1 
       1331 1 43 ILE HA   1 43 ILE HB   2.900 . 4.000 3.004 2.978 3.019     .  0 0 "[    .    1    .    2    .    3]" 1 
       1332 1 40 ALA HA   1 43 ILE HB   2.600 . 3.400 2.798 2.547 3.442 0.042 26 0 "[    .    1    .    2    .    3]" 1 
       1333 1 43 ILE HB   1 72 ALA MB   3.000 . 4.100 3.927 3.701 4.051     .  0 0 "[    .    1    .    2    .    3]" 1 
       1334 1 43 ILE HB   1 43 ILE MD   2.300 . 3.000 2.444 2.273 2.683     .  0 0 "[    .    1    .    2    .    3]" 1 
       1335 1 43 ILE HB   1 47 LEU QD   3.900 . 5.500 4.162 3.715 5.430     .  0 0 "[    .    1    .    2    .    3]" 1 
       1336 1 32 ILE MG   1 43 ILE HB   2.200 . 2.800 2.448 2.303 2.770     .  0 0 "[    .    1    .    2    .    3]" 1 
       1337 1 43 ILE MG   1 69 VAL HA   2.300 . 5.500 3.995 3.707 4.134     .  0 0 "[    .    1    .    2    .    3]" 1 
       1338 1 32 ILE HA   1 43 ILE MG   3.600 . 5.500 5.168 5.020 5.367     .  0 0 "[    .    1    .    2    .    3]" 1 
       1339 1 43 ILE MD   1 43 ILE MG   1.900 . 2.400 1.923 1.642 2.171     .  0 0 "[    .    1    .    2    .    3]" 1 
       1340 1 43 ILE MG   1 47 LEU QD   1.900 . 5.500 2.121 1.654 3.284     .  0 0 "[    .    1    .    2    .    3]" 1 
       1341 1 43 ILE MG   1 75 VAL QG   2.000 . 2.500 2.457 2.393 2.528 0.028  4 0 "[    .    1    .    2    .    3]" 1 
       1342 1 43 ILE MG   1 69 VAL QG   2.100 . 3.000 2.854 2.671 2.931     .  0 0 "[    .    1    .    2    .    3]" 1 
       1343 1 43 ILE HB   1 43 ILE MG   1.900 . 2.400 2.124 2.104 2.129     .  0 0 "[    .    1    .    2    .    3]" 1 
       1344 1 43 ILE MG   1 46 MET ME   2.400 . 5.500 4.163 1.823 4.613     .  0 0 "[    .    1    .    2    .    3]" 1 
       1345 1 43 ILE MG   1 75 VAL HB   3.700 . 5.400 5.049 2.582 5.235     .  0 0 "[    .    1    .    2    .    3]" 1 
       1346 1 43 ILE MD   1 69 VAL HA   3.300 . 5.500 5.336 4.242 5.539 0.039 29 0 "[    .    1    .    2    .    3]" 1 
       1347 1 40 ALA HA   1 43 ILE MD   2.500 . 3.300 2.338 1.855 2.769     .  0 0 "[    .    1    .    2    .    3]" 1 
       1348 1 39 LEU HB3  1 43 ILE MD   2.500 . 5.500 3.684 3.273 5.191     .  0 0 "[    .    1    .    2    .    3]" 1 
       1349 1 43 ILE MD   1 72 ALA MB   2.500 . 3.300 3.114 1.872 3.328 0.028  4 0 "[    .    1    .    2    .    3]" 1 
       1350 1 35 MET HB3  1 43 ILE MD   3.000 . 5.500 4.757 4.545 5.056     .  0 0 "[    .    1    .    2    .    3]" 1 
       1351 1 43 ILE MD   1 76 LEU QB   3.300 . 4.700 2.957 2.384 3.953     .  0 0 "[    .    1    .    2    .    3]" 1 
       1352 1 43 ILE MD   1 73 VAL HB   2.700 . 5.500 3.487 2.691 4.388     .  0 0 "[    .    1    .    2    .    3]" 1 
       1353 1 43 ILE MD   1 75 VAL QG   3.100 . 5.500 3.772 2.980 4.338     .  0 0 "[    .    1    .    2    .    3]" 1 
       1354 1 43 ILE MD   1 69 VAL QG   2.700 . 5.500 3.277 2.663 3.494     .  0 0 "[    .    1    .    2    .    3]" 1 
       1355 1 32 ILE MG   1 43 ILE MD   1.900 . 2.400 1.696 1.597 1.850     .  0 0 "[    .    1    .    2    .    3]" 1 
       1356 1 32 ILE MD   1 43 ILE MD   2.100 . 2.700 2.721 2.606 2.751 0.051 19 0 "[    .    1    .    2    .    3]" 1 
       1357 1 28 LEU QD   1 44 THR HB   2.800 . 3.800 3.414 3.089 3.896 0.096 29 0 "[    .    1    .    2    .    3]" 1 
       1358 1 44 THR HB   1 44 THR MG   2.300 . 3.000 2.109 2.085 2.116     .  0 0 "[    .    1    .    2    .    3]" 1 
       1359 1 43 ILE MG   1 44 THR HB   3.500 . 5.000 4.796 4.362 5.027 0.027  3 0 "[    .    1    .    2    .    3]" 1 
       1360 1 28 LEU HB2  1 44 THR HB   3.100 . 4.300 3.616 3.463 4.415 0.115 29 0 "[    .    1    .    2    .    3]" 1 
       1361 1 27 ARG QD   1 31 LEU QD   3.100 . 4.300 3.138 1.877 3.656 0.023 30 0 "[    .    1    .    2    .    3]" 1 
       1362 1 44 THR MG   2 13 PHE HB2  3.100 . 5.500 3.089 2.849 3.386     .  0 0 "[    .    1    .    2    .    3]" 1 
       1363 1 44 THR MG   1 48 LEU QD   2.600 . 3.000 2.727 1.842 2.977     .  0 0 "[    .    1    .    2    .    3]" 1 
       1364 1 45 GLY QA   2 13 PHE HB2  3.700 . 5.000 1.689 1.429 2.204 0.571 22 5 "[    .    1 *-*. *  2 +  .    3]" 1 
       1365 1 42 LYS HE3  1 45 GLY QA   4.300 . 5.400 3.920 2.966 5.201     .  0 0 "[    .    1    .    2    .    3]" 1 
       1366 1 45 GLY QA   1 48 LEU QD   2.900 . 4.000 2.413 2.023 2.563     .  0 0 "[    .    1    .    2    .    3]" 1 
       1367 1 44 THR MG   1 45 GLY QA   2.800 . 3.800 2.896 2.803 3.028     .  0 0 "[    .    1    .    2    .    3]" 1 
       1368 1 42 LYS QD   1 45 GLY QA   4.300 . 5.000 3.064 2.715 3.234     .  0 0 "[    .    1    .    2    .    3]" 1 
       1369 1 45 GLY QA   1 48 LEU HB2  3.700 . 5.400 2.520 2.098 2.802     .  0 0 "[    .    1    .    2    .    3]" 1 
       1370 1 45 GLY QA   1 48 LEU HB3  3.200 . 4.500 3.848 3.382 4.225     .  0 0 "[    .    1    .    2    .    3]" 1 
       1371 1 45 GLY QA   1 46 MET HA   3.200 . 5.500 3.977 3.954 4.032     .  0 0 "[    .    1    .    2    .    3]" 1 
       1372 1 45 GLY QA   2 12 GLU HA   3.200 . 3.800 2.824 2.383 3.242     .  0 0 "[    .    1    .    2    .    3]" 1 
       1373 1 46 MET QB   1 46 MET ME   2.600 . 4.000 2.694 1.956 3.510     .  0 0 "[    .    1    .    2    .    3]" 1 
       1374 1 46 MET QB   1 47 LEU QD   2.900 . 3.400 2.273 1.781 2.889 0.019  4 0 "[    .    1    .    2    .    3]" 1 
       1375 1 46 MET QB   1 75 VAL QG   2.900 . 5.500 3.272 2.039 4.061     .  0 0 "[    .    1    .    2    .    3]" 1 
       1376 1 46 MET QB   2  4 SER QB   3.800 . 5.500 3.953 3.583 4.417     .  0 0 "[    .    1    .    2    .    3]" 1 
       1377 1 46 MET HA   1 46 MET QG   2.500 . 4.000 3.168 2.937 3.298     .  0 0 "[    .    1    .    2    .    3]" 1 
       1378 1 46 MET QG   1 47 LEU QD   3.000 . 4.000 2.302 1.830 3.179 0.070  7 0 "[    .    1    .    2    .    3]" 1 
       1379 1 46 MET QG   1 47 LEU HB2  2.600 . 5.500 4.396 3.784 5.065     .  0 0 "[    .    1    .    2    .    3]" 1 
       1380 1 42 LYS QG   1 46 MET QG   2.800 . 4.000 3.496 2.787 3.748     .  0 0 "[    .    1    .    2    .    3]" 1 
       1381 1 46 MET QG   1 75 VAL QG   2.900 . 4.000 2.481 2.079 3.526     .  0 0 "[    .    1    .    2    .    3]" 1 
       1382 1 43 ILE MG   1 46 MET QG   3.700 . 5.400 3.463 2.981 3.985     .  0 0 "[    .    1    .    2    .    3]" 1 
       1383 1 46 MET HA   1 46 MET ME   2.900 . 5.500 4.627 4.025 5.234     .  0 0 "[    .    1    .    2    .    3]" 1 
       1384 1 46 MET ME   1 76 LEU HA   3.300 . 4.600 3.166 1.987 4.676 0.076 21 0 "[    .    1    .    2    .    3]" 1 
       1385 1 24 LEU HB2  1 27 ARG HA   3.000 . 4.100 2.477 1.974 2.972     .  0 0 "[    .    1    .    2    .    3]" 1 
       1386 1 46 MET ME   1 75 VAL HB   2.700 . 3.600 3.195 2.752 3.664 0.064 21 0 "[    .    1    .    2    .    3]" 1 
       1387 1 46 MET ME   1 46 MET QG   2.600 . 3.400 2.217 1.944 2.499     .  0 0 "[    .    1    .    2    .    3]" 1 
       1388 1 46 MET ME   1 76 LEU QD   2.600 . 5.500 3.039 1.761 4.472     .  0 0 "[    .    1    .    2    .    3]" 1 
       1389 1 46 MET ME   1 75 VAL QG   2.400 . 2.500 1.753 1.554 2.050     .  0 0 "[    .    1    .    2    .    3]" 1 
       1390 1 46 MET ME   1 76 LEU QB   2.400 . 5.500 4.178 2.606 4.840     .  0 0 "[    .    1    .    2    .    3]" 1 
       1391 1 42 LYS QD   1 46 MET ME   2.400 . 5.500 2.890 1.468 4.112     .  0 0 "[    .    1    .    2    .    3]" 1 
       1392 1 47 LEU HA   1 47 LEU HB3  2.500 . 3.300 2.514 2.424 2.656     .  0 0 "[    .    1    .    2    .    3]" 1 
       1393 1 61 SER QB   1 65 LEU HB2  3.000 . 4.100 3.479 3.105 3.837     .  0 0 "[    .    1    .    2    .    3]" 1 
       1394 1 47 LEU HA   1 47 LEU HB2  2.400 . 3.100 3.013 2.980 3.019     .  0 0 "[    .    1    .    2    .    3]" 1 
       1395 1 46 MET QB   1 47 LEU HB2  3.600 . 5.200 4.579 3.665 4.961     .  0 0 "[    .    1    .    2    .    3]" 1 
       1396 1 47 LEU HB2  1 47 LEU QD       . . 2.400 2.150 1.945 2.323     .  0 0 "[    .    1    .    2    .    3]" 1 
       1397 1 43 ILE MG   1 47 LEU HB2  2.700 . 3.600 3.436 2.851 3.650 0.050 18 0 "[    .    1    .    2    .    3]" 1 
       1398 1 47 LEU HB3  1 47 LEU QD   1.900 . 5.500 2.311 1.898 2.473     .  0 0 "[    .    1    .    2    .    3]" 1 
       1399 1 48 LEU HA   1 48 LEU HB2  2.500 . 3.300 2.736 2.695 2.870     .  0 0 "[    .    1    .    2    .    3]" 1 
       1400 1 48 LEU HB2  1 48 LEU QD   2.400 . 3.100 2.179 2.100 2.236     .  0 0 "[    .    1    .    2    .    3]" 1 
       1401 1 44 THR MG   1 48 LEU HB2  3.200 . 4.500 4.503 3.745 4.573 0.073 21 0 "[    .    1    .    2    .    3]" 1 
       1402 1 38 THR HB   1 73 VAL QG   2.500 . 3.300 2.943 2.411 3.272     .  0 0 "[    .    1    .    2    .    3]" 1 
       1403 1 35 MET HA   1 73 VAL QG   3.100 . 4.300 4.223 4.072 4.272     .  0 0 "[    .    1    .    2    .    3]" 1 
       1404 1 48 LEU HA   1 48 LEU QD   2.700 . 3.600 1.973 1.838 2.750     .  0 0 "[    .    1    .    2    .    3]" 1 
       1405 1 35 MET HG2  1 73 VAL QG   3.000 . 4.100 4.080 4.044 4.123 0.023 28 0 "[    .    1    .    2    .    3]" 1 
       1406 1 73 VAL HA   1 73 VAL QG   2.100 . 2.700 2.296 2.079 2.479     .  0 0 "[    .    1    .    2    .    3]" 1 
       1407 1 69 VAL HA   1 73 VAL QG   3.300 . 4.700 4.402 4.176 4.638     .  0 0 "[    .    1    .    2    .    3]" 1 
       1408 1 72 ALA MB   1 73 VAL QG   2.500 . 5.500 3.112 2.860 3.447     .  0 0 "[    .    1    .    2    .    3]" 1 
       1409 1 35 MET HB3  1 73 VAL QG   2.000 . 2.500 2.409 2.330 2.509 0.009  4 0 "[    .    1    .    2    .    3]" 1 
       1410 1 73 VAL HB   1 73 VAL QG   2.000 . 2.500 1.882 1.871 1.894     .  0 0 "[    .    1    .    2    .    3]" 1 
       1411 1 48 LEU MD1  1 48 LEU MD2  1.900 . 2.400 2.075 1.970 2.088     .  0 0 "[    .    1    .    2    .    3]" 1 
       1412 1 32 ILE MG   1 73 VAL QG   2.200 . 2.800 2.428 2.047 2.803 0.003 22 0 "[    .    1    .    2    .    3]" 1 
       1413 1 48 LEU QD   2 13 PHE HA   3.000 . 4.100 3.508 2.881 3.899     .  0 0 "[    .    1    .    2    .    3]" 1 
       1414 1 48 LEU QD   2 13 PHE HB2  2.800 . 3.800 2.887 2.685 3.420     .  0 0 "[    .    1    .    2    .    3]" 1 
       1415 1 48 LEU HB3  1 48 LEU QD   2.700 . 3.600 2.413 1.923 2.514     .  0 0 "[    .    1    .    2    .    3]" 1 
       1416 1 49 GLU HA   1 49 GLU HG2  2.700 . 3.600 2.526 2.298 3.740 0.140 21 0 "[    .    1    .    2    .    3]" 1 
       1417 1 49 GLU HA   1 49 GLU HG3  2.300 . 5.500 3.619 2.461 3.758     .  0 0 "[    .    1    .    2    .    3]" 1 
       1418 1 46 MET HA   1 49 GLU HG3  3.300 . 4.600 4.680 4.483 5.512 0.912 23 2 "[    .    1    .    2- + .    3]" 1 
       1419 1 49 GLU HG3  2 11 LYS HG3  2.900 . 4.000 3.101 2.224 4.586 0.586 21 1 "[    .    1    .    2+   .    3]" 1 
       1420 1 49 GLU HB2  1 49 GLU HG3  2.200 . 2.800 2.252 2.206 3.012 0.212 23 0 "[    .    1    .    2    .    3]" 1 
       1421 1 46 MET HA   1 49 GLU HG2  3.800 . 5.500 5.353 4.556 5.524 0.024 12 0 "[    .    1    .    2    .    3]" 1 
       1422 1 49 GLU HG2  2 11 LYS HG3  3.400 . 4.800 3.665 3.196 4.089     .  0 0 "[    .    1    .    2    .    3]" 1 
       1423 1 48 LEU HB2  1 49 GLU HG2  3.700 . 5.400 4.965 4.547 6.153 0.753 23 1 "[    .    1    .    2  + .    3]" 1 
       1424 1 50 ILE HA   1 50 ILE HG13 2.300 . 3.000 2.170 2.090 2.306     .  0 0 "[    .    1    .    2    .    3]" 1 
       1425 1 50 ILE HA   1 50 ILE HG12 2.300 . 3.000 2.776 2.604 2.945     .  0 0 "[    .    1    .    2    .    3]" 1 
       1426 1 50 ILE HA   1 50 ILE MD   2.500 . 5.500 3.634 3.570 3.706     .  0 0 "[    .    1    .    2    .    3]" 1 
       1427 1 50 ILE HA   1 50 ILE MG   2.100 . 5.500 3.101 3.032 3.143     .  0 0 "[    .    1    .    2    .    3]" 1 
       1428 1 28 LEU QD   1 50 ILE HB   3.400 . 4.800 2.665 2.430 3.025     .  0 0 "[    .    1    .    2    .    3]" 1 
       1429 1 50 ILE HB   1 50 ILE HG13 2.600 . 3.400 2.549 2.464 2.604     .  0 0 "[    .    1    .    2    .    3]" 1 
       1430 1 50 ILE HB   1 50 ILE HG12 2.300 . 3.000 3.012 3.001 3.024 0.024 21 0 "[    .    1    .    2    .    3]" 1 
       1431 1 50 ILE MG   1 55 LEU HA   3.500 . 5.000 3.561 3.278 3.771     .  0 0 "[    .    1    .    2    .    3]" 1 
       1432 1 50 ILE MG   1 68 LYS QE   3.800 . 5.500 4.245 3.817 4.690     .  0 0 "[    .    1    .    2    .    3]" 1 
       1433 1 50 ILE MG   1 51 ASP HB2  3.100 . 4.300 3.730 3.498 3.910     .  0 0 "[    .    1    .    2    .    3]" 1 
       1434 1 26 GLU QG   1 50 ILE MG   3.200 . 5.500 1.858 1.477 3.289     .  0 0 "[    .    1    .    2    .    3]" 1 
       1435 1 50 ILE MG   1 58 MET HB2  2.700 . 5.500 5.443 5.139 5.567 0.067 21 0 "[    .    1    .    2    .    3]" 1 
       1436 1 50 ILE HB   1 50 ILE MG   1.900 . 2.400 2.118 2.098 2.124     .  0 0 "[    .    1    .    2    .    3]" 1 
       1437 1 26 GLU HB2  1 50 ILE MG   2.200 . 2.800 2.422 2.169 2.775     .  0 0 "[    .    1    .    2    .    3]" 1 
       1438 1 50 ILE HG12 1 50 ILE MG   2.100 . 2.700 2.270 2.145 2.389     .  0 0 "[    .    1    .    2    .    3]" 1 
       1439 1 50 ILE HG13 1 50 ILE MG   2.100 . 5.500 3.189 3.163 3.204     .  0 0 "[    .    1    .    2    .    3]" 1 
       1440 1 47 LEU HB2  1 50 ILE MG   3.100 . 5.500 5.488 5.250 5.546 0.046 18 0 "[    .    1    .    2    .    3]" 1 
       1441 1 50 ILE MD   1 50 ILE MG   1.800 . 2.200 2.147 1.931 2.218 0.018 18 0 "[    .    1    .    2    .    3]" 1 
       1442 1 28 LEU QD   1 50 ILE MG   2.300 . 3.000 2.322 1.983 2.672     .  0 0 "[    .    1    .    2    .    3]" 1 
       1443 1 47 LEU HA   1 50 ILE MD   2.400 . 5.500 4.611 4.211 5.106     .  0 0 "[    .    1    .    2    .    3]" 1 
       1444 1 50 ILE MD   1 55 LEU HA   3.200 . 4.500 4.484 4.335 4.531 0.031 13 0 "[    .    1    .    2    .    3]" 1 
       1445 1 50 ILE MD   1 58 MET ME   2.200 . 5.500 4.217 3.696 4.673     .  0 0 "[    .    1    .    2    .    3]" 1 
       1446 1 50 ILE HB   1 50 ILE MD   2.100 . 2.700 2.281 2.189 2.403     .  0 0 "[    .    1    .    2    .    3]" 1 
       1447 1 50 ILE MD   1 58 MET QB   2.900 . 5.500 4.880 4.648 5.110     .  0 0 "[    .    1    .    2    .    3]" 1 
       1448 1 50 ILE MD   1 68 LYS QE   2.700 . 3.300 2.009 1.676 2.469 0.124 24 0 "[    .    1    .    2    .    3]" 1 
       1449 1 28 LEU QD   1 50 ILE MD   2.200 . 2.800 2.682 2.512 2.803 0.003 23 0 "[    .    1    .    2    .    3]" 1 
       1450 1 47 LEU HB2  1 50 ILE MD   3.200 . 4.500 4.363 3.870 4.528 0.028  7 0 "[    .    1    .    2    .    3]" 1 
       1451 1 50 ILE MD   1 50 ILE HG13 2.000 . 2.500 2.094 2.074 2.121     .  0 0 "[    .    1    .    2    .    3]" 1 
       1452 1 50 ILE MD   1 50 ILE HG12 2.000 . 2.500 2.093 2.073 2.120     .  0 0 "[    .    1    .    2    .    3]" 1 
       1453 1 50 ILE MD   1 68 LYS HD3  2.900 . 4.000 3.539 2.120 4.560 0.560 19 4 "[ -  . *  1    .   +2*   .    3]" 1 
       1454 1 50 ILE MD   1 68 LYS QB   3.300 . 5.500 4.103 3.423 4.678     .  0 0 "[    .    1    .    2    .    3]" 1 
       1455 1 50 ILE HA   1 51 ASP HA   3.200 . 4.500 4.304 4.290 4.339     .  0 0 "[    .    1    .    2    .    3]" 1 
       1456 1 50 ILE MG   1 51 ASP HA   4.200 . 5.500 3.809 3.688 3.897     .  0 0 "[    .    1    .    2    .    3]" 1 
       1457 1 51 ASP HA   1 51 ASP HB3  2.100 . 2.700 2.610 2.588 2.625     .  0 0 "[    .    1    .    2    .    3]" 1 
       1458 1 51 ASP HB3  1 55 LEU HB3  3.100 . 5.500 5.537 5.516 5.562 0.062 26 0 "[    .    1    .    2    .    3]" 1 
       1459 1 51 ASP HB2  1 55 LEU HB3  3.700 . 5.500 5.535 5.510 5.559 0.059 12 0 "[    .    1    .    2    .    3]" 1 
       1460 1 50 ILE MG   1 51 ASP HB3  3.600 . 5.200 4.539 4.362 4.679     .  0 0 "[    .    1    .    2    .    3]" 1 
       1461 1 26 GLU QG   1 52 ASN HA   2.300 . 3.000 2.024 1.831 2.972     .  0 0 "[    .    1    .    2    .    3]" 1 
       1462 1 52 ASN HA   1 55 LEU HB3  2.200 . 2.800 2.488 2.301 2.544     .  0 0 "[    .    1    .    2    .    3]" 1 
       1463 1 52 ASN HA   1 55 LEU QD   2.100 . 2.700 1.806 1.551 1.969 0.449  8 0 "[    .    1    .    2    .    3]" 1 
       1464 1 52 ASN HA   1 55 LEU HB2  2.900 . 4.000 4.017 3.827 4.048 0.048 27 0 "[    .    1    .    2    .    3]" 1 
       1465 1 52 ASN HA   1 55 LEU HG   2.700 . 3.600 3.295 3.143 3.450     .  0 0 "[    .    1    .    2    .    3]" 1 
       1466 1 52 ASN HA   1 52 ASN HB3  2.300 . 3.000 2.717 2.634 3.007 0.007 29 0 "[    .    1    .    2    .    3]" 1 
       1467 1 52 ASN HB3  1 55 LEU HB3  4.300 . 5.500 4.947 4.635 5.345     .  0 0 "[    .    1    .    2    .    3]" 1 
       1468 1 52 ASN HB3  1 55 LEU QD   2.500 . 5.500 2.727 2.348 3.507     .  0 0 "[    .    1    .    2    .    3]" 1 
       1469 1 52 ASN HA   1 52 ASN HB2  2.300 . 3.000 2.938 2.603 2.997     .  0 0 "[    .    1    .    2    .    3]" 1 
       1470 1 52 ASN HB2  2 18 LYS QB   3.300 . 5.500 5.291 4.290 5.534 0.034  4 0 "[    .    1    .    2    .    3]" 1 
       1471 1 52 ASN HB2  1 55 LEU QD   2.900 . 4.000 3.691 3.418 3.823     .  0 0 "[    .    1    .    2    .    3]" 1 
       1472 1 55 LEU HB2  1 55 LEU HG   2.800 . 3.800 2.996 2.990 3.002     .  0 0 "[    .    1    .    2    .    3]" 1 
       1473 1 55 LEU HB2  1 55 LEU QD   2.500 . 2.800 2.126 2.056 2.155     .  0 0 "[    .    1    .    2    .    3]" 1 
       1474 1 55 LEU HA   1 55 LEU HB2  2.700 . 3.600 2.286 2.269 2.305     .  0 0 "[    .    1    .    2    .    3]" 1 
       1475 1 55 LEU QD   1 56 LEU HA   2.700 . 3.600 2.477 2.357 2.556     .  0 0 "[    .    1    .    2    .    3]" 1 
       1476 1 55 LEU HA   1 55 LEU QD   2.000 . 5.500 3.182 3.124 3.231     .  0 0 "[    .    1    .    2    .    3]" 1 
       1477 1 55 LEU QD   1 58 MET HB2  2.700 . 5.500 4.144 3.906 4.331     .  0 0 "[    .    1    .    2    .    3]" 1 
       1478 1 26 GLU HB3  1 55 LEU QD   2.300 . 5.500 2.593 2.335 2.793     .  0 0 "[    .    1    .    2    .    3]" 1 
       1479 1 24 LEU HB2  1 55 LEU QD   3.000 . 5.500 4.946 4.453 5.245     .  0 0 "[    .    1    .    2    .    3]" 1 
       1480 1 27 ARG QG   1 55 LEU QD   3.000 . 4.100 2.683 1.909 2.883     .  0 0 "[    .    1    .    2    .    3]" 1 
       1481 1 55 LEU QD   1 55 LEU HG   2.000 . 2.500 1.869 1.855 1.879     .  0 0 "[    .    1    .    2    .    3]" 1 
       1482 1 55 LEU MD1  1 55 LEU MD2  1.900 . 2.400 1.970 1.858 2.041     .  0 0 "[    .    1    .    2    .    3]" 1 
       1483 1 50 ILE MG   1 55 LEU QD   2.300 . 5.500 3.827 3.707 3.955     .  0 0 "[    .    1    .    2    .    3]" 1 
       1484 1 56 LEU QB   1 56 LEU MD2  2.600 . 3.400 2.173 1.880 2.434     .  0 0 "[    .    1    .    2    .    3]" 1 
       1485 1 55 LEU QD   1 56 LEU QB   2.400 . 3.100 2.939 2.775 2.984     .  0 0 "[    .    1    .    2    .    3]" 1 
       1486 1 56 LEU HA   1 56 LEU QB   2.400 . 3.100 2.363 2.149 2.504     .  0 0 "[    .    1    .    2    .    3]" 1 
       1487 1 56 LEU HA   1 56 LEU MD1  2.300 . 5.500 2.898 1.902 3.888     .  0 0 "[    .    1    .    2    .    3]" 1 
       1488 1 57 HIS HA   1 60 GLU QB   2.500 . 3.300 2.907 2.096 3.252     .  0 0 "[    .    1    .    2    .    3]" 1 
       1489 1 57 HIS HA   1 57 HIS HB2  2.300 . 3.000 2.810 2.482 3.009 0.009 21 0 "[    .    1    .    2    .    3]" 1 
       1490 1 57 HIS HA   1 57 HIS HB3  2.500 . 3.300 2.846 2.582 3.028     .  0 0 "[    .    1    .    2    .    3]" 1 
       1491 1 58 MET HA   1 65 LEU HA   2.800 . 3.800 3.616 3.183 3.807 0.007 23 0 "[    .    1    .    2    .    3]" 1 
       1492 1 58 MET HA   1 61 SER QB   2.500 . 3.300 2.843 2.421 3.166     .  0 0 "[    .    1    .    2    .    3]" 1 
       1493 1 58 MET HA   1 65 LEU QD   2.800 . 3.800 3.504 3.205 3.635     .  0 0 "[    .    1    .    2    .    3]" 1 
       1494 1 58 MET HA   1 65 LEU HB2  2.700 . 3.600 1.988 1.777 2.539 0.023 24 0 "[    .    1    .    2    .    3]" 1 
       1495 1 58 MET HA   1 58 MET HB3  2.700 . 3.600 2.539 2.485 2.593     .  0 0 "[    .    1    .    2    .    3]" 1 
       1496 1 58 MET HA   1 58 MET QG   2.300 . 3.000 2.864 2.579 2.990     .  0 0 "[    .    1    .    2    .    3]" 1 
       1497 1 58 MET QB   1 59 LEU HA   2.700 . 5.500 3.852 3.776 3.927     .  0 0 "[    .    1    .    2    .    3]" 1 
       1498 1 31 LEU HG   1 58 MET QB   2.100 . 5.500 4.831 4.490 5.125     .  0 0 "[    .    1    .    2    .    3]" 1 
       1499 1 58 MET HB2  1 58 MET QG   2.000 . 2.500 2.142 2.131 2.160     .  0 0 "[    .    1    .    2    .    3]" 1 
       1500 1 58 MET HB3  1 65 LEU QD       . . 2.800 2.115 1.810 2.359 0.090  8 0 "[    .    1    .    2    .    3]" 1 
       1501 1 58 MET HA   1 58 MET ME   2.700 . 3.600 2.357 1.938 2.957     .  0 0 "[    .    1    .    2    .    3]" 1 
       1502 1 58 MET ME   1 64 SER HB3  2.500 . 3.300 2.904 1.947 3.307 0.007 12 0 "[    .    1    .    2    .    3]" 1 
       1503 1 58 MET ME   1 67 SER QB   2.800 . 5.500 5.061 4.480 5.520 0.020  8 0 "[    .    1    .    2    .    3]" 1 
       1504 1 58 MET ME   1 65 LEU HA   2.000 . 5.500 2.086 1.580 3.227     .  0 0 "[    .    1    .    2    .    3]" 1 
       1505 1 58 MET ME   1 64 SER HA   3.200 . 5.500 4.380 3.786 5.019     .  0 0 "[    .    1    .    2    .    3]" 1 
       1506 1 58 MET ME   1 58 MET HG2  2.700 . 3.600 2.799 1.989 3.367     .  0 0 "[    .    1    .    2    .    3]" 1 
       1507 1 58 MET ME   1 68 LYS QE   2.700 . 3.600 2.246 1.785 2.890 0.015 13 0 "[    .    1    .    2    .    3]" 1 
       1508 1 59 LEU HA   1 59 LEU HG   2.900 . 4.000 3.260 2.222 4.231 0.231 14 0 "[    .    1    .    2    .    3]" 1 
       1509 1 59 LEU HA   1 59 LEU QB   2.200 . 2.800 2.335 2.126 2.528     .  0 0 "[    .    1    .    2    .    3]" 1 
       1510 1 31 LEU QD   1 59 LEU HA   2.900 . 5.500 3.108 2.792 3.437     .  0 0 "[    .    1    .    2    .    3]" 1 
       1511 1 59 LEU HA   1 65 LEU QD   2.900 . 4.000 3.333 2.387 3.952     .  0 0 "[    .    1    .    2    .    3]" 1 
       1512 1 59 LEU HA   1 59 LEU QD   2.700 . 3.600 2.731 1.730 3.381 0.070  8 0 "[    .    1    .    2    .    3]" 1 
       1513 1 59 LEU QB   1 59 LEU QD       . . 2.800 1.898 1.722 2.093 0.078  5 0 "[    .    1    .    2    .    3]" 1 
       1514 1 59 LEU QD   1 59 LEU HG   2.100 . 2.500 1.876 1.854 1.892     .  0 0 "[    .    1    .    2    .    3]" 1 
       1515 1 24 LEU QD   1 59 LEU QD   2.900 . 4.000 3.671 3.325 3.938     .  0 0 "[    .    1    .    2    .    3]" 1 
       1516 1 59 LEU MD1  1 59 LEU MD2  2.000 . 2.500 2.027 1.873 2.087     .  0 0 "[    .    1    .    2    .    3]" 1 
       1517 1 59 LEU HA   1 60 GLU HA   3.200 . 4.500 4.561 4.522 4.594 0.094 29 0 "[    .    1    .    2    .    3]" 1 
       1518 1 59 LEU QB   1 60 GLU HA   3.400 . 4.800 4.328 3.970 4.620     .  0 0 "[    .    1    .    2    .    3]" 1 
       1519 1 60 GLU HA   1 60 GLU QB   1.900 . 2.400 2.235 2.162 2.321     .  0 0 "[    .    1    .    2    .    3]" 1 
       1520 1 60 GLU HA   1 60 GLU HG2  2.100 . 5.500 3.472 2.548 4.223     .  0 0 "[    .    1    .    2    .    3]" 1 
       1521 1 57 HIS HA   1 60 GLU QG   2.500 . 3.300 2.578 1.697 3.334 0.034 23 0 "[    .    1    .    2    .    3]" 1 
       1522 1 61 SER HA   1 61 SER QB   2.200 . 2.800 2.476 2.417 2.502     .  0 0 "[    .    1    .    2    .    3]" 1 
       1523 1 61 SER HA   1 64 SER HB2  2.000 . 5.500 4.445 4.165 5.454     .  0 0 "[    .    1    .    2    .    3]" 1 
       1524 1 61 SER HA   1 65 LEU HB3  3.500 . 5.000 5.036 4.928 5.249 0.249 20 0 "[    .    1    .    2    .    3]" 1 
       1525 1 61 SER HA   1 63 GLU QB   3.000 . 5.500 4.781 4.553 4.903     .  0 0 "[    .    1    .    2    .    3]" 1 
       1526 1 60 GLU QB   1 61 SER HA   2.900 . 5.500 4.568 4.193 4.905     .  0 0 "[    .    1    .    2    .    3]" 1 
       1527 1 61 SER QB   1 64 SER HB2  2.100 . 2.700 1.946 1.682 3.268 0.568 22 1 "[    .    1    .    2 +  .    3]" 1 
       1528 1 63 GLU HA   1 63 GLU HG3  2.900 . 4.000 3.495 2.636 3.898     .  0 0 "[    .    1    .    2    .    3]" 1 
       1529 1 63 GLU HA   1 63 GLU QB   1.900 . 2.700 2.285 2.144 2.415     .  0 0 "[    .    1    .    2    .    3]" 1 
       1530 1 63 GLU HA   1 66 ARG QD   3.300 . 5.500 5.100 4.610 5.352     .  0 0 "[    .    1    .    2    .    3]" 1 
       1531 1 63 GLU HA   1 64 SER HA   3.300 . 4.700 4.721 4.702 4.732 0.032 23 0 "[    .    1    .    2    .    3]" 1 
       1532 1 64 SER HA   1 64 SER HB3  2.400 . 3.100 2.522 2.356 3.034     .  0 0 "[    .    1    .    2    .    3]" 1 
       1533 1 58 MET QG   1 64 SER HB2  3.400 . 5.500 5.476 5.039 5.898 0.398 29 0 "[    .    1    .    2    .    3]" 1 
       1534 1 65 LEU HA   1 65 LEU HB3  2.600 . 3.400 2.969 2.908 3.005     .  0 0 "[    .    1    .    2    .    3]" 1 
       1535 1 65 LEU HB3  1 65 LEU QD   2.400 . 3.100 2.120 1.932 2.277     .  0 0 "[    .    1    .    2    .    3]" 1 
       1536 1 65 LEU HB3  1 65 LEU HG   2.500 . 3.300 2.592 2.512 2.697     .  0 0 "[    .    1    .    2    .    3]" 1 
       1537 1 65 LEU QD   1 65 LEU HG   2.200 . 2.700 1.867 1.842 1.890     .  0 0 "[    .    1    .    2    .    3]" 1 
       1538 1 65 LEU HG   1 69 VAL QG   2.600 . 5.500 3.905 3.520 4.264     .  0 0 "[    .    1    .    2    .    3]" 1 
       1539 1 31 LEU QD   1 65 LEU HG   4.000 . 5.500 2.425 1.651 3.513 0.349 16 0 "[    .    1    .    2    .    3]" 1 
       1540 1 65 LEU HB2  1 65 LEU HG   2.700 . 3.600 2.538 2.249 3.017     .  0 0 "[    .    1    .    2    .    3]" 1 
       1541 1 65 LEU QD   1 69 VAL HA   3.600 . 5.200 4.342 4.091 4.651     .  0 0 "[    .    1    .    2    .    3]" 1 
       1542 1 61 SER QB   1 65 LEU QD   3.400 . 5.500 4.382 4.146 4.669     .  0 0 "[    .    1    .    2    .    3]" 1 
       1543 1 32 ILE HA   1 65 LEU QD   3.900 . 5.500 5.049 4.853 5.210     .  0 0 "[    .    1    .    2    .    3]" 1 
       1544 1 28 LEU HA   1 65 LEU QD   2.000 . 5.500 4.290 4.101 4.545     .  0 0 "[    .    1    .    2    .    3]" 1 
       1545 1 65 LEU HA   1 65 LEU QD   2.100 . 2.700 2.298 1.947 2.612     .  0 0 "[    .    1    .    2    .    3]" 1 
       1546 1 58 MET HG3  1 65 LEU QD   3.000 . 4.100 2.731 2.011 3.479     .  0 0 "[    .    1    .    2    .    3]" 1 
       1547 1 65 LEU QD   1 69 VAL HB   2.900 . 4.000 2.837 2.599 3.107     .  0 0 "[    .    1    .    2    .    3]" 1 
       1548 1 31 LEU HB3  1 65 LEU QD   2.000 . 2.500 1.793 1.464 2.085 0.036 10 0 "[    .    1    .    2    .    3]" 1 
       1549 1 31 LEU HG   1 65 LEU QD   2.100 . 5.500 3.453 3.256 3.604     .  0 0 "[    .    1    .    2    .    3]" 1 
       1550 1 65 LEU HB2  1 65 LEU QD   2.700 . 3.600 2.388 2.034 2.611     .  0 0 "[    .    1    .    2    .    3]" 1 
       1551 1 65 LEU QD   1 68 LYS HD2  1.800 . 5.500 4.861 2.900 5.890 0.390  5 0 "[    .    1    .    2    .    3]" 1 
       1552 1 65 LEU QD   1 69 VAL QG   2.500 . 2.500 1.789 1.625 1.979     .  0 0 "[    .    1    .    2    .    3]" 1 
       1553 1 31 LEU QD   1 65 LEU QD   2.000 . 2.500 1.540 1.429 1.690 0.071 23 0 "[    .    1    .    2    .    3]" 1 
       1554 1 66 ARG HA   1 66 ARG QD   2.500 . 5.500 3.688 3.138 4.065     .  0 0 "[    .    1    .    2    .    3]" 1 
       1555 1 65 LEU QD   1 66 ARG HA   3.100 . 4.300 2.640 2.123 3.297     .  0 0 "[    .    1    .    2    .    3]" 1 
       1556 1 66 ARG HA   1 69 VAL QG   2.500 . 5.500 3.564 3.474 3.608     .  0 0 "[    .    1    .    2    .    3]" 1 
       1557 1 65 LEU HG   1 66 ARG HA   3.500 . 5.000 4.182 2.621 5.132 0.132 20 0 "[    .    1    .    2    .    3]" 1 
       1558 1 66 ARG HA   1 66 ARG QG   2.200 . 2.800 2.110 2.033 2.200     .  0 0 "[    .    1    .    2    .    3]" 1 
       1559 1 66 ARG HA   1 66 ARG HB2  2.700 . 3.600 2.656 2.552 2.762     .  0 0 "[    .    1    .    2    .    3]" 1 
       1560 1 35 MET ME   1 66 ARG HA   2.300 . 3.000 1.871 1.672 2.081     .  0 0 "[    .    1    .    2    .    3]" 1 
       1561 1 66 ARG QB   1 66 ARG QD   2.300 . 3.000 2.079 1.910 2.430     .  0 0 "[    .    1    .    2    .    3]" 1 
       1562 1 63 GLU HA   1 66 ARG HB3  1.900 . 5.500 3.971 3.657 4.333     .  0 0 "[    .    1    .    2    .    3]" 1 
       1563 1 65 LEU QD   1 66 ARG HB2  3.300 . 4.700 3.129 2.639 3.864     .  0 0 "[    .    1    .    2    .    3]" 1 
       1564 1 66 ARG QB   1 69 VAL QG   3.400 . 5.500 4.918 4.843 4.965     .  0 0 "[    .    1    .    2    .    3]" 1 
       1565 1 66 ARG QD   1 66 ARG QG   2.000 . 2.500 2.035 1.985 2.089     .  0 0 "[    .    1    .    2    .    3]" 1 
       1566 1 66 ARG QG   1 67 SER HA   3.000 . 5.500 4.849 4.175 5.243     .  0 0 "[    .    1    .    2    .    3]" 1 
       1567 1 68 LYS QB   1 68 LYS HD3  2.300 . 5.500 2.734 1.965 3.310     .  0 0 "[    .    1    .    2    .    3]" 1 
       1568 1 68 LYS QB   1 68 LYS HD2  2.200 . 5.500 2.704 1.974 3.309     .  0 0 "[    .    1    .    2    .    3]" 1 
       1569 1 65 LEU QD   1 68 LYS QB   2.500 . 3.300 2.877 2.579 3.216     .  0 0 "[    .    1    .    2    .    3]" 1 
       1570 1 68 LYS QB   2  6 LEU QD   2.900 . 4.000 2.796 1.874 3.495     .  0 0 "[    .    1    .    2    .    3]" 1 
       1571 1 68 LYS QB   1 69 VAL QG   3.600 . 5.200 2.984 2.804 3.256     .  0 0 "[    .    1    .    2    .    3]" 1 
       1572 1 38 THR MG   1 73 VAL HB   2.900 . 4.000 3.053 2.024 4.077 0.077 21 0 "[    .    1    .    2    .    3]" 1 
       1573 1 65 LEU HG   1 68 LYS QB   3.100 . 5.500 5.138 4.828 5.353     .  0 0 "[    .    1    .    2    .    3]" 1 
       1574 1 68 LYS QB   1 68 LYS QE   3.100 . 3.800 2.320 1.841 2.753 0.059 16 0 "[    .    1    .    2    .    3]" 1 
       1575 1 68 LYS QB   1 69 VAL HA   3.300 . 4.700 3.845 3.611 4.338     .  0 0 "[    .    1    .    2    .    3]" 1 
       1576 1 65 LEU HA   1 68 LYS QB   2.800 . 3.800 2.664 2.421 2.991     .  0 0 "[    .    1    .    2    .    3]" 1 
       1577 1 70 ASP HA   1 73 VAL HB   2.100 . 5.500 4.516 3.157 5.524 0.024 29 0 "[    .    1    .    2    .    3]" 1 
       1578 1 68 LYS QG   2  6 LEU QD   2.600 . 3.400 1.925 1.616 2.579 0.284 12 0 "[    .    1    .    2    .    3]" 1 
       1579 1 50 ILE MD   1 68 LYS QG   3.200 . 4.500 3.795 2.903 4.312     .  0 0 "[    .    1    .    2    .    3]" 1 
       1580 1 65 LEU QD   1 68 LYS QE   2.700 . 3.600 3.395 2.802 3.538     .  0 0 "[    .    1    .    2    .    3]" 1 
       1581 1 68 LYS QE   1 68 LYS QG   2.500 . 4.000 2.414 2.112 2.800     .  0 0 "[    .    1    .    2    .    3]" 1 
       1582 1 68 LYS HD2  1 68 LYS QE   2.500 . 3.000 2.271 2.142 2.519     .  0 0 "[    .    1    .    2    .    3]" 1 
       1583 1 68 LYS HD3  1 68 LYS QE   2.400 . 3.100 2.341 2.138 2.529     .  0 0 "[    .    1    .    2    .    3]" 1 
       1584 1 69 VAL HA   1 72 ALA HA   3.400 . 4.800 4.212 4.124 4.354     .  0 0 "[    .    1    .    2    .    3]" 1 
       1585 1 69 VAL HA   1 69 VAL QG   2.100 . 2.700 2.113 2.065 2.155     .  0 0 "[    .    1    .    2    .    3]" 1 
       1586 1 69 VAL HA   1 72 ALA MB   2.300 . 5.500 1.560 1.475 1.801     .  0 0 "[    .    1    .    2    .    3]" 1 
       1587 1 69 VAL HA   1 69 VAL HB   2.500 . 3.300 3.011 3.005 3.017     .  0 0 "[    .    1    .    2    .    3]" 1 
       1588 1 66 ARG HA   1 69 VAL HB   2.300 . 3.000 2.896 2.797 2.965     .  0 0 "[    .    1    .    2    .    3]" 1 
       1589 1 69 VAL HB   1 73 VAL QG   3.300 . 4.700 4.512 4.302 4.658     .  0 0 "[    .    1    .    2    .    3]" 1 
       1590 1 32 ILE MG   1 69 VAL HB   4.200 . 5.500 4.314 4.208 4.476     .  0 0 "[    .    1    .    2    .    3]" 1 
       1591 1 31 LEU QD   1 69 VAL HB   3.500 . 5.000 3.756 3.329 3.975     .  0 0 "[    .    1    .    2    .    3]" 1 
       1592 1 69 VAL HB   1 69 VAL QG   2.100 . 2.700 1.866 1.856 1.886     .  0 0 "[    .    1    .    2    .    3]" 1 
       1593 1 66 ARG QG   1 69 VAL HB   3.700 . 5.400 3.966 3.807 4.165     .  0 0 "[    .    1    .    2    .    3]" 1 
       1594 1 69 VAL QG   1 70 ASP HA   3.100 . 4.300 3.663 3.410 3.748     .  0 0 "[    .    1    .    2    .    3]" 1 
       1595 1 69 VAL QG   1 73 VAL QG   2.000 . 2.500 2.438 2.336 2.522 0.022  9 0 "[    .    1    .    2    .    3]" 1 
       1596 1 69 VAL MG1  1 69 VAL MG2  1.900 . 2.400 1.934 1.869 2.071     .  0 0 "[    .    1    .    2    .    3]" 1 
       1597 1 31 LEU HB2  1 69 VAL QG   2.800 . 2.800 2.330 2.081 2.677     .  0 0 "[    .    1    .    2    .    3]" 1 
       1598 1 34 ALA MB   1 69 VAL QG   3.400 . 5.500 4.975 4.645 5.142     .  0 0 "[    .    1    .    2    .    3]" 1 
       1599 1 66 ARG QG   1 69 VAL QG   3.100 . 4.300 4.005 3.935 4.078     .  0 0 "[    .    1    .    2    .    3]" 1 
       1600 1 35 MET HB2  1 69 VAL QG   2.900 . 4.000 3.147 2.964 3.445     .  0 0 "[    .    1    .    2    .    3]" 1 
       1601 1 35 MET HG2  1 69 VAL QG   3.200 . 4.500 4.122 3.316 4.300     .  0 0 "[    .    1    .    2    .    3]" 1 
       1602 1 65 LEU HA   1 69 VAL QG   3.300 . 4.700 4.299 4.153 4.461     .  0 0 "[    .    1    .    2    .    3]" 1 
       1603 1 70 ASP HA   1 73 VAL QG   2.600 . 3.400 2.865 2.483 3.283     .  0 0 "[    .    1    .    2    .    3]" 1 
       1604 1 70 ASP HA   1 72 ALA MB   3.300 . 4.700 4.633 4.504 4.708 0.008  7 0 "[    .    1    .    2    .    3]" 1 
       1605 1 70 ASP HA   1 70 ASP HB3  2.200 . 5.500 3.025 3.017 3.033     .  0 0 "[    .    1    .    2    .    3]" 1 
       1606 1 70 ASP HA   1 70 ASP HB2  2.400 . 3.100 2.429 2.376 2.558     .  0 0 "[    .    1    .    2    .    3]" 1 
       1607 1 67 SER HA   1 70 ASP HB2  2.700 . 3.600 2.687 2.256 3.116     .  0 0 "[    .    1    .    2    .    3]" 1 
       1608 1 69 VAL QG   1 70 ASP HB2  4.100 . 5.500 4.847 4.674 4.939     .  0 0 "[    .    1    .    2    .    3]" 1 
       1609 1 67 SER HA   1 70 ASP HB3  2.700 . 3.600 2.686 2.426 2.958     .  0 0 "[    .    1    .    2    .    3]" 1 
       1610 1 69 VAL QG   1 70 ASP HB3  4.300 . 5.500 5.140 5.066 5.213     .  0 0 "[    .    1    .    2    .    3]" 1 
       1611 1 71 GLU HA   1 73 VAL QG   3.300 . 5.500 4.353 3.760 5.032     .  0 0 "[    .    1    .    2    .    3]" 1 
       1612 1 71 GLU HA   1 75 VAL QG   3.200 . 4.500 4.188 4.051 4.425     .  0 0 "[    .    1    .    2    .    3]" 1 
       1613 1 71 GLU HA   1 74 ALA MB   2.100 . 2.700 2.440 2.199 2.660     .  0 0 "[    .    1    .    2    .    3]" 1 
       1614 1 71 GLU HA   1 71 GLU HB2  2.100 . 2.700 2.553 2.513 2.590     .  0 0 "[    .    1    .    2    .    3]" 1 
       1615 1 71 GLU QB   2  6 LEU QD   2.700 . 5.500 2.201 1.832 2.709     .  0 0 "[    .    1    .    2    .    3]" 1 
       1616 1 71 GLU HB3  2  6 LEU QD   2.900 . 4.000 2.243 1.852 2.782     .  0 0 "[    .    1    .    2    .    3]" 1 
       1617 1 71 GLU HB3  1 75 VAL QG   3.800 . 5.500 3.933 3.766 4.180     .  0 0 "[    .    1    .    2    .    3]" 1 
       1618 1 71 GLU HB3  2  6 LEU QB   3.400 . 4.800 3.592 1.995 4.696 0.005  4 0 "[    .    1    .    2    .    3]" 1 
       1619 1 71 GLU HG3  1 75 VAL HA   3.700 . 5.500 5.638 5.174 6.188 0.688  7 8 "[ *  .*+- 1*   .   **   *.    3]" 1 
       1620 1 71 GLU HA   1 71 GLU HG3  2.900 . 4.000 2.342 2.239 2.451     .  0 0 "[    .    1    .    2    .    3]" 1 
       1621 1 71 GLU HG3  2  6 LEU QD   3.600 . 5.200 4.246 3.734 4.819     .  0 0 "[    .    1    .    2    .    3]" 1 
       1622 1 71 GLU HG3  1 75 VAL QG   3.000 . 4.100 3.583 3.170 3.982     .  0 0 "[    .    1    .    2    .    3]" 1 
       1623 1 71 GLU HG3  1 74 ALA MB   3.400 . 4.800 2.720 2.451 3.137     .  0 0 "[    .    1    .    2    .    3]" 1 
       1624 1 71 GLU HA   1 71 GLU HG2  2.600 . 5.500 3.457 3.170 3.678     .  0 0 "[    .    1    .    2    .    3]" 1 
       1625 1 71 GLU HG2  2  6 LEU QD   2.600 . 5.400 3.252 2.430 3.955     .  0 0 "[    .    1    .    2    .    3]" 1 
       1626 1 71 GLU HG2  1 75 VAL QG   2.900 . 4.000 3.313 2.865 3.973     .  0 0 "[    .    1    .    2    .    3]" 1 
       1627 1 71 GLU HG2  1 74 ALA MB   2.900 . 4.000 3.865 3.499 4.043 0.043 10 0 "[    .    1    .    2    .    3]" 1 
       1628 1 71 GLU HG2  2  6 LEU QB   4.300 . 5.500 3.767 2.390 5.103     .  0 0 "[    .    1    .    2    .    3]" 1 
       1629 1 72 ALA HA   1 75 VAL QG   2.700 . 3.600 1.637 1.531 1.894 0.269 11 0 "[    .    1    .    2    .    3]" 1 
       1630 1 43 ILE MG   1 72 ALA HA   2.300 . 3.000 3.085 3.031 3.143 0.143 10 0 "[    .    1    .    2    .    3]" 1 
       1631 1 69 VAL QG   1 72 ALA HA   2.900 . 5.500 4.474 4.342 4.583     .  0 0 "[    .    1    .    2    .    3]" 1 
       1632 1 72 ALA HA   1 72 ALA MB   1.900 . 2.400 2.090 2.080 2.109     .  0 0 "[    .    1    .    2    .    3]" 1 
       1633 1 72 ALA HA   1 75 VAL HB   2.300 . 5.500 4.400 2.116 4.549     .  0 0 "[    .    1    .    2    .    3]" 1 
       1634 1 71 GLU HB3  1 72 ALA HA   3.000 . 4.100 4.123 4.103 4.150 0.050 22 0 "[    .    1    .    2    .    3]" 1 
       1635 1 72 ALA MB   1 73 VAL HA   3.200 . 4.500 3.768 3.714 3.837     .  0 0 "[    .    1    .    2    .    3]" 1 
       1636 1 71 GLU HG3  1 72 ALA MB   3.400 . 5.500 5.694 5.440 6.008 0.508  6 1 "[    .+   1    .    2    .    3]" 1 
       1637 1 72 ALA MB   1 75 VAL HB   2.800 . 5.500 5.428 3.147 5.559 0.059  1 0 "[    .    1    .    2    .    3]" 1 
       1638 1 35 MET ME   1 72 ALA MB   2.700 . 5.500 4.657 4.452 4.779     .  0 0 "[    .    1    .    2    .    3]" 1 
       1639 1 43 ILE MG   1 72 ALA MB   1.800 . 2.200 1.808 1.708 1.886     .  0 0 "[    .    1    .    2    .    3]" 1 
       1640 1 69 VAL QG   1 72 ALA MB   2.400 . 2.800 2.111 1.929 2.310     .  0 0 "[    .    1    .    2    .    3]" 1 
       1641 1 47 LEU HB2  1 72 ALA MB   3.100 . 4.300 3.790 3.377 4.329 0.029 22 0 "[    .    1    .    2    .    3]" 1 
       1642 1 73 VAL HA   1 77 GLN QG   3.800 . 5.500 5.063 4.687 5.330     .  0 0 "[    .    1    .    2    .    3]" 1 
       1643 1 73 VAL HA   1 73 VAL HB   2.400 . 3.100 2.631 2.318 3.017     .  0 0 "[    .    1    .    2    .    3]" 1 
       1644 1 73 VAL HA   1 76 LEU QB   2.700 . 3.600 3.143 2.905 3.546     .  0 0 "[    .    1    .    2    .    3]" 1 
       1645 1 43 ILE MD   1 73 VAL HA   2.000 . 2.500 1.706 1.490 2.044 0.010  8 0 "[    .    1    .    2    .    3]" 1 
       1646 1 73 VAL HA   1 76 LEU QD   2.900 . 5.500 3.597 1.746 4.618     .  0 0 "[    .    1    .    2    .    3]" 1 
       1647 1 69 VAL QG   1 73 VAL HA   3.300 . 4.700 4.373 4.238 4.539     .  0 0 "[    .    1    .    2    .    3]" 1 
       1648 1 73 VAL HA   1 75 VAL QG   2.500 . 5.500 3.933 3.673 4.931     .  0 0 "[    .    1    .    2    .    3]" 1 
       1649 1 73 VAL QG   1 74 ALA MB   2.900 . 4.000 3.298 2.863 3.851     .  0 0 "[    .    1    .    2    .    3]" 1 
       1650 1 73 VAL QG   1 77 GLN QB   3.200 . 4.500 4.295 4.233 4.374     .  0 0 "[    .    1    .    2    .    3]" 1 
       1651 1 73 VAL QG   1 77 GLN QG   3.200 . 4.000 3.383 2.892 3.684     .  0 0 "[    .    1    .    2    .    3]" 1 
       1652 1 73 VAL MG1  1 73 VAL MG2  1.900 . 2.400 2.067 1.989 2.098     .  0 0 "[    .    1    .    2    .    3]" 1 
       1653 1 73 VAL QG   1 74 ALA HA   2.600 . 3.400 3.090 2.823 3.377     .  0 0 "[    .    1    .    2    .    3]" 1 
       1654 1 74 ALA HA   1 76 LEU QD   3.600 . 5.200 5.064 5.022 5.132     .  0 0 "[    .    1    .    2    .    3]" 1 
       1655 1 74 ALA HA   1 74 ALA MB   1.800 . 2.200 2.119 2.084 2.129     .  0 0 "[    .    1    .    2    .    3]" 1 
       1656 1 74 ALA HA   1 77 GLN QB   2.300 . 4.000 2.631 2.092 3.703     .  0 0 "[    .    1    .    2    .    3]" 1 
       1657 1 74 ALA HA   1 77 GLN QG   2.900 . 4.000 2.928 1.811 3.396 0.089 20 0 "[    .    1    .    2    .    3]" 1 
       1658 1 74 ALA MB   1 75 VAL HA   2.100 . 5.500 3.824 3.722 3.931     .  0 0 "[    .    1    .    2    .    3]" 1 
       1659 1 74 ALA MB   1 77 GLN QB   2.600 . 5.500 3.753 3.189 4.836     .  0 0 "[    .    1    .    2    .    3]" 1 
       1660 1 74 ALA MB   1 77 GLN QG   3.700 . 5.400 4.098 3.091 4.520     .  0 0 "[    .    1    .    2    .    3]" 1 
       1661 1 74 ALA MB   1 75 VAL QG   2.700 . 3.300 3.092 2.962 3.321 0.021  4 0 "[    .    1    .    2    .    3]" 1 
       1662 1 75 VAL HA   1 75 VAL QG   2.200 . 5.500 2.473 2.158 2.510     .  0 0 "[    .    1    .    2    .    3]" 1 
       1663 1 75 VAL HA   1 78 ALA MB   2.200 . 2.800 2.723 2.587 2.827 0.027 29 0 "[    .    1    .    2    .    3]" 1 
       1664 1 46 MET ME   1 75 VAL HA   3.800 . 5.500 4.435 3.954 5.159     .  0 0 "[    .    1    .    2    .    3]" 1 
       1665 1 75 VAL HA   1 75 VAL HB   2.500 . 3.300 2.316 2.276 3.005     .  0 0 "[    .    1    .    2    .    3]" 1 
       1666 1 75 VAL HB   1 75 VAL QG   2.100 . 2.500 1.871 1.854 1.892     .  0 0 "[    .    1    .    2    .    3]" 1 
       1667 1 75 VAL QG   1 76 LEU HA   2.600 . 3.400 2.964 2.607 3.374     .  0 0 "[    .    1    .    2    .    3]" 1 
       1668 1 75 VAL QG   1 79 HIS HA   2.100 . 5.500 5.300 5.139 5.367     .  0 0 "[    .    1    .    2    .    3]" 1 
       1669 1 47 LEU HB2  1 75 VAL QG   2.500 . 5.500 4.787 4.463 5.037     .  0 0 "[    .    1    .    2    .    3]" 1 
       1670 1 42 LYS QG   1 75 VAL QG   3.000 . 5.500 4.488 3.872 4.869     .  0 0 "[    .    1    .    2    .    3]" 1 
       1671 1 72 ALA MB   1 75 VAL QG   2.700 . 3.600 2.894 2.759 2.977     .  0 0 "[    .    1    .    2    .    3]" 1 
       1672 1 43 ILE HB   1 75 VAL QG   2.100 . 5.500 4.746 4.453 4.910     .  0 0 "[    .    1    .    2    .    3]" 1 
       1673 1 75 VAL QG   1 79 HIS HB2  2.800 . 5.500 3.587 3.249 3.961     .  0 0 "[    .    1    .    2    .    3]" 1 
       1674 1 76 LEU QB   1 76 LEU QD   2.300 . 3.000 1.929 1.742 2.041 0.058 21 0 "[    .    1    .    2    .    3]" 1 
       1675 1 77 GLN HA   1 77 GLN QG   2.200 . 5.500 2.773 2.318 3.424     .  0 0 "[    .    1    .    2    .    3]" 1 
       1676 1 76 LEU QB   1 77 GLN QG   4.200 . 5.500 3.591 3.187 4.264     .  0 0 "[    .    1    .    2    .    3]" 1 
       1677 1 79 HIS HA   1 83 GLU QB   3.100 . 4.300 4.030 2.390 4.267     .  0 0 "[    .    1    .    2    .    3]" 1 
       1678 1 76 LEU HA   1 79 HIS HB3  2.700 . 3.600 2.577 2.078 3.433     .  0 0 "[    .    1    .    2    .    3]" 1 
       1679 1 79 HIS HA   1 79 HIS HB3  2.600 . 3.400 3.013 2.928 3.036     .  0 0 "[    .    1    .    2    .    3]" 1 
       1680 1 78 ALA MB   1 79 HIS HB3  4.300 . 5.500 5.073 4.766 5.511 0.011 24 0 "[    .    1    .    2    .    3]" 1 
       1681 1 42 LYS HB3  1 79 HIS HB3  3.800 . 5.500 5.585 5.373 6.128 0.628 26 1 "[    .    1    .    2    .+   3]" 1 
       1682 1 76 LEU HA   1 79 HIS HB2  3.100 . 4.300 2.491 2.039 3.360     .  0 0 "[    .    1    .    2    .    3]" 1 
       1683 1 79 HIS HA   1 79 HIS HB2  2.400 . 3.100 2.535 2.371 2.764     .  0 0 "[    .    1    .    2    .    3]" 1 
       1684 1 80 GLN HA   1 80 GLN HG3  2.600 . 3.400 2.955 2.170 3.444 0.044 19 0 "[    .    1    .    2    .    3]" 1 
       1685 1 80 GLN HA   1 80 GLN HG2  2.400 . 3.100 2.576 2.103 3.539 0.439 24 0 "[    .    1    .    2    .    3]" 1 
       1686 1 80 GLN HA   1 80 GLN HB3  2.200 . 2.800 2.632 2.381 2.941 0.141 21 0 "[    .    1    .    2    .    3]" 1 
       1687 1 80 GLN HA   1 80 GLN HB2  2.200 . 5.500 2.925 2.259 3.024     .  0 0 "[    .    1    .    2    .    3]" 1 
       1688 1 80 GLN HA   1 83 GLU QB   2.300 . 5.500 2.558 2.016 3.829     .  0 0 "[    .    1    .    2    .    3]" 1 
       1689 1 80 GLN HA   1 84 ALA MB   3.500 . 5.000 3.893 2.868 4.668     .  0 0 "[    .    1    .    2    .    3]" 1 
       1690 1 80 GLN HA   1 81 ALA MB   3.700 . 5.400 4.904 4.817 5.021     .  0 0 "[    .    1    .    2    .    3]" 1 
       1691 1 80 GLN HB3  1 81 ALA MB   3.800 . 5.500 4.884 3.728 5.444     .  0 0 "[    .    1    .    2    .    3]" 1 
       1692 1 80 GLN HB2  1 81 ALA MB   3.800 . 5.500 4.624 3.942 5.428     .  0 0 "[    .    1    .    2    .    3]" 1 
       1693 1 80 GLN HB2  1 84 ALA MB   3.800 . 5.500 4.976 4.148 5.540 0.040 19 0 "[    .    1    .    2    .    3]" 1 
       1694 1 80 GLN HB3  1 84 ALA MB   4.300 . 5.500 3.868 2.980 5.483     .  0 0 "[    .    1    .    2    .    3]" 1 
    stop_

save_


save_distance_constraint_statistics_2
    _Distance_constraint_stats_list.Sf_category                   distance_constraint_statistics
    _Distance_constraint_stats_list.Constraint_list_ID            2
    _Distance_constraint_stats_list.Constraint_count              102
    _Distance_constraint_stats_list.Viol_count                    344
    _Distance_constraint_stats_list.Viol_total                    589.451
    _Distance_constraint_stats_list.Viol_max                      0.739
    _Distance_constraint_stats_list.Viol_rms                      0.0349
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0064
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0571
    _Distance_constraint_stats_list.Cutoff_violation_report       0.500
    _Distance_constraint_stats_list.Details                       .

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

       1 20 GLN 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 21 LYS 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 25 GLY 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 26 GLU 0.023 0.014 12 0 "[    .    1    .    2    .    3]" 
       1 28 LEU 0.732 0.090 22 0 "[    .    1    .    2    .    3]" 
       1 29 PHE 2.565 0.108 26 0 "[    .    1    .    2    .    3]" 
       1 40 ALA 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 41 GLY 0.868 0.108 26 0 "[    .    1    .    2    .    3]" 
       1 42 LYS 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 44 THR 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 46 MET 0.603 0.150 14 0 "[    .    1    .    2    .    3]" 
       1 47 LEU 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 48 LEU 0.309 0.050 29 0 "[    .    1    .    2    .    3]" 
       1 50 ILE 0.552 0.046 21 0 "[    .    1    .    2    .    3]" 
       1 68 LYS 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 69 VAL 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 70 ASP 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 71 GLU 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       1 75 VAL 0.666 0.164  4 0 "[    .    1    .    2    .    3]" 
       2  2 VAL 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       2  4 SER 1.220 0.276  4 0 "[    .    1    .    2    .    3]" 
       2  5 ASN 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       2  6 LEU 0.227 0.099 13 0 "[    .    1    .    2    .    3]" 
       2  7 ASN 2.837 0.112 28 0 "[    .    1    .    2    .    3]" 
       2  8 PRO 1.940 0.112 28 0 "[    .    1    .    2    .    3]" 
       2  9 ASN 0.270 0.024 23 0 "[    .    1    .    2    .    3]" 
       2 10 ALA 2.835 0.276  4 0 "[    .    1    .    2    .    3]" 
       2 11 LYS 2.741 0.739 27 3 "[    .    1    -    2    . +* 3]" 
       2 12 GLU 0.007 0.007 26 0 "[    .    1    .    2    .    3]" 
       2 13 PHE 3.756 0.090 22 0 "[    .    1    .    2    .    3]" 
       2 14 VAL 0.020 0.013 28 0 "[    .    1    .    2    .    3]" 
       2 17 VAL 0.000 0.000  . 0 "[    .    1    .    2    .    3]" 
       2 18 LYS 0.613 0.056 23 0 "[    .    1    .    2    .    3]" 
       2 19 TYR 7.652 0.338 14 0 "[    .    1    .    2    .    3]" 
       2 20 GLY 6.419 0.338 14 0 "[    .    1    .    2    .    3]" 
       2 21 ASN 0.037 0.037  4 0 "[    .    1    .    2    .    3]" 
    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 75 VAL QG   2  4 SER HA  4.100 . 5.500 3.706 2.713 4.962     .  0 0 "[    .    1    .    2    .    3]" 2 
         2 1 75 VAL QG   2  4 SER QB  2.900 . 5.500 3.449 2.618 3.963     .  0 0 "[    .    1    .    2    .    3]" 2 
         3 1 47 LEU QD   2  4 SER QB  4.600 . 5.500 3.543 2.822 3.905     .  0 0 "[    .    1    .    2    .    3]" 2 
         4 2  2 VAL QG   2  4 SER QB  5.100 . 5.500 3.849 2.309 5.051     .  0 0 "[    .    1    .    2    .    3]" 2 
         5 2  5 ASN HA   2  5 ASN QB  2.200 . 2.800 2.447 2.207 2.542     .  0 0 "[    .    1    .    2    .    3]" 2 
         6 2  5 ASN HB2  2  6 LEU HB2 5.000 . 5.500 4.025 3.537 4.710     .  0 0 "[    .    1    .    2    .    3]" 2 
         7 2  6 LEU HA   2  6 LEU QD  2.900 . 4.000 2.147 1.901 2.585 0.099 13 0 "[    .    1    .    2    .    3]" 2 
         8 1 70 ASP HB3  2  6 LEU QD  4.100 . 5.500 5.072 4.746 5.424     .  0 0 "[    .    1    .    2    .    3]" 2 
         9 1 68 LYS QE   2  6 LEU QD  3.400 . 4.800 3.343 2.441 4.009     .  0 0 "[    .    1    .    2    .    3]" 2 
        10 1 71 GLU HA   2  6 LEU QD  3.600 . 5.200 4.571 4.126 5.002     .  0 0 "[    .    1    .    2    .    3]" 2 
        11 1 69 VAL QG   2  6 LEU QD  2.300 . 5.500 3.705 3.268 4.439     .  0 0 "[    .    1    .    2    .    3]" 2 
        12 1 75 VAL QG   2  6 LEU QD  3.200 . 4.500 3.537 2.764 4.259     .  0 0 "[    .    1    .    2    .    3]" 2 
        13 2  6 LEU HB3  2  6 LEU QD  2.100 . 2.700 2.216 2.025 2.517     .  0 0 "[    .    1    .    2    .    3]" 2 
        14 1 68 LYS HD3  2  6 LEU QD  2.600 . 5.500 3.148 2.036 4.434     .  0 0 "[    .    1    .    2    .    3]" 2 
        15 2  7 ASN HA   2  7 ASN HB3 2.800 . 3.800 2.954 2.907 2.973     .  0 0 "[    .    1    .    2    .    3]" 2 
        16 2  7 ASN HA   2  7 ASN HB2 2.900 . 4.000 2.714 2.679 2.783     .  0 0 "[    .    1    .    2    .    3]" 2 
        17 2  4 SER QB   2  7 ASN HA  2.600 . 5.500 4.937 4.719 5.159     .  0 0 "[    .    1    .    2    .    3]" 2 
        18 2  7 ASN HA   2  8 PRO HA  2.500 . 5.500 4.464 4.438 4.499     .  0 0 "[    .    1    .    2    .    3]" 2 
        19 1 47 LEU QD   2  7 ASN HA  4.200 . 5.500 3.701 3.414 3.860     .  0 0 "[    .    1    .    2    .    3]" 2 
        20 1 50 ILE HG13 2  7 ASN HA  4.400 . 5.500 5.500 5.275 5.546 0.046 21 0 "[    .    1    .    2    .    3]" 2 
        21 2  7 ASN HB2  2 10 ALA MB  3.300 . 4.700 4.666 3.924 4.730 0.030  6 0 "[    .    1    .    2    .    3]" 2 
        22 2  4 SER QB   2  7 ASN HB2 3.700 . 5.400 4.816 4.337 5.089     .  0 0 "[    .    1    .    2    .    3]" 2 
        23 2  7 ASN HB3  2  8 PRO HA  3.400 . 4.800 4.865 4.842 4.912 0.112 28 0 "[    .    1    .    2    .    3]" 2 
        24 2 10 ALA HA   2 11 LYS QG  4.300 . 5.500 3.927 3.516 5.352     .  0 0 "[    .    1    .    2    .    3]" 2 
        25 2  9 ASN HB3  2 10 ALA HA  4.600 . 5.500 5.265 5.076 5.462     .  0 0 "[    .    1    .    2    .    3]" 2 
        26 1 46 MET QG   2 10 ALA HA  4.500 . 5.500 4.511 4.042 5.002     .  0 0 "[    .    1    .    2    .    3]" 2 
        27 2  9 ASN HA   2 10 ALA HA  4.200 . 5.500 4.702 4.631 4.781     .  0 0 "[    .    1    .    2    .    3]" 2 
        28 1 47 LEU QD   2 10 ALA MB  3.000 . 4.100 3.150 2.572 3.413     .  0 0 "[    .    1    .    2    .    3]" 2 
        29 2  2 VAL QG   2 10 ALA MB  2.700 . 5.500 3.215 1.775 5.496     .  0 0 "[    .    1    .    2    .    3]" 2 
        30 1 46 MET ME   2 10 ALA MB  2.900 . 4.000 3.053 2.015 4.050 0.050  6 0 "[    .    1    .    2    .    3]" 2 
        31 1 46 MET QB   2 10 ALA MB  2.800 . 3.800 1.874 1.650 2.062 0.150 14 0 "[    .    1    .    2    .    3]" 2 
        32 1 75 VAL HB   2 10 ALA MB  3.200 . 4.500 4.427 4.052 4.664 0.164  4 0 "[    .    1    .    2    .    3]" 2 
        33 1 46 MET QG   2 10 ALA MB  2.400 . 4.000 3.515 3.344 3.650     .  0 0 "[    .    1    .    2    .    3]" 2 
        34 2  7 ASN HB3  2 10 ALA MB  2.900 . 4.000 3.568 3.058 3.664     .  0 0 "[    .    1    .    2    .    3]" 2 
        35 2  4 SER QB   2 10 ALA MB  3.100 . 4.300 1.952 1.624 2.253 0.276  4 0 "[    .    1    .    2    .    3]" 2 
        36 1 46 MET HA   2 10 ALA MB  2.200 . 5.500 3.416 3.030 3.700     .  0 0 "[    .    1    .    2    .    3]" 2 
        37 2 10 ALA HA   2 10 ALA MB  2.200 . 2.800 2.105 2.078 2.125     .  0 0 "[    .    1    .    2    .    3]" 2 
        38 2 11 LYS HA   2 11 LYS HG2 2.600 . 3.400 2.977 2.589 4.139 0.739 27 3 "[    .    1    -    2    . +* 3]" 2 
        39 2 11 LYS HA   2 11 LYS QB  2.200 . 2.800 2.241 2.143 2.315     .  0 0 "[    .    1    .    2    .    3]" 2 
        40 2 11 LYS HA   2 11 LYS QE  4.400 . 5.500 4.642 4.222 5.424     .  0 0 "[    .    1    .    2    .    3]" 2 
        41 2 12 GLU HA   2 12 GLU QG  2.700 . 3.600 2.279 1.996 2.634     .  0 0 "[    .    1    .    2    .    3]" 2 
        42 2 12 GLU HA   2 14 VAL QG  3.200 . 5.500 4.403 3.960 4.988     .  0 0 "[    .    1    .    2    .    3]" 2 
        43 1 42 LYS QG   2 12 GLU HA  4.200 . 5.500 5.002 3.910 5.187     .  0 0 "[    .    1    .    2    .    3]" 2 
        44 2 12 GLU HA   2 12 GLU QB  2.400 . 3.100 2.446 2.270 2.539     .  0 0 "[    .    1    .    2    .    3]" 2 
        45 2 12 GLU HB3  2 14 VAL QG  3.100 . 4.300 2.785 1.893 4.194 0.007 26 0 "[    .    1    .    2    .    3]" 2 
        46 2 13 PHE HA   2 13 PHE HB2 2.900 . 4.000 2.603 2.507 2.713     .  0 0 "[    .    1    .    2    .    3]" 2 
        47 2 13 PHE HA   2 13 PHE HB3 3.000 . 4.100 3.007 2.960 3.026     .  0 0 "[    .    1    .    2    .    3]" 2 
        48 2 14 VAL HB   2 14 VAL QG  2.100 . 2.500 1.879 1.858 1.894     .  0 0 "[    .    1    .    2    .    3]" 2 
        49 2 12 GLU QG   2 14 VAL QG  3.300 . 4.600 3.811 2.849 4.310     .  0 0 "[    .    1    .    2    .    3]" 2 
        50 2 14 VAL HA   2 14 VAL QG  2.100 . 2.700 2.214 2.019 2.591     .  0 0 "[    .    1    .    2    .    3]" 2 
        51 2 13 PHE HA   2 14 VAL QG  3.100 . 4.300 3.518 3.212 3.822     .  0 0 "[    .    1    .    2    .    3]" 2 
        52 2 17 VAL HA   2 17 VAL HB  2.700 . 3.600 2.578 2.411 2.977     .  0 0 "[    .    1    .    2    .    3]" 2 
        53 2 17 VAL HA   2 17 VAL QG  2.300 . 3.000 2.166 1.960 2.344     .  0 0 "[    .    1    .    2    .    3]" 2 
        54 1 21 LYS QE   2 17 VAL MG1 3.700 . 5.400 4.133 2.311 5.246     .  0 0 "[    .    1    .    2    .    3]" 2 
        55 2 18 LYS HA   2 18 LYS QG  2.800 . 3.800 2.725 2.050 3.411     .  0 0 "[    .    1    .    2    .    3]" 2 
        56 2 18 LYS HA   2 18 LYS QD  3.000 . 4.100 3.800 3.387 4.091     .  0 0 "[    .    1    .    2    .    3]" 2 
        57 2 18 LYS HA   2 19 TYR HB3 4.800 . 5.500 5.053 4.858 5.350     .  0 0 "[    .    1    .    2    .    3]" 2 
        58 2 19 TYR HA   2 19 TYR HB2 2.600 . 3.400 2.678 2.566 2.850     .  0 0 "[    .    1    .    2    .    3]" 2 
        59 2 19 TYR HA   2 19 TYR HB3 2.700 . 3.600 2.972 2.856 3.016     .  0 0 "[    .    1    .    2    .    3]" 2 
        60 2 19 TYR HB2  2 20 GLY HA3 4.100 . 5.500 5.714 5.488 5.838 0.338 14 0 "[    .    1    .    2    .    3]" 2 
        61 2 18 LYS QB   2 21 ASN HB3 4.300 . 5.500 3.530 1.963 5.202 0.037  4 0 "[    .    1    .    2    .    3]" 2 
        62 2 18 LYS QB   2 21 ASN HB2 4.000 . 5.500 3.120 2.022 5.219     .  0 0 "[    .    1    .    2    .    3]" 2 
        63 2  7 ASN HA   2  9 ASN H   4.000 . 5.000 3.574 3.431 3.774     .  0 0 "[    .    1    .    2    .    3]" 2 
        64 2  7 ASN HB2  2  9 ASN H   4.000 . 5.000 4.270 4.162 4.374     .  0 0 "[    .    1    .    2    .    3]" 2 
        65 2  7 ASN HB3  2  9 ASN H   4.000 . 5.000 2.800 2.649 2.923     .  0 0 "[    .    1    .    2    .    3]" 2 
        66 1 47 LEU QD   2  9 ASN H   4.000 . 5.000 4.849 4.571 4.936     .  0 0 "[    .    1    .    2    .    3]" 2 
        67 2  9 ASN HB3  2 11 LYS H   4.000 . 5.000 4.869 4.512 5.024 0.024 23 0 "[    .    1    .    2    .    3]" 2 
        68 2  9 ASN HB2  2 11 LYS H   4.000 . 5.000 4.917 4.609 5.022 0.022 23 0 "[    .    1    .    2    .    3]" 2 
        69 1 48 LEU QD   2 13 PHE QD  3.200 . 4.000 2.668 2.500 2.856     .  0 0 "[    .    1    .    2    .    3]" 2 
        70 1 48 LEU QD   2 13 PHE QE  4.000 . 5.000 2.552 2.147 2.668     .  0 0 "[    .    1    .    2    .    3]" 2 
        71 1 28 LEU QD   2 13 PHE QE  4.000 . 5.500 5.340 4.986 5.590 0.090 22 0 "[    .    1    .    2    .    3]" 2 
        72 1 44 THR MG   2 13 PHE QE  4.000 . 5.000 3.483 2.705 4.132     .  0 0 "[    .    1    .    2    .    3]" 2 
        73 2 13 PHE QE   2 18 LYS HA  4.000 . 5.500 5.511 5.315 5.556 0.056 23 0 "[    .    1    .    2    .    3]" 2 
        74 1 29 PHE QD   2 13 PHE QD  3.200 . 4.000 3.420 3.193 3.792     .  0 0 "[    .    1    .    2    .    3]" 2 
        75 1 29 PHE HB2  2 13 PHE QD  4.000 . 5.000 5.038 5.010 5.086 0.086 15 0 "[    .    1    .    2    .    3]" 2 
        76 1 29 PHE HB3  2 13 PHE QE  4.000 . 5.500 5.403 4.922 5.573 0.073 29 0 "[    .    1    .    2    .    3]" 2 
        77 1 29 PHE HB2  2 13 PHE QE  4.000 . 5.000 3.960 3.459 4.130     .  0 0 "[    .    1    .    2    .    3]" 2 
        78 2 13 PHE QD   2 19 TYR HB3 4.000 . 5.000 4.954 4.384 5.054 0.054 20 0 "[    .    1    .    2    .    3]" 2 
        79 2 13 PHE QD   2 19 TYR HB2 4.000 . 5.000 4.222 3.793 4.644     .  0 0 "[    .    1    .    2    .    3]" 2 
        80 2 13 PHE QE   2 19 TYR HB3 4.000 . 5.000 4.693 4.354 5.003 0.003 10 0 "[    .    1    .    2    .    3]" 2 
        81 2 13 PHE QE   2 19 TYR HB2 4.000 . 5.000 3.799 3.514 4.167     .  0 0 "[    .    1    .    2    .    3]" 2 
        82 1 29 PHE H    2 13 PHE QE  4.000 . 5.000 4.837 4.495 5.043 0.043 21 0 "[    .    1    .    2    .    3]" 2 
        83 1 26 GLU H    2 13 PHE HZ  4.000 . 5.000 4.868 4.636 5.014 0.014 12 0 "[    .    1    .    2    .    3]" 2 
        84 1 48 LEU QD   2 13 PHE H   4.000 . 5.000 4.766 4.414 5.047 0.047  9 0 "[    .    1    .    2    .    3]" 2 
        85 1 25 GLY HA3  2 13 PHE HZ  4.000 . 5.000 2.894 2.651 3.219     .  0 0 "[    .    1    .    2    .    3]" 2 
        86 1 25 GLY HA2  2 13 PHE HZ  4.000 . 5.000 1.965 1.816 2.158     .  0 0 "[    .    1    .    2    .    3]" 2 
        87 1 48 LEU QD   2 19 TYR QD  4.000 . 5.000 3.362 3.166 3.563     .  0 0 "[    .    1    .    2    .    3]" 2 
        88 1 48 LEU QD   2 19 TYR QE  4.000 . 5.000 4.951 4.777 5.050 0.050 29 0 "[    .    1    .    2    .    3]" 2 
        89 2 14 VAL H    2 19 TYR QD  4.000 . 5.000 4.226 3.262 4.996     .  0 0 "[    .    1    .    2    .    3]" 2 
        90 2 14 VAL H    2 19 TYR QE  4.000 . 5.000 4.197 3.406 5.013 0.013 28 0 "[    .    1    .    2    .    3]" 2 
        91 2 11 LYS HA   2 19 TYR QE  4.000 . 5.000 4.730 4.280 5.063 0.063 28 0 "[    .    1    .    2    .    3]" 2 
        92 2 11 LYS QB   2 19 TYR QD  4.000 . 5.000 4.248 3.711 5.016 0.016 27 0 "[    .    1    .    2    .    3]" 2 
        93 2 11 LYS HB3  2 19 TYR QE  4.000 . 5.000 3.430 2.767 4.317     .  0 0 "[    .    1    .    2    .    3]" 2 
        94 2 11 LYS HB2  2 19 TYR QE  4.000 . 5.000 2.328 1.771 4.153 0.029 19 0 "[    .    1    .    2    .    3]" 2 
        95 1 29 PHE QD   1 44 THR MG  3.200 . 4.000 2.332 1.960 2.637     .  0 0 "[    .    1    .    2    .    3]" 2 
        96 1 29 PHE QD   1 40 ALA MB  3.200 . 4.000 2.762 2.325 3.558     .  0 0 "[    .    1    .    2    .    3]" 2 
        97 1 29 PHE QE   1 40 ALA MB  3.200 . 4.000 2.651 2.189 3.188     .  0 0 "[    .    1    .    2    .    3]" 2 
        98 1 29 PHE HZ   1 40 ALA MB  4.000 . 5.000 4.334 3.857 4.479     .  0 0 "[    .    1    .    2    .    3]" 2 
        99 1 29 PHE HZ   1 41 GLY H   3.200 . 4.000 3.985 3.671 4.108 0.108 26 0 "[    .    1    .    2    .    3]" 2 
       100 1 20 GLN QE   2 18 LYS HA  3.200 . 4.000 2.950 2.476 3.401     .  0 0 "[    .    1    .    2    .    3]" 2 
       101 2  7 ASN QD   2 10 ALA MB  4.000 . 5.000 4.469 4.322 4.785     .  0 0 "[    .    1    .    2    .    3]" 2 
       102 2  7 ASN QD   2 10 ALA HA  4.000 . 5.000 3.919 3.534 4.440     .  0 0 "[    .    1    .    2    .    3]" 2 
    stop_

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