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
520676 2lgl 17813 cing 4-filtered-FRED Wattos check violation distance


data_2lgl


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              720
    _Distance_constraint_stats_list.Viol_count                    2609
    _Distance_constraint_stats_list.Viol_total                    3499.173
    _Distance_constraint_stats_list.Viol_max                      0.369
    _Distance_constraint_stats_list.Viol_rms                      0.0340
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0121
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0671
    _Distance_constraint_stats_list.Cutoff_violation_report       0.500
    _Distance_constraint_stats_list.Details                       
;
Description of the tags in this list:
*  1 * Administrative tag
*  2 * Administrative tag
*  3 * Administrative tag
*  4 * ID of the restraint list.                                                              
*  5 * Number of restraints in list.                                                          
*  6 * Number of violated restraints (each model violation is used).                          
*  7 * Sum of violations in Angstrom.                                                         
*  8 * Maximum violation of a restraint without averaging in any way.                         
*  9 * Rms of violations over all restraints.                                                 
*  10 * Average violation over all restraints.                                                 
*  11 * Average violation over violated restraints.                                            
           This violation is averaged over only those models in which the restraint is violated.   
           These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).     
*  12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
*  13 * This tag                                                                               

Description of the tags in the per residue table below:
*  1 * Chain identifier (can be absent if none defined)                   
*  2 * Residue number                                                     
*  3 * Residue name                                                       
*  4 * Maximum violation in ensemble of models (without any averaging)
*  5 * Model number with the maximum violation
*  6 * Number of models with a violation above cutoff
*  7 * List of models (1 character per model) with a violation above cutoff.
           An '*' marks a violation above the cutoff. A '+' indicates the largest
           violation above the cutoff and a '-' marks the smallest violation over cutoff.
           For models  5, 15, 25,... a ' ' is replaced by a '.'.
           For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
*  8 * Administrative tag
*  9 * Administrative tag

Description of the tags in the per restraint table below:
*  1 * Restraint ID within restraint list.                                
           First node, FIRST member, first atom's:                              
*  2 * Chain identifier (can be absent if none defined)                   
*  3 * Residue number                                                     
*  4 * Residue name                                                       
*  5 * Name of (pseudo-)atom                                              
           First node, SECOND member, first atom's:                             
*  6 * Chain identifier (can be absent if none defined)                   
*  7 * Residue number                                                     
*  8 * Residue name                                                       
*  9 * Name of (pseudo-)atom                                              
           FIRST node's:
*  10 * Target distance value (Angstrom)
*  11 * Lower bound distance (Angstrom)
*  12 * Upper bound distance (Angstrom)
*  13 * Average distance in ensemble of models
*  14 * Minimum distance in ensemble of models
*  15 * Maximum distance in ensemble of models
*  16 * Maximum violation (without any averaging)
*  17 * Model number with the maximum violation
*  18 * Number of models with a violation above cutoff
*  19 * List of models with a violation above cutoff. See description above.
*  20 * Administrative tag
*  21 * Administrative tag
;


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

       1  4 SER  0.294 0.079  8 0 "[    .    1    .    2]" 
       1  5 CYS  1.883 0.127 10 0 "[    .    1    .    2]" 
       1  6 LYS  3.789 0.185 16 0 "[    .    1    .    2]" 
       1  7 HIS  3.642 0.122  1 0 "[    .    1    .    2]" 
       1  8 CYS  5.316 0.225 10 0 "[    .    1    .    2]" 
       1  9 LYS  3.490 0.225 10 0 "[    .    1    .    2]" 
       1 10 ASP  2.221 0.185 16 0 "[    .    1    .    2]" 
       1 11 ASP  1.240 0.078 15 0 "[    .    1    .    2]" 
       1 12 VAL  1.959 0.179 12 0 "[    .    1    .    2]" 
       1 13 ASN  1.126 0.179  7 0 "[    .    1    .    2]" 
       1 14 ARG  1.815 0.179  7 0 "[    .    1    .    2]" 
       1 15 LEU 12.800 0.267  5 0 "[    .    1    .    2]" 
       1 16 CYS  3.842 0.144  2 0 "[    .    1    .    2]" 
       1 17 ARG  6.181 0.174  5 0 "[    .    1    .    2]" 
       1 18 VAL 11.739 0.180 20 0 "[    .    1    .    2]" 
       1 19 CYS  6.015 0.180 20 0 "[    .    1    .    2]" 
       1 20 ALA  4.346 0.137  7 0 "[    .    1    .    2]" 
       1 21 CYS  1.393 0.109  2 0 "[    .    1    .    2]" 
       1 22 HIS  2.276 0.244  9 0 "[    .    1    .    2]" 
       1 23 LEU  9.112 0.278  3 0 "[    .    1    .    2]" 
       1 24 CYS  5.919 0.278  3 0 "[    .    1    .    2]" 
       1 25 GLY  4.494 0.152  1 0 "[    .    1    .    2]" 
       1 26 GLY  2.575 0.214 19 0 "[    .    1    .    2]" 
       1 27 ARG  1.735 0.153  8 0 "[    .    1    .    2]" 
       1 28 GLN  6.181 0.216 16 0 "[    .    1    .    2]" 
       1 29 ASP  9.320 0.216 16 0 "[    .    1    .    2]" 
       1 30 PRO  0.021 0.018  5 0 "[    .    1    .    2]" 
       1 31 ASP  5.090 0.212  4 0 "[    .    1    .    2]" 
       1 32 LYS  8.362 0.212  4 0 "[    .    1    .    2]" 
       1 33 GLN  5.313 0.184 20 0 "[    .    1    .    2]" 
       1 34 LEU  4.820 0.148  1 0 "[    .    1    .    2]" 
       1 35 MET  3.455 0.148  1 0 "[    .    1    .    2]" 
       1 36 CYS  5.429 0.174 12 0 "[    .    1    .    2]" 
       1 37 ASP  2.999 0.150 16 0 "[    .    1    .    2]" 
       1 38 GLU  7.917 0.175  3 0 "[    .    1    .    2]" 
       1 39 CYS  3.717 0.142  3 0 "[    .    1    .    2]" 
       1 40 ASP  4.289 0.172 17 0 "[    .    1    .    2]" 
       1 41 MET  6.005 0.278  4 0 "[    .    1    .    2]" 
       1 42 ALA  4.009 0.174 12 0 "[    .    1    .    2]" 
       1 43 PHE  1.677 0.107  2 0 "[    .    1    .    2]" 
       1 44 HIS  3.214 0.165 18 0 "[    .    1    .    2]" 
       1 45 ILE  6.679 0.150 13 0 "[    .    1    .    2]" 
       1 46 TYR  3.948 0.171 12 0 "[    .    1    .    2]" 
       1 47 CYS  0.556 0.173  5 0 "[    .    1    .    2]" 
       1 48 LEU 11.419 0.369  3 0 "[    .    1    .    2]" 
       1 49 ASP  2.123 0.135  6 0 "[    .    1    .    2]" 
       1 50 PRO  1.432 0.060 13 0 "[    .    1    .    2]" 
       1 51 PRO  2.672 0.369  3 0 "[    .    1    .    2]" 
       1 52 LEU  6.179 0.204 10 0 "[    .    1    .    2]" 
       1 53 SER  2.706 0.205  7 0 "[    .    1    .    2]" 
       1 54 SER  4.952 0.205  7 0 "[    .    1    .    2]" 
       1 55 VAL  1.813 0.204 10 0 "[    .    1    .    2]" 
       1 56 PRO  2.002 0.175  8 0 "[    .    1    .    2]" 
       1 57 SER  1.976 0.091 16 0 "[    .    1    .    2]" 
       1 58 GLU  3.570 0.129  6 0 "[    .    1    .    2]" 
       1 59 ASP  1.953 0.084  1 0 "[    .    1    .    2]" 
       1 60 GLU  2.601 0.226  2 0 "[    .    1    .    2]" 
       1 61 TRP  2.333 0.226  2 0 "[    .    1    .    2]" 
       1 62 TYR  5.305 0.161  5 0 "[    .    1    .    2]" 
       1 63 CYS  1.823 0.131 13 0 "[    .    1    .    2]" 
       1 64 PRO  0.397 0.053  7 0 "[    .    1    .    2]" 
       1 65 GLU  7.369 0.254 19 0 "[    .    1    .    2]" 
       1 66 CYS  8.426 0.254 19 0 "[    .    1    .    2]" 
       1 67 ARG  4.702 0.226  5 0 "[    .    1    .    2]" 
       1 68 ASN  6.278 0.225 16 0 "[    .    1    .    2]" 
       1 69 ASP  4.378 0.225 16 0 "[    .    1    .    2]" 
    stop_

    loop_
       _Distance_constraint_stats.Restraint_ID
       _Distance_constraint_stats.Atom_1_entity_assembly_ID
       _Distance_constraint_stats.Atom_1_comp_index_ID
       _Distance_constraint_stats.Atom_1_comp_ID
       _Distance_constraint_stats.Atom_1_ID
       _Distance_constraint_stats.Atom_2_entity_assembly_ID
       _Distance_constraint_stats.Atom_2_comp_index_ID
       _Distance_constraint_stats.Atom_2_comp_ID
       _Distance_constraint_stats.Atom_2_ID
       _Distance_constraint_stats.Node_1_distance_val
       _Distance_constraint_stats.Node_1_distance_lower_bound_val
       _Distance_constraint_stats.Node_1_distance_upper_bound_val
       _Distance_constraint_stats.Distance_average
       _Distance_constraint_stats.Distance_minimum
       _Distance_constraint_stats.Distance_maximum
       _Distance_constraint_stats.Max_violation
       _Distance_constraint_stats.Max_violation_model_number
       _Distance_constraint_stats.Over_cutoff_violation_count
       _Distance_constraint_stats.Over_cutoff_viol_per_model
       _Distance_constraint_stats.Distance_constraint_stats_ID

         1 1  4 SER HA   1  5 CYS H    1.800 . 3.500 2.831 2.289 3.579 0.079  8 0 "[    .    1    .    2]" 1 
         2 1  4 SER QB   1  5 CYS H    1.800 . 3.500 2.774 2.560 3.520 0.020 12 0 "[    .    1    .    2]" 1 
         3 1  5 CYS H    1  5 CYS HB2  1.800 . 3.500 2.353 2.191 3.279     .  0 0 "[    .    1    .    2]" 1 
         4 1  5 CYS H    1  5 CYS HB3  1.800 . 3.500 3.516 2.966 3.627 0.127 10 0 "[    .    1    .    2]" 1 
         5 1  5 CYS H    1  6 LYS H    1.800 . 5.000 4.452 4.303 4.554     .  0 0 "[    .    1    .    2]" 1 
         6 1  5 CYS HA   1  6 LYS H    1.800 . 2.900 2.213 2.187 2.357     .  0 0 "[    .    1    .    2]" 1 
         7 1  5 CYS HA   1  7 HIS H    1.800 . 5.000 4.132 3.482 4.783     .  0 0 "[    .    1    .    2]" 1 
         8 1  5 CYS QB   1  7 HIS H    1.800 . 5.000 4.177 2.029 4.878     .  0 0 "[    .    1    .    2]" 1 
         9 1  5 CYS QB   1 10 ASP H    1.800 . 6.000 4.329 1.744 5.853 0.056 20 0 "[    .    1    .    2]" 1 
        10 1  5 CYS HB2  1  6 LYS H    1.800 . 5.000 4.384 3.015 4.569     .  0 0 "[    .    1    .    2]" 1 
        11 1  5 CYS HB2  1  8 CYS H    1.800 . 5.000 4.693 2.813 5.121 0.121  8 0 "[    .    1    .    2]" 1 
        12 1  5 CYS HB2  1 10 ASP H    1.800 . 6.000 5.535 2.426 6.062 0.062 10 0 "[    .    1    .    2]" 1 
        13 1  5 CYS HB3  1  6 LYS H    1.800 . 5.000 3.532 3.236 3.995     .  0 0 "[    .    1    .    2]" 1 
        14 1  5 CYS HB3  1  8 CYS H    1.800 . 5.000 3.183 2.760 4.560     .  0 0 "[    .    1    .    2]" 1 
        15 1  6 LYS H    1  6 LYS HA   1.800 . 2.900 2.970 2.937 2.984 0.084 14 0 "[    .    1    .    2]" 1 
        16 1  6 LYS H    1  6 LYS QB   1.800 . 2.900 2.432 2.408 2.494     .  0 0 "[    .    1    .    2]" 1 
        17 1  6 LYS H    1  6 LYS QE   1.800 . 5.000 4.749 4.368 4.955     .  0 0 "[    .    1    .    2]" 1 
        18 1  6 LYS H    1  6 LYS HG2  1.800 . 5.000 3.837 3.497 4.475     .  0 0 "[    .    1    .    2]" 1 
        19 1  6 LYS H    1  6 LYS HG3  1.800 . 5.000 2.884 2.394 4.608     .  0 0 "[    .    1    .    2]" 1 
        20 1  6 LYS H    1  7 HIS H    1.800 . 2.900 2.334 2.125 2.706     .  0 0 "[    .    1    .    2]" 1 
        21 1  6 LYS H    1  7 HIS HA   1.800 . 5.000 4.973 4.730 5.122 0.122  1 0 "[    .    1    .    2]" 1 
        22 1  6 LYS H    1  7 HIS QB   1.800 . 5.000 4.400 3.896 4.835     .  0 0 "[    .    1    .    2]" 1 
        23 1  6 LYS H    1  8 CYS H    1.800 . 5.000 3.358 2.959 4.736     .  0 0 "[    .    1    .    2]" 1 
        24 1  6 LYS HA   1  6 LYS QG   1.800 . 3.500 2.313 2.299 2.336     .  0 0 "[    .    1    .    2]" 1 
        25 1  6 LYS HA   1  7 HIS H    1.800 . 3.500 3.538 3.274 3.590 0.090 20 0 "[    .    1    .    2]" 1 
        26 1  6 LYS HA   1  9 LYS H    1.800 . 5.000 4.394 3.064 4.949     .  0 0 "[    .    1    .    2]" 1 
        27 1  6 LYS QB   1  7 HIS H    1.800 . 5.000 2.565 2.023 3.435     .  0 0 "[    .    1    .    2]" 1 
        28 1  6 LYS QB   1  8 CYS H    1.800 . 6.000 4.390 3.952 5.665     .  0 0 "[    .    1    .    2]" 1 
        29 1  6 LYS QB   1 10 ASP H    1.800 . 6.000 5.870 5.409 6.185 0.185 16 0 "[    .    1    .    2]" 1 
        30 1  6 LYS QE   1  6 LYS HG2  1.800 . 3.500 2.480 2.241 3.116     .  0 0 "[    .    1    .    2]" 1 
        31 1  6 LYS QE   1  6 LYS HG3  1.800 . 3.500 2.479 2.269 3.341     .  0 0 "[    .    1    .    2]" 1 
        32 1  6 LYS HG2  1  7 HIS H    1.800 . 5.000 4.803 3.389 5.102 0.102  8 0 "[    .    1    .    2]" 1 
        33 1  6 LYS HG3  1  7 HIS H    1.800 . 5.000 4.383 4.178 4.631     .  0 0 "[    .    1    .    2]" 1 
        34 1  7 HIS H    1  7 HIS HA   1.800 . 2.900 2.966 2.924 2.984 0.084 11 0 "[    .    1    .    2]" 1 
        35 1  7 HIS H    1  7 HIS HB2  1.800 . 3.500 2.484 2.217 2.921     .  0 0 "[    .    1    .    2]" 1 
        36 1  7 HIS H    1  8 CYS H    1.800 . 2.900 2.306 2.167 2.703     .  0 0 "[    .    1    .    2]" 1 
        37 1  7 HIS H    1  8 CYS HA   1.800 . 6.000 4.882 4.706 5.154     .  0 0 "[    .    1    .    2]" 1 
        38 1  7 HIS H    1  8 CYS QB   1.800 . 5.000 4.657 3.714 5.015 0.015  8 0 "[    .    1    .    2]" 1 
        39 1  7 HIS H    1  9 LYS H    1.800 . 5.000 4.204 3.158 4.925     .  0 0 "[    .    1    .    2]" 1 
        40 1  7 HIS H    1 16 CYS HA   1.800 . 6.000 5.165 5.048 5.282     .  0 0 "[    .    1    .    2]" 1 
        41 1  7 HIS H    1 18 VAL MG1  1.800 . 5.000 4.020 1.985 5.085 0.085  8 0 "[    .    1    .    2]" 1 
        42 1  7 HIS H    1 18 VAL MG2  1.800 . 5.000 3.274 1.921 4.476     .  0 0 "[    .    1    .    2]" 1 
        43 1  7 HIS HA   1  8 CYS H    1.800 . 3.500 3.350 3.214 3.576 0.076  6 0 "[    .    1    .    2]" 1 
        44 1  7 HIS QB   1 18 VAL QG   1.800 . 3.500 2.565 1.981 3.540 0.040  6 0 "[    .    1    .    2]" 1 
        45 1  7 HIS HB2  1 18 VAL QG   1.800 . 5.000 2.633 1.997 3.672     .  0 0 "[    .    1    .    2]" 1 
        46 1  7 HIS HB3  1 18 VAL QG   1.800 . 5.000 3.785 2.299 4.926     .  0 0 "[    .    1    .    2]" 1 
        47 1  8 CYS H    1  8 CYS HA   1.800 . 2.900 2.943 2.885 2.969 0.069  8 0 "[    .    1    .    2]" 1 
        48 1  8 CYS H    1  8 CYS HB2  1.800 . 3.500 3.027 2.226 3.614 0.114  6 0 "[    .    1    .    2]" 1 
        49 1  8 CYS H    1  8 CYS HB3  1.800 . 3.500 3.472 2.521 3.599 0.099 13 0 "[    .    1    .    2]" 1 
        50 1  8 CYS H    1  9 LYS H    1.800 . 2.900 2.411 2.159 2.819     .  0 0 "[    .    1    .    2]" 1 
        51 1  8 CYS H    1  9 LYS HA   1.800 . 5.000 4.997 4.471 5.225 0.225 10 0 "[    .    1    .    2]" 1 
        52 1  8 CYS H    1  9 LYS QB   1.800 . 5.000 4.340 4.020 5.034 0.034 20 0 "[    .    1    .    2]" 1 
        53 1  8 CYS H    1 10 ASP H    1.800 . 5.000 3.868 3.378 4.629     .  0 0 "[    .    1    .    2]" 1 
        54 1  8 CYS H    1 18 VAL MG1  1.800 . 6.000 5.482 3.106 6.080 0.080 14 0 "[    .    1    .    2]" 1 
        55 1  8 CYS H    1 18 VAL MG2  1.800 . 6.000 4.733 3.282 6.108 0.108 16 0 "[    .    1    .    2]" 1 
        56 1  8 CYS HA   1  9 LYS H    1.800 . 3.500 3.533 3.397 3.578 0.078 11 0 "[    .    1    .    2]" 1 
        57 1  8 CYS HA   1 10 ASP H    1.800 . 5.000 4.478 4.087 4.847     .  0 0 "[    .    1    .    2]" 1 
        58 1  8 CYS HA   1 15 LEU H    1.800 . 6.000 4.974 2.859 6.084 0.084  7 0 "[    .    1    .    2]" 1 
        59 1  8 CYS HB2  1  9 LYS H    1.800 . 5.000 2.776 2.228 4.095     .  0 0 "[    .    1    .    2]" 1 
        60 1  8 CYS HB3  1  9 LYS H    1.800 . 5.000 3.905 1.987 4.458     .  0 0 "[    .    1    .    2]" 1 
        61 1  9 LYS H    1  9 LYS HA   1.800 . 2.900 2.763 2.345 2.850     .  0 0 "[    .    1    .    2]" 1 
        62 1  9 LYS H    1  9 LYS QD   1.800 . 5.000 4.407 3.835 4.697     .  0 0 "[    .    1    .    2]" 1 
        63 1  9 LYS H    1  9 LYS HG2  1.800 . 5.000 4.215 3.223 4.669     .  0 0 "[    .    1    .    2]" 1 
        64 1  9 LYS H    1  9 LYS HG3  1.800 . 5.000 3.963 2.153 4.467     .  0 0 "[    .    1    .    2]" 1 
        65 1  9 LYS H    1 10 ASP H    1.800 . 3.500 2.751 2.684 2.834     .  0 0 "[    .    1    .    2]" 1 
        66 1  9 LYS HA   1  9 LYS QD   1.800 . 5.000 3.877 2.207 3.988     .  0 0 "[    .    1    .    2]" 1 
        67 1  9 LYS HA   1  9 LYS HG2  1.800 . 3.500 2.872 2.417 3.699 0.199 14 0 "[    .    1    .    2]" 1 
        68 1  9 LYS HA   1  9 LYS HG3  1.800 . 3.500 2.640 2.428 3.188     .  0 0 "[    .    1    .    2]" 1 
        69 1  9 LYS HA   1 10 ASP H    1.800 . 3.500 3.433 2.762 3.564 0.064  3 0 "[    .    1    .    2]" 1 
        70 1  9 LYS QB   1  9 LYS QE   1.800 . 5.000 3.378 2.114 3.685     .  0 0 "[    .    1    .    2]" 1 
        71 1  9 LYS QE   1  9 LYS QG   1.800 . 3.500 2.208 2.086 2.862     .  0 0 "[    .    1    .    2]" 1 
        72 1 10 ASP H    1 10 ASP QB   1.800 . 3.500 2.554 2.400 3.323     .  0 0 "[    .    1    .    2]" 1 
        73 1 10 ASP H    1 11 ASP H    1.800 . 2.900 2.723 2.592 2.902 0.002  7 0 "[    .    1    .    2]" 1 
        74 1 10 ASP H    1 11 ASP HA   1.800 . 6.000 5.302 5.121 5.441     .  0 0 "[    .    1    .    2]" 1 
        75 1 10 ASP HA   1 11 ASP H    1.800 . 3.500 3.431 2.802 3.562 0.062  5 0 "[    .    1    .    2]" 1 
        76 1 10 ASP HB2  1 11 ASP H    1.800 . 5.000 2.989 1.912 4.423     .  0 0 "[    .    1    .    2]" 1 
        77 1 10 ASP HB3  1 11 ASP H    1.800 . 5.000 3.743 2.707 4.461     .  0 0 "[    .    1    .    2]" 1 
        78 1 11 ASP H    1 11 ASP HA   1.800 . 2.900 2.886 2.376 2.978 0.078 15 0 "[    .    1    .    2]" 1 
        79 1 11 ASP H    1 11 ASP QB   1.800 . 3.500 2.569 2.296 3.165     .  0 0 "[    .    1    .    2]" 1 
        80 1 11 ASP H    1 12 VAL HA   1.800 . 6.000 5.161 4.382 5.641     .  0 0 "[    .    1    .    2]" 1 
        81 1 11 ASP HA   1 12 VAL H    1.800 . 3.500 2.474 2.177 3.466     .  0 0 "[    .    1    .    2]" 1 
        82 1 11 ASP HA   1 12 VAL QG   1.800 . 5.000 3.937 3.552 4.837     .  0 0 "[    .    1    .    2]" 1 
        83 1 12 VAL H    1 12 VAL HA   1.800 . 2.900 2.849 2.797 2.898     .  0 0 "[    .    1    .    2]" 1 
        84 1 12 VAL H    1 12 VAL HB   1.800 . 3.500 2.573 2.345 3.594 0.094 13 0 "[    .    1    .    2]" 1 
        85 1 12 VAL H    1 12 VAL QG   1.800 . 3.500 2.190 1.815 2.402     .  0 0 "[    .    1    .    2]" 1 
        86 1 12 VAL H    1 13 ASN QB   1.800 . 5.000 4.774 4.444 5.105 0.105 17 0 "[    .    1    .    2]" 1 
        87 1 12 VAL HA   1 12 VAL MG1  1.800 . 3.500 2.556 2.251 3.182     .  0 0 "[    .    1    .    2]" 1 
        88 1 12 VAL HA   1 12 VAL MG2  1.800 . 3.500 2.391 2.203 3.191     .  0 0 "[    .    1    .    2]" 1 
        89 1 12 VAL HA   1 13 ASN H    1.800 . 3.500 3.527 3.453 3.580 0.080  7 0 "[    .    1    .    2]" 1 
        90 1 12 VAL HA   1 14 ARG H    1.800 . 5.000 4.220 3.313 5.179 0.179 12 0 "[    .    1    .    2]" 1 
        91 1 12 VAL HB   1 13 ASN H    1.800 . 5.000 3.051 2.245 3.962     .  0 0 "[    .    1    .    2]" 1 
        92 1 12 VAL QG   1 13 ASN H    1.800 . 3.500 2.768 1.810 3.366     .  0 0 "[    .    1    .    2]" 1 
        93 1 12 VAL QG   1 13 ASN QB   1.800 . 5.000 3.866 2.307 4.595     .  0 0 "[    .    1    .    2]" 1 
        94 1 12 VAL MG1  1 14 ARG H    1.800 . 5.000 3.919 1.941 4.951     .  0 0 "[    .    1    .    2]" 1 
        95 1 12 VAL MG2  1 14 ARG H    1.800 . 5.000 4.552 1.794 5.145 0.145  6 0 "[    .    1    .    2]" 1 
        96 1 13 ASN H    1 13 ASN HA   1.800 . 2.900 2.691 2.344 2.907 0.007 10 0 "[    .    1    .    2]" 1 
        97 1 13 ASN H    1 13 ASN QB   1.800 . 3.500 2.736 2.242 3.260     .  0 0 "[    .    1    .    2]" 1 
        98 1 13 ASN H    1 14 ARG H    1.800 . 2.900 2.610 1.792 3.079 0.179  7 0 "[    .    1    .    2]" 1 
        99 1 13 ASN HA   1 14 ARG H    1.800 . 3.500 3.268 2.590 3.526 0.026 16 0 "[    .    1    .    2]" 1 
       100 1 13 ASN QB   1 14 ARG H    1.800 . 5.000 3.237 2.717 3.994     .  0 0 "[    .    1    .    2]" 1 
       101 1 14 ARG H    1 14 ARG HA   1.800 . 2.900 2.703 2.326 2.989 0.089 19 0 "[    .    1    .    2]" 1 
       102 1 14 ARG H    1 15 LEU H    1.800 . 5.000 3.701 2.714 4.707     .  0 0 "[    .    1    .    2]" 1 
       103 1 14 ARG HA   1 15 LEU H    1.800 . 3.500 2.869 2.288 3.561 0.061 15 0 "[    .    1    .    2]" 1 
       104 1 14 ARG HB2  1 15 LEU H    1.800 . 5.000 3.672 1.908 4.638     .  0 0 "[    .    1    .    2]" 1 
       105 1 14 ARG HB3  1 15 LEU H    1.800 . 5.000 3.068 1.758 4.457 0.042 12 0 "[    .    1    .    2]" 1 
       106 1 15 LEU H    1 15 LEU HA   1.800 . 2.900 2.924 2.889 2.971 0.071 15 0 "[    .    1    .    2]" 1 
       107 1 15 LEU H    1 15 LEU HB2  1.800 . 3.500 2.548 2.493 2.603     .  0 0 "[    .    1    .    2]" 1 
       108 1 15 LEU H    1 15 LEU HB3  1.800 . 3.500 3.636 3.604 3.699 0.199  2 0 "[    .    1    .    2]" 1 
       109 1 15 LEU H    1 15 LEU QD   1.800 . 2.900 2.964 2.829 3.050 0.150 18 0 "[    .    1    .    2]" 1 
       110 1 15 LEU H    1 15 LEU HG   1.800 . 2.900 2.164 1.951 2.632     .  0 0 "[    .    1    .    2]" 1 
       111 1 15 LEU H    1 16 CYS H    1.800 . 5.000 4.600 4.514 4.639     .  0 0 "[    .    1    .    2]" 1 
       112 1 15 LEU HA   1 15 LEU MD2  1.800 . 2.900 2.060 2.030 2.384     .  0 0 "[    .    1    .    2]" 1 
       113 1 15 LEU HA   1 15 LEU HG   1.800 . 3.500 3.116 2.647 3.216     .  0 0 "[    .    1    .    2]" 1 
       114 1 15 LEU HA   1 16 CYS H    1.800 . 2.900 2.251 2.230 2.275     .  0 0 "[    .    1    .    2]" 1 
       115 1 15 LEU QB   1 16 CYS H    1.800 . 5.000 2.885 2.774 3.080     .  0 0 "[    .    1    .    2]" 1 
       116 1 15 LEU QB   1 26 GLY H    1.800 . 5.000 4.913 4.292 5.118 0.118  9 0 "[    .    1    .    2]" 1 
       117 1 15 LEU HB2  1 15 LEU MD1  1.800 . 2.900 2.354 2.166 2.468     .  0 0 "[    .    1    .    2]" 1 
       118 1 15 LEU HB2  1 15 LEU MD2  1.800 . 2.900 3.162 3.093 3.167 0.267  5 0 "[    .    1    .    2]" 1 
       119 1 15 LEU HB3  1 15 LEU MD1  1.800 . 2.900 2.350 2.222 2.677     .  0 0 "[    .    1    .    2]" 1 
       120 1 15 LEU HB3  1 15 LEU MD2  1.800 . 2.900 2.256 2.138 2.308     .  0 0 "[    .    1    .    2]" 1 
       121 1 15 LEU QD   1 16 CYS H    1.800 . 3.500 3.410 3.312 3.532 0.032 15 0 "[    .    1    .    2]" 1 
       122 1 15 LEU QD   1 26 GLY H    1.800 . 5.000 4.464 3.824 5.038 0.038 12 0 "[    .    1    .    2]" 1 
       123 1 15 LEU QD   1 27 ARG H    1.800 . 5.000 4.542 3.064 5.097 0.097 18 0 "[    .    1    .    2]" 1 
       124 1 15 LEU MD1  1 25 GLY QA   1.800 . 5.000 3.158 2.393 3.948     .  0 0 "[    .    1    .    2]" 1 
       125 1 15 LEU MD2  1 25 GLY QA   1.800 . 5.000 3.512 2.384 4.281     .  0 0 "[    .    1    .    2]" 1 
       126 1 15 LEU HG   1 16 CYS H    1.800 . 5.000 5.057 4.757 5.144 0.144  2 0 "[    .    1    .    2]" 1 
       127 1 16 CYS H    1 16 CYS HA   1.800 . 2.900 2.940 2.867 2.989 0.089  6 0 "[    .    1    .    2]" 1 
       128 1 16 CYS H    1 25 GLY QA   1.800 . 3.500 3.520 3.325 3.594 0.094 13 0 "[    .    1    .    2]" 1 
       129 1 16 CYS HA   1 17 ARG H    1.800 . 3.500 2.877 2.185 3.572 0.072 14 0 "[    .    1    .    2]" 1 
       130 1 16 CYS HA   1 17 ARG QG   1.800 . 6.000 4.485 3.342 6.135 0.135 12 0 "[    .    1    .    2]" 1 
       131 1 16 CYS QB   1 18 VAL H    1.800 . 5.000 4.131 3.577 4.896     .  0 0 "[    .    1    .    2]" 1 
       132 1 16 CYS QB   1 20 ALA MB   1.800 . 5.000 2.112 1.826 3.192     .  0 0 "[    .    1    .    2]" 1 
       133 1 16 CYS HB2  1 17 ARG H    1.800 . 5.000 3.975 2.691 4.596     .  0 0 "[    .    1    .    2]" 1 
       134 1 16 CYS HB2  1 19 CYS H    1.800 . 5.000 4.635 4.071 5.019 0.019 12 0 "[    .    1    .    2]" 1 
       135 1 16 CYS HB2  1 20 ALA H    1.800 . 5.000 3.660 2.933 5.050 0.050  4 0 "[    .    1    .    2]" 1 
       136 1 16 CYS HB3  1 17 ARG H    1.800 . 5.000 3.945 2.909 4.438     .  0 0 "[    .    1    .    2]" 1 
       137 1 16 CYS HB3  1 19 CYS H    1.800 . 5.000 3.127 2.535 4.877     .  0 0 "[    .    1    .    2]" 1 
       138 1 16 CYS HB3  1 20 ALA H    1.800 . 5.000 2.346 1.783 4.182 0.017 20 0 "[    .    1    .    2]" 1 
       139 1 17 ARG H    1 17 ARG QB   1.800 . 3.500 2.771 2.243 2.965     .  0 0 "[    .    1    .    2]" 1 
       140 1 17 ARG H    1 17 ARG HG2  1.800 . 5.000 3.334 2.299 4.630     .  0 0 "[    .    1    .    2]" 1 
       141 1 17 ARG H    1 17 ARG HG3  1.800 . 5.000 2.898 1.756 4.715 0.044  3 0 "[    .    1    .    2]" 1 
       142 1 17 ARG H    1 18 VAL H    1.800 . 5.000 3.116 2.279 3.951     .  0 0 "[    .    1    .    2]" 1 
       143 1 17 ARG H    1 18 VAL QG   1.800 . 5.000 4.233 3.224 5.096 0.096  5 0 "[    .    1    .    2]" 1 
       144 1 17 ARG H    1 19 CYS H    1.800 . 5.000 4.632 4.202 5.071 0.071  3 0 "[    .    1    .    2]" 1 
       145 1 17 ARG H    1 25 GLY QA   1.800 . 5.000 3.142 2.048 4.549     .  0 0 "[    .    1    .    2]" 1 
       146 1 17 ARG HA   1 18 VAL H    1.800 . 3.500 3.536 3.491 3.566 0.066 19 0 "[    .    1    .    2]" 1 
       147 1 17 ARG HA   1 20 ALA MB   1.800 . 3.500 3.303 2.800 3.615 0.115 20 0 "[    .    1    .    2]" 1 
       148 1 17 ARG QB   1 17 ARG QD   1.800 . 3.500 2.147 2.070 2.202     .  0 0 "[    .    1    .    2]" 1 
       149 1 17 ARG QB   1 18 VAL H    1.800 . 3.500 2.775 1.813 3.497     .  0 0 "[    .    1    .    2]" 1 
       150 1 17 ARG QB   1 25 GLY H    1.800 . 5.000 4.913 4.375 5.116 0.116  2 0 "[    .    1    .    2]" 1 
       151 1 17 ARG HD2  1 18 VAL H    1.800 . 3.500 3.406 2.591 3.674 0.174  5 0 "[    .    1    .    2]" 1 
       152 1 17 ARG HD3  1 18 VAL H    1.800 . 3.500 3.331 2.568 3.636 0.136 18 0 "[    .    1    .    2]" 1 
       153 1 17 ARG HG2  1 18 VAL H    1.800 . 5.000 3.831 3.252 4.851     .  0 0 "[    .    1    .    2]" 1 
       154 1 17 ARG HG2  1 25 GLY QA   1.800 . 5.000 4.578 3.814 5.076 0.076 17 0 "[    .    1    .    2]" 1 
       155 1 17 ARG HG3  1 18 VAL H    1.800 . 5.000 3.166 1.752 4.779 0.048  7 0 "[    .    1    .    2]" 1 
       156 1 17 ARG HG3  1 25 GLY QA   1.800 . 5.000 4.230 2.788 5.018 0.018 10 0 "[    .    1    .    2]" 1 
       157 1 18 VAL H    1 18 VAL HA   1.800 . 2.900 2.886 2.817 2.932 0.032 20 0 "[    .    1    .    2]" 1 
       158 1 18 VAL H    1 18 VAL HB   1.800 . 3.500 2.682 2.314 3.638 0.138  6 0 "[    .    1    .    2]" 1 
       159 1 18 VAL H    1 18 VAL MG1  1.800 . 5.000 3.383 1.697 3.755 0.103 20 0 "[    .    1    .    2]" 1 
       160 1 18 VAL H    1 18 VAL MG2  1.800 . 5.000 2.266 1.741 3.698 0.059 11 0 "[    .    1    .    2]" 1 
       161 1 18 VAL H    1 19 CYS H    1.800 . 2.900 2.740 2.570 2.911 0.011  4 0 "[    .    1    .    2]" 1 
       162 1 18 VAL H    1 20 ALA H    1.800 . 3.500 3.578 3.542 3.637 0.137  7 0 "[    .    1    .    2]" 1 
       163 1 18 VAL HA   1 18 VAL MG1  1.800 . 3.500 2.411 2.126 3.184     .  0 0 "[    .    1    .    2]" 1 
       164 1 18 VAL HA   1 18 VAL MG2  1.800 . 3.500 2.459 2.226 3.203     .  0 0 "[    .    1    .    2]" 1 
       165 1 18 VAL HA   1 19 CYS H    1.800 . 3.500 3.564 3.543 3.577 0.077  6 0 "[    .    1    .    2]" 1 
       166 1 18 VAL HA   1 20 ALA H    1.800 . 5.000 4.292 4.086 4.519     .  0 0 "[    .    1    .    2]" 1 
       167 1 18 VAL HA   1 41 MET ME   1.800 . 2.900 2.957 2.860 2.996 0.096  9 0 "[    .    1    .    2]" 1 
       168 1 18 VAL HB   1 19 CYS H    1.800 . 3.500 2.471 1.924 3.680 0.180 20 0 "[    .    1    .    2]" 1 
       169 1 18 VAL QG   1 41 MET QG   1.800 . 5.000 4.225 2.838 5.052 0.052 17 0 "[    .    1    .    2]" 1 
       170 1 18 VAL MG1  1 19 CYS H    1.800 . 3.500 3.058 1.702 3.610 0.110  6 0 "[    .    1    .    2]" 1 
       171 1 18 VAL MG1  1 41 MET ME   1.800 . 5.000 3.854 3.046 4.944     .  0 0 "[    .    1    .    2]" 1 
       172 1 18 VAL MG2  1 19 CYS H    1.800 . 3.500 3.293 1.665 3.665 0.165 16 0 "[    .    1    .    2]" 1 
       173 1 18 VAL MG2  1 41 MET ME   1.800 . 5.000 3.978 3.042 4.941     .  0 0 "[    .    1    .    2]" 1 
       174 1 19 CYS H    1 19 CYS HA   1.800 . 2.900 2.889 2.818 2.966 0.066  4 0 "[    .    1    .    2]" 1 
       175 1 19 CYS H    1 19 CYS HB2  1.800 . 3.500 2.974 2.467 3.236     .  0 0 "[    .    1    .    2]" 1 
       176 1 19 CYS H    1 19 CYS HB3  1.800 . 3.500 3.541 3.437 3.628 0.128  6 0 "[    .    1    .    2]" 1 
       177 1 19 CYS H    1 20 ALA H    1.800 . 2.900 2.509 2.183 2.744     .  0 0 "[    .    1    .    2]" 1 
       178 1 19 CYS H    1 20 ALA MB   1.800 . 5.000 4.300 3.884 4.619     .  0 0 "[    .    1    .    2]" 1 
       179 1 19 CYS HA   1 20 ALA H    1.800 . 3.500 3.472 3.324 3.532 0.032 20 0 "[    .    1    .    2]" 1 
       180 1 19 CYS QB   1 20 ALA MB   1.800 . 5.000 3.566 3.322 3.849     .  0 0 "[    .    1    .    2]" 1 
       181 1 19 CYS HB2  1 20 ALA H    1.800 . 5.000 3.068 2.770 3.618     .  0 0 "[    .    1    .    2]" 1 
       182 1 19 CYS HB3  1 20 ALA H    1.800 . 5.000 4.199 3.797 4.510     .  0 0 "[    .    1    .    2]" 1 
       183 1 20 ALA H    1 20 ALA HA   1.800 . 2.900 2.986 2.971 3.002 0.102  7 0 "[    .    1    .    2]" 1 
       184 1 20 ALA H    1 20 ALA MB   1.800 . 2.900 2.380 2.231 2.516     .  0 0 "[    .    1    .    2]" 1 
       185 1 20 ALA H    1 25 GLY QA   1.800 . 5.000 4.501 3.831 5.053 0.053 20 0 "[    .    1    .    2]" 1 
       186 1 20 ALA HA   1 21 CYS H    1.800 . 2.900 2.492 2.346 2.524     .  0 0 "[    .    1    .    2]" 1 
       187 1 20 ALA MB   1 21 CYS H    1.800 . 2.900 2.417 2.302 2.727     .  0 0 "[    .    1    .    2]" 1 
       188 1 20 ALA MB   1 26 GLY H    1.800 . 5.000 2.909 1.771 3.868 0.029 13 0 "[    .    1    .    2]" 1 
       189 1 21 CYS H    1 21 CYS HA   1.800 . 2.900 2.794 2.750 2.861     .  0 0 "[    .    1    .    2]" 1 
       190 1 21 CYS H    1 21 CYS HB2  1.800 . 3.500 3.534 3.465 3.609 0.109  2 0 "[    .    1    .    2]" 1 
       191 1 21 CYS H    1 21 CYS HB3  1.800 . 3.500 2.767 2.183 3.173     .  0 0 "[    .    1    .    2]" 1 
       192 1 21 CYS H    1 25 GLY QA   1.800 . 5.000 4.575 2.497 5.107 0.107  1 0 "[    .    1    .    2]" 1 
       193 1 21 CYS H    1 26 GLY H    1.800 . 5.000 4.168 3.706 5.001 0.001 18 0 "[    .    1    .    2]" 1 
       194 1 21 CYS H    1 26 GLY QA   1.800 . 5.000 4.551 3.494 5.108 0.108 19 0 "[    .    1    .    2]" 1 
       195 1 21 CYS HA   1 22 HIS H    1.800 . 3.500 2.188 2.158 2.230     .  0 0 "[    .    1    .    2]" 1 
       196 1 21 CYS HA   1 22 HIS QB   1.800 . 5.000 4.142 4.077 4.488     .  0 0 "[    .    1    .    2]" 1 
       197 1 21 CYS QB   1 42 ALA MB   1.800 . 5.000 2.926 2.249 4.061     .  0 0 "[    .    1    .    2]" 1 
       198 1 21 CYS HB2  1 22 HIS H    1.800 . 5.000 3.385 3.146 3.670     .  0 0 "[    .    1    .    2]" 1 
       199 1 21 CYS HB2  1 23 LEU H    1.800 . 6.000 3.426 2.271 5.085     .  0 0 "[    .    1    .    2]" 1 
       200 1 21 CYS HB3  1 22 HIS H    1.800 . 5.000 4.034 3.608 4.516     .  0 0 "[    .    1    .    2]" 1 
       201 1 21 CYS HB3  1 23 LEU H    1.800 . 6.000 4.693 3.730 5.747     .  0 0 "[    .    1    .    2]" 1 
       202 1 22 HIS H    1 22 HIS HA   1.800 . 2.900 2.863 2.798 2.917 0.017 20 0 "[    .    1    .    2]" 1 
       203 1 22 HIS H    1 22 HIS HB2  1.800 . 3.500 2.682 2.437 3.589 0.089  8 0 "[    .    1    .    2]" 1 
       204 1 22 HIS H    1 22 HIS HB3  1.800 . 3.500 2.529 2.188 2.666     .  0 0 "[    .    1    .    2]" 1 
       205 1 22 HIS H    1 23 LEU H    1.800 . 5.000 3.286 2.583 4.073     .  0 0 "[    .    1    .    2]" 1 
       206 1 22 HIS H    1 42 ALA MB   1.800 . 5.000 4.209 3.899 4.571     .  0 0 "[    .    1    .    2]" 1 
       207 1 22 HIS HA   1 23 LEU H    1.800 . 5.000 2.980 2.313 3.503     .  0 0 "[    .    1    .    2]" 1 
       208 1 22 HIS QB   1 42 ALA H    1.800 . 5.000 4.981 4.399 5.120 0.120  9 0 "[    .    1    .    2]" 1 
       209 1 22 HIS HB2  1 22 HIS HD1  1.800 . 2.900 2.724 2.540 2.894     .  0 0 "[    .    1    .    2]" 1 
       210 1 22 HIS HB2  1 23 LEU H    1.800 . 5.000 4.379 3.986 4.692     .  0 0 "[    .    1    .    2]" 1 
       211 1 22 HIS HB2  1 23 LEU MD1  1.800 . 6.000 5.550 3.992 6.244 0.244  9 0 "[    .    1    .    2]" 1 
       212 1 22 HIS HB3  1 22 HIS HD1  1.800 . 2.900 2.697 2.534 2.788     .  0 0 "[    .    1    .    2]" 1 
       213 1 22 HIS HB3  1 23 LEU H    1.800 . 5.000 3.808 2.928 4.610     .  0 0 "[    .    1    .    2]" 1 
       214 1 22 HIS HB3  1 23 LEU MD1  1.800 . 6.000 4.476 2.514 6.154 0.154 17 0 "[    .    1    .    2]" 1 
       215 1 23 LEU H    1 23 LEU QD   1.800 . 5.000 3.384 1.794 4.113 0.006 19 0 "[    .    1    .    2]" 1 
       216 1 23 LEU H    1 23 LEU HG   1.800 . 5.000 4.126 2.990 4.750     .  0 0 "[    .    1    .    2]" 1 
       217 1 23 LEU H    1 24 CYS H    1.800 . 2.900 2.735 2.563 2.959 0.059 16 0 "[    .    1    .    2]" 1 
       218 1 23 LEU H    1 24 CYS HA   1.800 . 5.000 5.003 4.569 5.278 0.278  3 0 "[    .    1    .    2]" 1 
       219 1 23 LEU H    1 24 CYS QB   1.800 . 5.000 4.835 4.457 5.115 0.115 11 0 "[    .    1    .    2]" 1 
       220 1 23 LEU H    1 25 GLY H    1.800 . 3.500 3.194 2.483 3.652 0.152  1 0 "[    .    1    .    2]" 1 
       221 1 23 LEU H    1 25 GLY QA   1.800 . 5.000 4.323 3.527 5.079 0.079 13 0 "[    .    1    .    2]" 1 
       222 1 23 LEU HA   1 23 LEU QD   1.800 . 2.900 2.279 2.067 2.702     .  0 0 "[    .    1    .    2]" 1 
       223 1 23 LEU HA   1 23 LEU HG   1.800 . 3.500 2.519 2.268 2.858     .  0 0 "[    .    1    .    2]" 1 
       224 1 23 LEU HA   1 24 CYS H    1.800 . 3.500 3.550 3.530 3.568 0.068 12 0 "[    .    1    .    2]" 1 
       225 1 23 LEU HA   1 25 GLY H    1.800 . 5.000 4.803 4.538 5.038 0.038  4 0 "[    .    1    .    2]" 1 
       226 1 23 LEU QB   1 24 CYS H    1.800 . 3.500 2.147 1.770 2.616 0.030 18 0 "[    .    1    .    2]" 1 
       227 1 23 LEU QB   1 44 HIS H    1.800 . 6.000 5.674 4.797 6.106 0.106  2 0 "[    .    1    .    2]" 1 
       228 1 23 LEU HB2  1 23 LEU MD1  1.800 . 3.500 2.194 2.168 2.217     .  0 0 "[    .    1    .    2]" 1 
       229 1 23 LEU HB2  1 23 LEU MD2  1.800 . 3.500 2.651 2.331 3.174     .  0 0 "[    .    1    .    2]" 1 
       230 1 23 LEU QD   1 24 CYS H    1.800 . 5.000 3.585 3.327 3.853     .  0 0 "[    .    1    .    2]" 1 
       231 1 23 LEU QD   1 44 HIS H    1.800 . 5.000 4.555 2.969 5.165 0.165 18 0 "[    .    1    .    2]" 1 
       232 1 23 LEU QD   1 47 CYS HB2  1.800 . 6.000 4.621 4.145 5.780     .  0 0 "[    .    1    .    2]" 1 
       233 1 23 LEU QD   1 47 CYS HB3  1.800 . 5.000 4.171 3.584 4.887     .  0 0 "[    .    1    .    2]" 1 
       234 1 23 LEU QD   1 48 LEU H    1.800 . 6.000 5.660 5.170 6.166 0.166  3 0 "[    .    1    .    2]" 1 
       235 1 23 LEU QD   1 48 LEU HA   1.800 . 5.000 5.091 5.021 5.138 0.138  3 0 "[    .    1    .    2]" 1 
       236 1 24 CYS H    1 24 CYS HA   1.800 . 2.900 2.926 2.820 2.974 0.074  2 0 "[    .    1    .    2]" 1 
       237 1 24 CYS H    1 25 GLY H    1.800 . 2.900 2.296 1.754 2.803 0.046  4 0 "[    .    1    .    2]" 1 
       238 1 24 CYS H    1 25 GLY QA   1.800 . 5.000 4.239 3.763 4.623     .  0 0 "[    .    1    .    2]" 1 
       239 1 24 CYS H    1 26 GLY H    1.800 . 5.000 4.058 3.466 4.473     .  0 0 "[    .    1    .    2]" 1 
       240 1 24 CYS HA   1 25 GLY H    1.800 . 3.500 3.510 3.458 3.561 0.061 16 0 "[    .    1    .    2]" 1 
       241 1 24 CYS HA   1 26 GLY H    1.800 . 5.000 4.568 4.171 5.062 0.062  1 0 "[    .    1    .    2]" 1 
       242 1 24 CYS QB   1 25 GLY H    1.800 . 3.500 3.032 2.456 3.600 0.100  5 0 "[    .    1    .    2]" 1 
       243 1 24 CYS HB2  1 26 GLY H    1.800 . 5.000 3.137 2.196 4.408     .  0 0 "[    .    1    .    2]" 1 
       244 1 24 CYS HB3  1 26 GLY H    1.800 . 5.000 3.869 2.933 4.748     .  0 0 "[    .    1    .    2]" 1 
       245 1 25 GLY H    1 26 GLY H    1.800 . 2.900 2.459 2.250 2.917 0.017 13 0 "[    .    1    .    2]" 1 
       246 1 25 GLY H    1 26 GLY QA   1.800 . 5.000 4.413 4.209 4.807     .  0 0 "[    .    1    .    2]" 1 
       247 1 25 GLY QA   1 26 GLY H    1.800 . 2.900 2.860 2.614 2.937 0.037  6 0 "[    .    1    .    2]" 1 
       248 1 26 GLY H    1 27 ARG H    1.800 . 5.000 3.946 2.284 4.597     .  0 0 "[    .    1    .    2]" 1 
       249 1 26 GLY H    1 28 GLN H    1.800 . 5.000 4.847 3.701 5.214 0.214 19 0 "[    .    1    .    2]" 1 
       250 1 26 GLY QA   1 27 ARG H    1.800 . 2.900 2.390 2.154 2.934 0.034  2 0 "[    .    1    .    2]" 1 
       251 1 26 GLY QA   1 28 GLN H    1.800 . 3.500 3.309 2.766 3.541 0.041 16 0 "[    .    1    .    2]" 1 
       252 1 27 ARG H    1 27 ARG HA   1.800 . 2.900 2.646 2.342 2.978 0.078  6 0 "[    .    1    .    2]" 1 
       253 1 27 ARG H    1 27 ARG QB   1.800 . 3.500 2.690 2.265 3.344     .  0 0 "[    .    1    .    2]" 1 
       254 1 27 ARG H    1 27 ARG QD   1.800 . 5.000 4.517 3.742 5.044 0.044 15 0 "[    .    1    .    2]" 1 
       255 1 27 ARG H    1 27 ARG HG2  1.800 . 5.000 3.989 3.235 4.832     .  0 0 "[    .    1    .    2]" 1 
       256 1 27 ARG H    1 27 ARG HG3  1.800 . 5.000 3.473 2.091 4.431     .  0 0 "[    .    1    .    2]" 1 
       257 1 27 ARG H    1 28 GLN H    1.800 . 2.900 2.763 2.592 2.900     . 13 0 "[    .    1    .    2]" 1 
       258 1 27 ARG H    1 28 GLN QB   1.800 . 5.000 4.837 4.436 5.153 0.153  8 0 "[    .    1    .    2]" 1 
       259 1 27 ARG HA   1 27 ARG HG2  1.800 . 3.500 2.679 2.414 2.975     .  0 0 "[    .    1    .    2]" 1 
       260 1 27 ARG HA   1 27 ARG HG3  1.800 . 3.500 2.765 2.350 3.107     .  0 0 "[    .    1    .    2]" 1 
       261 1 27 ARG QB   1 27 ARG QD   1.800 . 2.900 2.211 2.126 2.348     .  0 0 "[    .    1    .    2]" 1 
       262 1 27 ARG QB   1 28 GLN H    1.800 . 5.000 3.250 2.627 3.944     .  0 0 "[    .    1    .    2]" 1 
       263 1 27 ARG HG2  1 28 GLN H    1.800 . 5.000 4.620 3.879 5.083 0.083  5 0 "[    .    1    .    2]" 1 
       264 1 27 ARG HG3  1 28 GLN H    1.800 . 5.000 4.801 4.289 5.122 0.122  4 0 "[    .    1    .    2]" 1 
       265 1 28 GLN H    1 28 GLN HA   1.800 . 2.900 2.781 2.362 2.978 0.078 16 0 "[    .    1    .    2]" 1 
       266 1 28 GLN H    1 28 GLN QG   1.800 . 5.000 2.937 1.974 4.361     .  0 0 "[    .    1    .    2]" 1 
       267 1 28 GLN HA   1 29 ASP H    1.800 . 3.500 3.024 2.464 3.553 0.053  4 0 "[    .    1    .    2]" 1 
       268 1 28 GLN HB2  1 29 ASP H    1.800 . 3.500 2.604 1.731 3.611 0.111  7 0 "[    .    1    .    2]" 1 
       269 1 28 GLN HB3  1 29 ASP H    1.800 . 3.500 2.320 1.756 3.716 0.216 16 0 "[    .    1    .    2]" 1 
       270 1 28 GLN QG   1 29 ASP H    1.800 . 3.500 3.167 1.753 3.705 0.205  8 0 "[    .    1    .    2]" 1 
       271 1 28 GLN QG   1 46 TYR QD   1.800 . 5.000 4.607 3.654 5.101 0.101 12 0 "[    .    1    .    2]" 1 
       272 1 29 ASP H    1 29 ASP HA   1.800 . 2.900 2.978 2.875 2.988 0.088  1 0 "[    .    1    .    2]" 1 
       273 1 29 ASP H    1 29 ASP HB2  1.800 . 3.500 2.455 2.111 2.629     .  0 0 "[    .    1    .    2]" 1 
       274 1 29 ASP H    1 29 ASP HB3  1.800 . 3.500 3.589 3.411 3.684 0.184  4 0 "[    .    1    .    2]" 1 
       275 1 29 ASP H    1 30 PRO HD2  1.800 . 5.000 4.677 4.464 4.975     .  0 0 "[    .    1    .    2]" 1 
       276 1 29 ASP H    1 30 PRO HD3  1.800 . 5.000 3.639 3.303 4.874     .  0 0 "[    .    1    .    2]" 1 
       277 1 29 ASP H    1 32 LYS H    1.800 . 5.000 4.912 4.753 4.999     .  0 0 "[    .    1    .    2]" 1 
       278 1 29 ASP QB   1 32 LYS H    1.800 . 2.900 2.722 2.627 2.798     .  0 0 "[    .    1    .    2]" 1 
       279 1 29 ASP HB2  1 32 LYS QB   1.800 . 3.500 3.517 3.429 3.552 0.052 17 0 "[    .    1    .    2]" 1 
       280 1 29 ASP HB3  1 31 ASP H    1.800 . 2.900 3.005 2.914 3.042 0.142 18 0 "[    .    1    .    2]" 1 
       281 1 29 ASP HB3  1 32 LYS QB   1.800 . 3.500 3.483 3.370 3.611 0.111 12 0 "[    .    1    .    2]" 1 
       282 1 30 PRO HA   1 30 PRO QG   1.800 . 3.500 2.992 2.951 3.504 0.004  5 0 "[    .    1    .    2]" 1 
       283 1 30 PRO HA   1 31 ASP H    1.800 . 3.500 3.465 3.442 3.518 0.018  5 0 "[    .    1    .    2]" 1 
       284 1 30 PRO HA   1 32 LYS H    1.800 . 5.000 3.998 3.874 4.063     .  0 0 "[    .    1    .    2]" 1 
       285 1 30 PRO HA   1 33 GLN H    1.800 . 5.000 3.363 3.222 3.779     .  0 0 "[    .    1    .    2]" 1 
       286 1 30 PRO HB2  1 31 ASP H    1.800 . 3.500 3.248 3.183 3.397     .  0 0 "[    .    1    .    2]" 1 
       287 1 30 PRO HB3  1 31 ASP H    1.800 . 5.000 4.356 4.248 4.388     .  0 0 "[    .    1    .    2]" 1 
       288 1 30 PRO HD2  1 31 ASP H    1.800 . 5.000 3.020 2.722 3.070     .  0 0 "[    .    1    .    2]" 1 
       289 1 30 PRO HD3  1 31 ASP H    1.800 . 5.000 4.057 3.926 4.095     .  0 0 "[    .    1    .    2]" 1 
       290 1 30 PRO QG   1 31 ASP H    1.800 . 5.000 4.032 2.690 4.128     .  0 0 "[    .    1    .    2]" 1 
       291 1 31 ASP H    1 31 ASP HA   1.800 . 2.900 2.893 2.864 2.899     .  0 0 "[    .    1    .    2]" 1 
       292 1 31 ASP H    1 31 ASP QB   1.800 . 2.900 2.386 2.280 2.413     .  0 0 "[    .    1    .    2]" 1 
       293 1 31 ASP H    1 32 LYS H    1.800 . 2.900 2.516 2.475 2.606     .  0 0 "[    .    1    .    2]" 1 
       294 1 31 ASP H    1 32 LYS QB   1.800 . 5.000 4.672 4.563 4.750     .  0 0 "[    .    1    .    2]" 1 
       295 1 31 ASP H    1 32 LYS HG2  1.800 . 5.000 5.140 5.098 5.212 0.212  4 0 "[    .    1    .    2]" 1 
       296 1 31 ASP H    1 32 LYS HG3  1.800 . 5.000 4.027 3.874 4.298     .  0 0 "[    .    1    .    2]" 1 
       297 1 31 ASP H    1 33 GLN H    1.800 . 5.000 3.883 3.806 4.107     .  0 0 "[    .    1    .    2]" 1 
       298 1 31 ASP HA   1 32 LYS H    1.800 . 3.500 3.505 3.471 3.521 0.021 15 0 "[    .    1    .    2]" 1 
       299 1 31 ASP QB   1 32 LYS H    1.800 . 2.900 2.762 2.741 2.850     .  0 0 "[    .    1    .    2]" 1 
       300 1 31 ASP QB   1 33 GLN H    1.800 . 5.000 4.430 4.377 4.484     .  0 0 "[    .    1    .    2]" 1 
       301 1 32 LYS H    1 32 LYS HA   1.800 . 2.900 2.944 2.929 2.957 0.057 15 0 "[    .    1    .    2]" 1 
       302 1 32 LYS H    1 32 LYS HB2  1.800 . 3.500 2.532 2.463 2.576     .  0 0 "[    .    1    .    2]" 1 
       303 1 32 LYS H    1 32 LYS HB3  1.800 . 3.500 3.638 3.612 3.670 0.170 15 0 "[    .    1    .    2]" 1 
       304 1 32 LYS H    1 32 LYS QE   1.800 . 5.000 4.561 3.806 5.023 0.023  8 0 "[    .    1    .    2]" 1 
       305 1 32 LYS H    1 32 LYS HG2  1.800 . 3.500 3.170 3.043 3.288     .  0 0 "[    .    1    .    2]" 1 
       306 1 32 LYS H    1 32 LYS HG3  1.800 . 3.500 2.311 2.166 2.560     .  0 0 "[    .    1    .    2]" 1 
       307 1 32 LYS H    1 33 GLN H    1.800 . 2.900 2.475 2.407 2.661     .  0 0 "[    .    1    .    2]" 1 
       308 1 32 LYS H    1 33 GLN HA   1.800 . 5.000 4.944 4.863 5.017 0.017  5 0 "[    .    1    .    2]" 1 
       309 1 32 LYS H    1 33 GLN QG   1.800 . 3.500 3.482 3.339 3.564 0.064 19 0 "[    .    1    .    2]" 1 
       310 1 32 LYS HA   1 33 GLN H    1.800 . 3.500 3.250 3.183 3.290     .  0 0 "[    .    1    .    2]" 1 
       311 1 32 LYS QB   1 33 GLN H    1.800 . 5.000 3.448 3.370 3.560     .  0 0 "[    .    1    .    2]" 1 
       312 1 32 LYS HB2  1 45 ILE MD   1.800 . 5.000 4.828 3.919 5.074 0.074  9 0 "[    .    1    .    2]" 1 
       313 1 32 LYS HB3  1 45 ILE MD   1.800 . 5.000 4.183 3.803 4.496     .  0 0 "[    .    1    .    2]" 1 
       314 1 32 LYS QE   1 32 LYS HG2  1.800 . 3.500 2.481 2.222 3.317     .  0 0 "[    .    1    .    2]" 1 
       315 1 32 LYS QE   1 32 LYS HG3  1.800 . 3.500 3.114 2.269 3.530 0.030  8 0 "[    .    1    .    2]" 1 
       316 1 32 LYS QE   1 45 ILE MD   1.800 . 5.000 4.979 4.722 5.075 0.075  3 0 "[    .    1    .    2]" 1 
       317 1 33 GLN H    1 33 GLN HA   1.800 . 2.900 2.964 2.946 2.974 0.074 19 0 "[    .    1    .    2]" 1 
       318 1 33 GLN H    1 33 GLN HB2  1.800 . 3.500 2.450 2.384 2.487     .  0 0 "[    .    1    .    2]" 1 
       319 1 33 GLN H    1 33 GLN HB3  1.800 . 3.500 3.660 3.622 3.684 0.184 20 0 "[    .    1    .    2]" 1 
       320 1 33 GLN H    1 33 GLN HG2  1.800 . 5.000 3.806 3.712 3.962     .  0 0 "[    .    1    .    2]" 1 
       321 1 33 GLN H    1 33 GLN HG3  1.800 . 5.000 2.636 2.523 2.806     .  0 0 "[    .    1    .    2]" 1 
       322 1 33 GLN H    1 34 LEU H    1.800 . 5.000 4.572 4.540 4.607     .  0 0 "[    .    1    .    2]" 1 
       323 1 33 GLN HA   1 34 LEU H    1.800 . 3.500 2.338 2.307 2.362     .  0 0 "[    .    1    .    2]" 1 
       324 1 33 GLN HA   1 44 HIS HA   1.800 . 6.000 5.523 4.991 6.073 0.073 18 0 "[    .    1    .    2]" 1 
       325 1 33 GLN HB2  1 34 LEU H    1.800 . 5.000 3.863 3.813 3.932     .  0 0 "[    .    1    .    2]" 1 
       326 1 33 GLN HB3  1 34 LEU H    1.800 . 5.000 2.743 2.704 2.813     .  0 0 "[    .    1    .    2]" 1 
       327 1 33 GLN QG   1 34 LEU H    1.800 . 5.000 3.920 3.830 3.990     .  0 0 "[    .    1    .    2]" 1 
       328 1 33 GLN QG   1 44 HIS HA   1.800 . 6.000 4.139 3.800 4.331     .  0 0 "[    .    1    .    2]" 1 
       329 1 33 GLN QG   1 44 HIS QB   1.800 . 6.000 5.933 5.607 6.105 0.105 19 0 "[    .    1    .    2]" 1 
       330 1 34 LEU H    1 34 LEU HA   1.800 . 2.900 2.980 2.976 2.982 0.082 18 0 "[    .    1    .    2]" 1 
       331 1 34 LEU H    1 34 LEU MD1  1.800 . 5.000 3.043 1.856 4.260     .  0 0 "[    .    1    .    2]" 1 
       332 1 34 LEU H    1 34 LEU MD2  1.800 . 5.000 3.110 2.055 4.432     .  0 0 "[    .    1    .    2]" 1 
       333 1 34 LEU H    1 34 LEU HG   1.800 . 5.000 2.936 1.765 4.491 0.035 18 0 "[    .    1    .    2]" 1 
       334 1 34 LEU H    1 35 MET QG   1.800 . 5.000 4.906 4.579 5.049 0.049 16 0 "[    .    1    .    2]" 1 
       335 1 34 LEU H    1 43 PHE QB   1.800 . 5.000 3.464 2.880 4.185     .  0 0 "[    .    1    .    2]" 1 
       336 1 34 LEU HA   1 34 LEU MD1  1.800 . 5.000 3.333 2.206 4.060     .  0 0 "[    .    1    .    2]" 1 
       337 1 34 LEU HA   1 34 LEU MD2  1.800 . 5.000 3.133 2.322 3.735     .  0 0 "[    .    1    .    2]" 1 
       338 1 34 LEU HA   1 35 MET H    1.800 . 2.900 2.235 2.205 2.259     .  0 0 "[    .    1    .    2]" 1 
       339 1 34 LEU QB   1 43 PHE QB   1.800 . 5.000 3.293 2.334 4.639     .  0 0 "[    .    1    .    2]" 1 
       340 1 34 LEU HB2  1 34 LEU MD1  1.800 . 3.500 2.270 2.114 2.450     .  0 0 "[    .    1    .    2]" 1 
       341 1 34 LEU HB2  1 34 LEU MD2  1.800 . 3.500 2.827 2.358 3.184     .  0 0 "[    .    1    .    2]" 1 
       342 1 34 LEU HB2  1 35 MET H    1.800 . 5.000 3.834 3.336 4.433     .  0 0 "[    .    1    .    2]" 1 
       343 1 34 LEU HB3  1 34 LEU MD1  1.800 . 3.500 2.760 2.242 3.200     .  0 0 "[    .    1    .    2]" 1 
       344 1 34 LEU HB3  1 34 LEU MD2  1.800 . 3.500 2.256 2.112 2.344     .  0 0 "[    .    1    .    2]" 1 
       345 1 34 LEU HB3  1 35 MET H    1.800 . 5.000 3.431 3.108 3.990     .  0 0 "[    .    1    .    2]" 1 
       346 1 34 LEU QD   1 45 ILE MD   1.800 . 5.000 2.051 1.825 2.776     .  0 0 "[    .    1    .    2]" 1 
       347 1 34 LEU QD   1 52 LEU QD   1.800 . 5.000 3.419 3.010 3.884     .  0 0 "[    .    1    .    2]" 1 
       348 1 34 LEU QD   1 55 VAL H    1.800 . 5.000 3.830 3.408 4.421     .  0 0 "[    .    1    .    2]" 1 
       349 1 34 LEU MD1  1 35 MET H    1.800 . 5.000 4.708 3.573 5.088 0.088  8 0 "[    .    1    .    2]" 1 
       350 1 34 LEU MD1  1 45 ILE HA   1.800 . 6.000 5.494 5.146 6.143 0.143  5 0 "[    .    1    .    2]" 1 
       351 1 34 LEU MD1  1 45 ILE MG   1.800 . 5.000 2.817 2.162 3.673     .  0 0 "[    .    1    .    2]" 1 
       352 1 34 LEU MD1  1 55 VAL MG1  1.800 . 5.000 3.173 1.962 4.476     .  0 0 "[    .    1    .    2]" 1 
       353 1 34 LEU MD1  1 55 VAL MG2  1.800 . 6.000 3.289 2.060 4.379     .  0 0 "[    .    1    .    2]" 1 
       354 1 34 LEU MD1  1 56 PRO QD   1.800 . 3.500 2.698 1.979 3.567 0.067 12 0 "[    .    1    .    2]" 1 
       355 1 34 LEU MD1  1 56 PRO QG   1.800 . 5.000 3.917 2.225 5.018 0.018  4 0 "[    .    1    .    2]" 1 
       356 1 34 LEU MD2  1 35 MET H    1.800 . 5.000 4.526 3.751 4.904     .  0 0 "[    .    1    .    2]" 1 
       357 1 34 LEU MD2  1 45 ILE HA   1.800 . 6.000 5.873 5.571 6.129 0.129 12 0 "[    .    1    .    2]" 1 
       358 1 34 LEU MD2  1 45 ILE MG   1.800 . 3.500 3.286 2.727 3.559 0.059 14 0 "[    .    1    .    2]" 1 
       359 1 34 LEU MD2  1 55 VAL QG   1.800 . 5.000 2.631 2.097 4.167     .  0 0 "[    .    1    .    2]" 1 
       360 1 34 LEU MD2  1 56 PRO QD   1.800 . 3.500 2.788 1.976 3.513 0.013  2 0 "[    .    1    .    2]" 1 
       361 1 34 LEU MD2  1 56 PRO QG   1.800 . 5.000 4.082 2.200 5.016 0.016 18 0 "[    .    1    .    2]" 1 
       362 1 34 LEU HG   1 35 MET H    1.800 . 5.000 4.397 2.368 5.148 0.148  1 0 "[    .    1    .    2]" 1 
       363 1 35 MET H    1 35 MET QB   1.800 . 3.500 2.428 2.391 2.509     .  0 0 "[    .    1    .    2]" 1 
       364 1 35 MET H    1 35 MET QG   1.800 . 3.500 2.694 2.599 2.784     .  0 0 "[    .    1    .    2]" 1 
       365 1 35 MET H    1 36 CYS H    1.800 . 5.000 4.557 4.538 4.571     .  0 0 "[    .    1    .    2]" 1 
       366 1 35 MET HA   1 35 MET ME   1.800 . 5.000 3.326 2.682 4.153     .  0 0 "[    .    1    .    2]" 1 
       367 1 35 MET HA   1 35 MET QG   1.800 . 3.500 2.477 2.268 2.864     .  0 0 "[    .    1    .    2]" 1 
       368 1 35 MET HA   1 36 CYS H    1.800 . 2.900 2.236 2.210 2.266     .  0 0 "[    .    1    .    2]" 1 
       369 1 35 MET HA   1 42 ALA HA   1.800 . 2.900 2.468 2.283 2.602     .  0 0 "[    .    1    .    2]" 1 
       370 1 35 MET HA   1 43 PHE H    1.800 . 5.000 4.057 3.675 4.224     .  0 0 "[    .    1    .    2]" 1 
       371 1 35 MET QB   1 36 CYS H    1.800 . 2.900 2.944 2.909 2.975 0.075  7 0 "[    .    1    .    2]" 1 
       372 1 35 MET ME   1 37 ASP HA   1.800 . 5.000 4.993 4.762 5.068 0.068  7 0 "[    .    1    .    2]" 1 
       373 1 35 MET ME   1 40 ASP HA   1.800 . 2.900 2.847 2.534 3.019 0.119 18 0 "[    .    1    .    2]" 1 
       374 1 35 MET ME   1 40 ASP QB   1.800 . 5.000 3.092 2.686 3.351     .  0 0 "[    .    1    .    2]" 1 
       375 1 35 MET QG   1 36 CYS H    1.800 . 5.000 4.149 3.904 4.513     .  0 0 "[    .    1    .    2]" 1 
       376 1 35 MET QG   1 42 ALA MB   1.800 . 5.000 3.148 2.329 3.750     .  0 0 "[    .    1    .    2]" 1 
       377 1 36 CYS H    1 36 CYS HA   1.800 . 2.900 2.967 2.929 2.981 0.081  8 0 "[    .    1    .    2]" 1 
       378 1 36 CYS H    1 36 CYS HB2  1.800 . 3.500 3.168 2.824 3.391     .  0 0 "[    .    1    .    2]" 1 
       379 1 36 CYS H    1 36 CYS HB3  1.800 . 3.500 2.350 2.194 2.459     .  0 0 "[    .    1    .    2]" 1 
       380 1 36 CYS H    1 40 ASP H    1.800 . 5.000 3.978 3.771 4.289     .  0 0 "[    .    1    .    2]" 1 
       381 1 36 CYS H    1 40 ASP HA   1.800 . 3.500 3.538 3.368 3.597 0.097 11 0 "[    .    1    .    2]" 1 
       382 1 36 CYS H    1 41 MET H    1.800 . 3.500 2.532 2.378 2.713     .  0 0 "[    .    1    .    2]" 1 
       383 1 36 CYS H    1 42 ALA HA   1.800 . 5.000 3.853 3.633 3.966     .  0 0 "[    .    1    .    2]" 1 
       384 1 36 CYS H    1 42 ALA MB   1.800 . 5.000 5.081 4.822 5.174 0.174 12 0 "[    .    1    .    2]" 1 
       385 1 36 CYS HA   1 37 ASP H    1.800 . 3.500 2.178 2.150 2.201     .  0 0 "[    .    1    .    2]" 1 
       386 1 36 CYS HA   1 63 CYS H    1.800 . 5.000 4.562 3.705 5.058 0.058 18 0 "[    .    1    .    2]" 1 
       387 1 36 CYS QB   1 41 MET H    1.800 . 5.000 2.695 2.149 3.110     .  0 0 "[    .    1    .    2]" 1 
       388 1 36 CYS HB2  1 37 ASP H    1.800 . 5.000 4.140 3.872 4.399     .  0 0 "[    .    1    .    2]" 1 
       389 1 36 CYS HB2  1 38 GLU H    1.800 . 5.000 4.622 4.281 4.948     .  0 0 "[    .    1    .    2]" 1 
       390 1 36 CYS HB2  1 61 TRP HE1  1.800 . 5.000 3.380 2.256 4.202     .  0 0 "[    .    1    .    2]" 1 
       391 1 36 CYS HB2  1 63 CYS H    1.800 . 5.000 2.744 2.330 2.949     .  0 0 "[    .    1    .    2]" 1 
       392 1 36 CYS HB3  1 37 ASP H    1.800 . 5.000 4.435 4.355 4.489     .  0 0 "[    .    1    .    2]" 1 
       393 1 36 CYS HB3  1 38 GLU H    1.800 . 5.000 4.529 4.276 4.671     .  0 0 "[    .    1    .    2]" 1 
       394 1 36 CYS HB3  1 61 TRP HE1  1.800 . 5.000 4.521 3.160 5.059 0.059  6 0 "[    .    1    .    2]" 1 
       395 1 36 CYS HB3  1 63 CYS H    1.800 . 5.000 3.620 3.537 3.696     .  0 0 "[    .    1    .    2]" 1 
       396 1 37 ASP H    1 37 ASP HA   1.800 . 2.900 2.834 2.822 2.855     .  0 0 "[    .    1    .    2]" 1 
       397 1 37 ASP H    1 37 ASP HB2  1.800 . 3.500 2.476 2.421 2.543     .  0 0 "[    .    1    .    2]" 1 
       398 1 37 ASP H    1 37 ASP HB3  1.800 . 3.500 2.606 2.516 2.690     .  0 0 "[    .    1    .    2]" 1 
       399 1 37 ASP H    1 38 GLU H    1.800 . 2.900 2.802 2.753 2.872     .  0 0 "[    .    1    .    2]" 1 
       400 1 37 ASP H    1 39 CYS H    1.800 . 5.000 4.501 4.461 4.554     .  0 0 "[    .    1    .    2]" 1 
       401 1 37 ASP H    1 40 ASP H    1.800 . 5.000 4.415 4.380 4.458     .  0 0 "[    .    1    .    2]" 1 
       402 1 37 ASP H    1 62 TYR H    1.800 . 6.000 5.882 5.175 6.150 0.150 16 0 "[    .    1    .    2]" 1 
       403 1 37 ASP H    1 62 TYR HA   1.800 . 5.000 4.207 3.516 4.547     .  0 0 "[    .    1    .    2]" 1 
       404 1 37 ASP H    1 62 TYR QE   1.800 . 5.000 4.153 3.502 4.908     .  0 0 "[    .    1    .    2]" 1 
       405 1 37 ASP HA   1 38 GLU H    1.800 . 3.500 3.541 3.526 3.551 0.051 12 0 "[    .    1    .    2]" 1 
       406 1 37 ASP HA   1 39 CYS H    1.800 . 5.000 4.501 4.116 4.756     .  0 0 "[    .    1    .    2]" 1 
       407 1 37 ASP HA   1 40 ASP HA   1.800 . 5.000 3.500 3.302 3.736     .  0 0 "[    .    1    .    2]" 1 
       408 1 37 ASP HB2  1 61 TRP H    1.800 . 5.000 4.584 4.036 4.935     .  0 0 "[    .    1    .    2]" 1 
       409 1 37 ASP HB3  1 61 TRP H    1.800 . 5.000 5.040 4.945 5.108 0.108  8 0 "[    .    1    .    2]" 1 
       410 1 38 GLU H    1 38 GLU HA   1.800 . 2.900 2.874 2.848 2.898     .  0 0 "[    .    1    .    2]" 1 
       411 1 38 GLU H    1 38 GLU HB2  1.800 . 2.900 2.569 2.527 2.622     .  0 0 "[    .    1    .    2]" 1 
       412 1 38 GLU H    1 38 GLU HB3  1.800 . 2.900 2.572 2.539 2.626     .  0 0 "[    .    1    .    2]" 1 
       413 1 38 GLU H    1 39 CYS H    1.800 . 3.500 2.696 2.647 2.725     .  0 0 "[    .    1    .    2]" 1 
       414 1 38 GLU H    1 39 CYS QB   1.800 . 5.000 5.043 4.943 5.142 0.142  3 0 "[    .    1    .    2]" 1 
       415 1 38 GLU H    1 40 ASP H    1.800 . 3.500 3.638 3.606 3.672 0.172 17 0 "[    .    1    .    2]" 1 
       416 1 38 GLU H    1 62 TYR HA   1.800 . 5.000 4.025 3.779 4.298     .  0 0 "[    .    1    .    2]" 1 
       417 1 38 GLU H    1 62 TYR QD   1.800 . 3.500 2.674 2.285 3.463     .  0 0 "[    .    1    .    2]" 1 
       418 1 38 GLU H    1 62 TYR QE   1.800 . 3.500 2.663 2.118 3.331     .  0 0 "[    .    1    .    2]" 1 
       419 1 38 GLU HA   1 38 GLU HG2  1.800 . 3.500 3.102 2.958 3.675 0.175  3 0 "[    .    1    .    2]" 1 
       420 1 38 GLU HA   1 38 GLU HG3  1.800 . 3.500 2.552 2.462 2.937     .  0 0 "[    .    1    .    2]" 1 
       421 1 38 GLU HA   1 39 CYS H    1.800 . 3.500 3.554 3.519 3.570 0.070 13 0 "[    .    1    .    2]" 1 
       422 1 38 GLU HB2  1 39 CYS H    1.800 . 5.000 3.925 3.841 4.091     .  0 0 "[    .    1    .    2]" 1 
       423 1 38 GLU HB2  1 62 TYR QD   1.800 . 2.900 2.539 2.255 2.951 0.051  7 0 "[    .    1    .    2]" 1 
       424 1 38 GLU HB2  1 62 TYR QE   1.800 . 3.500 2.291 2.246 2.408     .  0 0 "[    .    1    .    2]" 1 
       425 1 38 GLU HB3  1 39 CYS H    1.800 . 2.900 2.661 2.541 2.911 0.011  5 0 "[    .    1    .    2]" 1 
       426 1 38 GLU HB3  1 62 TYR QD   1.800 . 2.900 2.545 2.277 2.922 0.022  7 0 "[    .    1    .    2]" 1 
       427 1 38 GLU HB3  1 62 TYR QE   1.800 . 3.500 3.579 3.541 3.661 0.161  5 0 "[    .    1    .    2]" 1 
       428 1 38 GLU QG   1 39 CYS H    1.800 . 5.000 3.653 3.578 3.747     .  0 0 "[    .    1    .    2]" 1 
       429 1 39 CYS H    1 39 CYS HA   1.800 . 2.900 2.977 2.971 2.986 0.086  3 0 "[    .    1    .    2]" 1 
       430 1 39 CYS H    1 40 ASP H    1.800 . 2.900 2.026 1.819 2.175     .  0 0 "[    .    1    .    2]" 1 
       431 1 39 CYS HA   1 40 ASP H    1.800 . 3.500 3.368 3.266 3.425     .  0 0 "[    .    1    .    2]" 1 
       432 1 39 CYS HA   1 41 MET H    1.800 . 5.000 4.817 4.634 5.018 0.018 17 0 "[    .    1    .    2]" 1 
       433 1 39 CYS QB   1 41 MET H    1.800 . 5.000 3.221 2.644 4.335     .  0 0 "[    .    1    .    2]" 1 
       434 1 39 CYS HB2  1 40 ASP H    1.800 . 5.000 3.517 3.052 4.430     .  0 0 "[    .    1    .    2]" 1 
       435 1 39 CYS HB3  1 40 ASP H    1.800 . 5.000 4.222 4.092 4.325     .  0 0 "[    .    1    .    2]" 1 
       436 1 40 ASP H    1 40 ASP HA   1.800 . 2.900 2.347 2.338 2.355     .  0 0 "[    .    1    .    2]" 1 
       437 1 40 ASP H    1 41 MET H    1.800 . 3.500 2.820 2.753 2.931     .  0 0 "[    .    1    .    2]" 1 
       438 1 40 ASP HA   1 41 MET H    1.800 . 3.500 2.812 2.766 2.862     .  0 0 "[    .    1    .    2]" 1 
       439 1 40 ASP QB   1 41 MET H    1.800 . 5.000 3.872 3.839 3.897     .  0 0 "[    .    1    .    2]" 1 
       440 1 41 MET H    1 41 MET HA   1.800 . 2.900 2.979 2.970 2.987 0.087 20 0 "[    .    1    .    2]" 1 
       441 1 41 MET H    1 41 MET HB2  1.800 . 3.500 2.748 2.459 3.181     .  0 0 "[    .    1    .    2]" 1 
       442 1 41 MET H    1 41 MET HB3  1.800 . 3.500 3.332 2.650 3.778 0.278  4 0 "[    .    1    .    2]" 1 
       443 1 41 MET H    1 41 MET QG   1.800 . 5.000 3.410 2.864 4.119     .  0 0 "[    .    1    .    2]" 1 
       444 1 41 MET H    1 42 ALA H    1.800 . 5.000 4.500 4.458 4.559     .  0 0 "[    .    1    .    2]" 1 
       445 1 41 MET H    1 42 ALA HA   1.800 . 5.000 4.864 4.743 4.991     .  0 0 "[    .    1    .    2]" 1 
       446 1 41 MET HA   1 41 MET ME   1.800 . 5.000 3.378 2.343 3.760     .  0 0 "[    .    1    .    2]" 1 
       447 1 41 MET HA   1 41 MET HG2  1.800 . 3.500 2.702 2.243 3.320     .  0 0 "[    .    1    .    2]" 1 
       448 1 41 MET HA   1 41 MET HG3  1.800 . 3.500 2.889 2.251 3.674 0.174 10 0 "[    .    1    .    2]" 1 
       449 1 41 MET HA   1 42 ALA H    1.800 . 3.500 2.434 2.321 2.531     .  0 0 "[    .    1    .    2]" 1 
       450 1 41 MET QB   1 41 MET ME   1.800 . 2.900 2.194 2.074 2.624     .  0 0 "[    .    1    .    2]" 1 
       451 1 41 MET HB2  1 42 ALA H    1.800 . 5.000 3.837 3.572 4.045     .  0 0 "[    .    1    .    2]" 1 
       452 1 41 MET HB3  1 42 ALA H    1.800 . 5.000 2.979 2.403 3.821     .  0 0 "[    .    1    .    2]" 1 
       453 1 41 MET ME   1 41 MET QG   1.800 . 2.900 2.201 2.163 2.308     .  0 0 "[    .    1    .    2]" 1 
       454 1 42 ALA H    1 42 ALA HA   1.800 . 2.900 2.964 2.954 2.978 0.078  3 0 "[    .    1    .    2]" 1 
       455 1 42 ALA H    1 42 ALA MB   1.800 . 2.900 2.217 2.168 2.380     .  0 0 "[    .    1    .    2]" 1 
       456 1 42 ALA HA   1 43 PHE H    1.800 . 2.900 2.302 2.249 2.338     .  0 0 "[    .    1    .    2]" 1 
       457 1 42 ALA HA   1 43 PHE QD   1.800 . 6.000 5.576 5.381 5.808     .  0 0 "[    .    1    .    2]" 1 
       458 1 42 ALA MB   1 43 PHE H    1.800 . 2.900 2.794 2.673 2.907 0.007 10 0 "[    .    1    .    2]" 1 
       459 1 43 PHE H    1 43 PHE HA   1.800 . 2.900 2.971 2.949 2.984 0.084  5 0 "[    .    1    .    2]" 1 
       460 1 43 PHE H    1 43 PHE QB   1.800 . 2.900 2.385 2.269 2.495     .  0 0 "[    .    1    .    2]" 1 
       461 1 43 PHE H    1 43 PHE QD   1.800 . 5.000 4.247 4.132 4.331     .  0 0 "[    .    1    .    2]" 1 
       462 1 43 PHE H    1 44 HIS H    1.800 . 5.000 4.573 4.526 4.607     .  0 0 "[    .    1    .    2]" 1 
       463 1 43 PHE HA   1 43 PHE QD   1.800 . 5.000 2.861 2.629 3.007     .  0 0 "[    .    1    .    2]" 1 
       464 1 43 PHE HA   1 44 HIS H    1.800 . 2.900 2.384 2.275 2.515     .  0 0 "[    .    1    .    2]" 1 
       465 1 43 PHE QB   1 44 HIS H    1.800 . 3.500 3.255 3.168 3.441     .  0 0 "[    .    1    .    2]" 1 
       466 1 43 PHE QB   1 48 LEU QD   1.800 . 6.000 5.537 4.931 5.962     .  0 0 "[    .    1    .    2]" 1 
       467 1 43 PHE QD   1 45 ILE MD   1.800 . 5.000 4.933 4.664 5.107 0.107  2 0 "[    .    1    .    2]" 1 
       468 1 43 PHE QD   1 48 LEU QD   1.800 . 5.000 4.126 3.347 4.620     .  0 0 "[    .    1    .    2]" 1 
       469 1 44 HIS H    1 44 HIS HA   1.800 . 2.900 2.917 2.906 2.928 0.028 16 0 "[    .    1    .    2]" 1 
       470 1 44 HIS H    1 44 HIS QB   1.800 . 2.900 2.130 2.093 2.248     .  0 0 "[    .    1    .    2]" 1 
       471 1 44 HIS H    1 45 ILE HG12 1.800 . 6.000 5.500 4.927 5.875     .  0 0 "[    .    1    .    2]" 1 
       472 1 44 HIS H    1 45 ILE HG13 1.800 . 5.000 4.978 4.622 5.088 0.088  5 0 "[    .    1    .    2]" 1 
       473 1 44 HIS H    1 47 CYS H    1.800 . 6.000 5.129 5.039 5.205     .  0 0 "[    .    1    .    2]" 1 
       474 1 44 HIS H    1 47 CYS QB   1.800 . 6.000 4.679 4.429 5.079     .  0 0 "[    .    1    .    2]" 1 
       475 1 44 HIS H    1 48 LEU QD   1.800 . 5.000 4.240 3.709 4.759     .  0 0 "[    .    1    .    2]" 1 
       476 1 44 HIS HA   1 45 ILE H    1.800 . 3.500 3.214 3.175 3.297     .  0 0 "[    .    1    .    2]" 1 
       477 1 44 HIS HA   1 45 ILE QG   1.800 . 5.000 4.088 3.882 4.326     .  0 0 "[    .    1    .    2]" 1 
       478 1 44 HIS HA   1 45 ILE MG   1.800 . 5.000 4.910 4.823 5.051 0.051  3 0 "[    .    1    .    2]" 1 
       479 1 44 HIS QB   1 44 HIS HD2  1.800 . 3.500 3.108 2.674 3.285     .  0 0 "[    .    1    .    2]" 1 
       480 1 44 HIS QB   1 45 ILE H    1.800 . 5.000 3.575 3.422 3.621     .  0 0 "[    .    1    .    2]" 1 
       481 1 44 HIS QB   1 45 ILE QG   1.800 . 5.000 4.953 4.804 5.036 0.036  6 0 "[    .    1    .    2]" 1 
       482 1 44 HIS QB   1 46 TYR QD   1.800 . 6.000 5.829 4.559 6.120 0.120 14 0 "[    .    1    .    2]" 1 
       483 1 45 ILE H    1 45 ILE HA   1.800 . 2.900 2.749 2.716 2.783     .  0 0 "[    .    1    .    2]" 1 
       484 1 45 ILE H    1 45 ILE MD   1.800 . 5.000 3.939 3.872 3.983     .  0 0 "[    .    1    .    2]" 1 
       485 1 45 ILE H    1 45 ILE HG12 1.800 . 3.500 3.025 2.529 3.237     .  0 0 "[    .    1    .    2]" 1 
       486 1 45 ILE H    1 45 ILE HG13 1.800 . 3.500 2.445 2.328 2.584     .  0 0 "[    .    1    .    2]" 1 
       487 1 45 ILE H    1 45 ILE MG   1.800 . 3.500 2.205 2.106 2.372     .  0 0 "[    .    1    .    2]" 1 
       488 1 45 ILE H    1 46 TYR H    1.800 . 3.500 3.001 2.843 3.092     .  0 0 "[    .    1    .    2]" 1 
       489 1 45 ILE H    1 48 LEU HG   1.800 . 5.000 4.828 4.391 5.084 0.084  3 0 "[    .    1    .    2]" 1 
       490 1 45 ILE HA   1 45 ILE MD   1.800 . 5.000 3.759 3.618 4.030     .  0 0 "[    .    1    .    2]" 1 
       491 1 45 ILE HA   1 45 ILE HG13 1.800 . 3.500 3.517 3.498 3.534 0.034 16 0 "[    .    1    .    2]" 1 
       492 1 45 ILE HA   1 45 ILE MG   1.800 . 3.500 2.249 2.172 2.300     .  0 0 "[    .    1    .    2]" 1 
       493 1 45 ILE HA   1 46 TYR H    1.800 . 5.000 3.550 3.469 3.582     .  0 0 "[    .    1    .    2]" 1 
       494 1 45 ILE HA   1 48 LEU QB   1.800 . 5.000 4.855 4.150 5.036 0.036 18 0 "[    .    1    .    2]" 1 
       495 1 45 ILE HA   1 48 LEU QD   1.800 . 2.900 2.769 2.056 2.998 0.098 20 0 "[    .    1    .    2]" 1 
       496 1 45 ILE HA   1 52 LEU QD   1.800 . 5.000 2.830 2.384 3.952     .  0 0 "[    .    1    .    2]" 1 
       497 1 45 ILE HA   1 52 LEU HG   1.800 . 5.000 4.854 4.143 5.150 0.150 13 0 "[    .    1    .    2]" 1 
       498 1 45 ILE HB   1 45 ILE MD   1.800 . 2.900 2.124 2.100 2.143     .  0 0 "[    .    1    .    2]" 1 
       499 1 45 ILE HB   1 46 TYR H    1.800 . 5.000 3.771 3.647 4.064     .  0 0 "[    .    1    .    2]" 1 
       500 1 45 ILE HB   1 52 LEU HB2  1.800 . 6.000 2.702 2.248 5.312     .  0 0 "[    .    1    .    2]" 1 
       501 1 45 ILE HB   1 52 LEU HB3  1.800 . 6.000 2.546 2.227 5.651     .  0 0 "[    .    1    .    2]" 1 
       502 1 45 ILE HB   1 54 SER H    1.800 . 6.000 4.807 4.036 5.348     .  0 0 "[    .    1    .    2]" 1 
       503 1 45 ILE MD   1 54 SER HA   1.800 . 6.000 6.050 6.012 6.098 0.098  3 0 "[    .    1    .    2]" 1 
       504 1 45 ILE HG12 1 45 ILE MG   1.800 . 2.900 2.001 1.905 2.116     .  0 0 "[    .    1    .    2]" 1 
       505 1 45 ILE HG12 1 46 TYR H    1.800 . 5.000 3.567 3.469 3.912     .  0 0 "[    .    1    .    2]" 1 
       506 1 45 ILE HG13 1 45 ILE MG   1.800 . 2.900 2.816 2.698 3.015 0.115  5 0 "[    .    1    .    2]" 1 
       507 1 45 ILE HG13 1 46 TYR H    1.800 . 3.500 1.833 1.752 2.170 0.048  8 0 "[    .    1    .    2]" 1 
       508 1 45 ILE MG   1 46 TYR H    1.800 . 5.000 3.959 3.872 4.077     .  0 0 "[    .    1    .    2]" 1 
       509 1 45 ILE MG   1 54 SER H    1.800 . 6.000 5.545 4.598 6.055 0.055 10 0 "[    .    1    .    2]" 1 
       510 1 45 ILE MG   1 55 VAL H    1.800 . 5.000 4.768 3.566 5.062 0.062  4 0 "[    .    1    .    2]" 1 
       511 1 46 TYR H    1 46 TYR HA   1.800 . 2.900 2.974 2.932 2.988 0.088  2 0 "[    .    1    .    2]" 1 
       512 1 46 TYR H    1 46 TYR HB2  1.800 . 3.500 3.368 3.212 3.671 0.171 12 0 "[    .    1    .    2]" 1 
       513 1 46 TYR H    1 46 TYR HB3  1.800 . 3.500 2.326 2.161 2.461     .  0 0 "[    .    1    .    2]" 1 
       514 1 46 TYR H    1 52 LEU H    1.800 . 6.000 4.804 4.530 5.891     .  0 0 "[    .    1    .    2]" 1 
       515 1 46 TYR HA   1 47 CYS H    1.800 . 3.500 3.401 3.298 3.455     .  0 0 "[    .    1    .    2]" 1 
       516 1 46 TYR HA   1 48 LEU H    1.800 . 5.000 4.032 3.531 4.437     .  0 0 "[    .    1    .    2]" 1 
       517 1 46 TYR HA   1 53 SER H    1.800 . 6.000 3.901 3.415 5.063     .  0 0 "[    .    1    .    2]" 1 
       518 1 46 TYR HB2  1 46 TYR QD   1.800 . 2.900 2.381 2.308 2.507     .  0 0 "[    .    1    .    2]" 1 
       519 1 46 TYR HB3  1 46 TYR QD   1.800 . 2.900 2.477 2.349 2.720     .  0 0 "[    .    1    .    2]" 1 
       520 1 46 TYR QE   1 47 CYS QB   1.800 . 5.000 4.594 3.247 5.074 0.074  5 0 "[    .    1    .    2]" 1 
       521 1 47 CYS H    1 47 CYS HB2  1.800 . 3.500 2.244 2.118 2.779     .  0 0 "[    .    1    .    2]" 1 
       522 1 47 CYS H    1 47 CYS HB3  1.800 . 3.500 3.304 2.592 3.673 0.173  5 0 "[    .    1    .    2]" 1 
       523 1 47 CYS H    1 48 LEU H    1.800 . 3.500 2.432 2.252 2.544     .  0 0 "[    .    1    .    2]" 1 
       524 1 47 CYS HA   1 48 LEU H    1.800 . 3.500 3.486 3.196 3.550 0.050  5 0 "[    .    1    .    2]" 1 
       525 1 47 CYS QB   1 48 LEU QB   1.800 . 6.000 4.843 4.417 5.225     .  0 0 "[    .    1    .    2]" 1 
       526 1 47 CYS QB   1 48 LEU HG   1.800 . 5.000 4.068 3.819 4.666     .  0 0 "[    .    1    .    2]" 1 
       527 1 47 CYS HB2  1 48 LEU H    1.800 . 5.000 3.422 2.724 4.071     .  0 0 "[    .    1    .    2]" 1 
       528 1 47 CYS HB3  1 48 LEU H    1.800 . 5.000 3.497 3.032 3.968     .  0 0 "[    .    1    .    2]" 1 
       529 1 48 LEU H    1 48 LEU HA   1.800 . 2.900 2.853 2.779 2.899     .  0 0 "[    .    1    .    2]" 1 
       530 1 48 LEU H    1 48 LEU HB2  1.800 . 3.500 2.896 2.749 3.625 0.125 18 0 "[    .    1    .    2]" 1 
       531 1 48 LEU H    1 48 LEU HB3  1.800 . 3.500 3.536 2.909 3.619 0.119  2 0 "[    .    1    .    2]" 1 
       532 1 48 LEU H    1 48 LEU QD   1.800 . 3.500 2.514 2.042 2.715     .  0 0 "[    .    1    .    2]" 1 
       533 1 48 LEU H    1 48 LEU HG   1.800 . 3.500 1.758 1.701 1.792 0.099  3 0 "[    .    1    .    2]" 1 
       534 1 48 LEU H    1 49 ASP H    1.800 . 5.000 4.702 4.658 4.732     .  0 0 "[    .    1    .    2]" 1 
       535 1 48 LEU H    1 52 LEU H    1.800 . 5.000 5.020 4.695 5.141 0.141 19 0 "[    .    1    .    2]" 1 
       536 1 48 LEU HA   1 48 LEU MD1  1.800 . 5.000 3.847 3.798 3.910     .  0 0 "[    .    1    .    2]" 1 
       537 1 48 LEU HA   1 48 LEU MD2  1.800 . 5.000 2.331 2.136 3.910     .  0 0 "[    .    1    .    2]" 1 
       538 1 48 LEU HA   1 49 ASP H    1.800 . 3.500 2.422 2.361 2.501     .  0 0 "[    .    1    .    2]" 1 
       539 1 48 LEU QB   1 48 LEU QD   1.800 . 3.500 1.913 1.840 1.947     .  0 0 "[    .    1    .    2]" 1 
       540 1 48 LEU QB   1 49 ASP H    1.800 . 3.500 2.630 2.308 2.755     .  0 0 "[    .    1    .    2]" 1 
       541 1 48 LEU HB2  1 49 ASP H    1.800 . 3.500 3.399 2.337 3.560 0.060  1 0 "[    .    1    .    2]" 1 
       542 1 48 LEU HB3  1 49 ASP H    1.800 . 3.500 2.840 2.700 3.574 0.074 18 0 "[    .    1    .    2]" 1 
       543 1 48 LEU QD   1 49 ASP H    1.800 . 5.000 3.644 3.242 3.799     .  0 0 "[    .    1    .    2]" 1 
       544 1 48 LEU QD   1 49 ASP HA   1.800 . 6.000 5.325 4.355 5.475     .  0 0 "[    .    1    .    2]" 1 
       545 1 48 LEU QD   1 51 PRO HA   1.800 . 5.000 4.812 3.848 5.018 0.018  4 0 "[    .    1    .    2]" 1 
       546 1 48 LEU HG   1 49 ASP H    1.800 . 5.000 5.023 4.453 5.135 0.135  6 0 "[    .    1    .    2]" 1 
       547 1 48 LEU HG   1 51 PRO HA   1.800 . 5.000 5.106 4.602 5.369 0.369  3 0 "[    .    1    .    2]" 1 
       548 1 49 ASP H    1 49 ASP HA   1.800 . 2.900 2.790 2.760 2.812     .  0 0 "[    .    1    .    2]" 1 
       549 1 49 ASP H    1 49 ASP HB2  1.800 . 3.500 2.524 2.153 3.411     .  0 0 "[    .    1    .    2]" 1 
       550 1 49 ASP H    1 49 ASP HB3  1.800 . 3.500 3.313 2.193 3.565 0.065 19 0 "[    .    1    .    2]" 1 
       551 1 49 ASP HA   1 50 PRO HA   1.800 . 5.000 4.760 4.753 4.789     .  0 0 "[    .    1    .    2]" 1 
       552 1 50 PRO HA   1 50 PRO QD   1.800 . 3.500 3.467 3.307 3.490     .  0 0 "[    .    1    .    2]" 1 
       553 1 50 PRO HA   1 50 PRO QG   1.800 . 3.500 3.515 3.495 3.519 0.019  6 0 "[    .    1    .    2]" 1 
       554 1 50 PRO HB2  1 50 PRO QD   1.800 . 3.500 3.556 3.544 3.560 0.060 13 0 "[    .    1    .    2]" 1 
       555 1 50 PRO HB3  1 50 PRO QD   1.800 . 3.500 2.972 2.923 3.011     .  0 0 "[    .    1    .    2]" 1 
       556 1 51 PRO HA   1 52 LEU H    1.800 . 2.900 2.248 2.198 2.433     .  0 0 "[    .    1    .    2]" 1 
       557 1 51 PRO HA   1 52 LEU QB   1.800 . 5.000 4.147 4.105 4.285     .  0 0 "[    .    1    .    2]" 1 
       558 1 51 PRO HB2  1 52 LEU H    1.800 . 5.000 3.649 2.946 4.245     .  0 0 "[    .    1    .    2]" 1 
       559 1 51 PRO HB3  1 52 LEU H    1.800 . 5.000 4.128 3.513 4.572     .  0 0 "[    .    1    .    2]" 1 
       560 1 51 PRO QD   1 52 LEU H    1.800 . 5.000 4.892 4.522 4.995     .  0 0 "[    .    1    .    2]" 1 
       561 1 52 LEU H    1 52 LEU HA   1.800 . 2.900 2.830 2.713 2.867     .  0 0 "[    .    1    .    2]" 1 
       562 1 52 LEU H    1 52 LEU HB2  1.800 . 3.500 2.274 2.128 2.457     .  0 0 "[    .    1    .    2]" 1 
       563 1 52 LEU H    1 52 LEU MD1  1.800 . 5.000 4.111 3.948 4.303     .  0 0 "[    .    1    .    2]" 1 
       564 1 52 LEU H    1 52 LEU MD2  1.800 . 5.000 4.273 4.131 4.348     .  0 0 "[    .    1    .    2]" 1 
       565 1 52 LEU H    1 52 LEU HG   1.800 . 5.000 4.229 3.949 4.457     .  0 0 "[    .    1    .    2]" 1 
       566 1 52 LEU HA   1 52 LEU QD   1.800 . 3.500 2.590 2.149 3.032     .  0 0 "[    .    1    .    2]" 1 
       567 1 52 LEU HA   1 53 SER H    1.800 . 3.500 3.541 3.520 3.569 0.069 11 0 "[    .    1    .    2]" 1 
       568 1 52 LEU HB2  1 52 LEU MD2  1.800 . 3.500 3.051 2.630 3.189     .  0 0 "[    .    1    .    2]" 1 
       569 1 52 LEU HB2  1 53 SER H    1.800 . 5.000 3.494 3.136 3.656     .  0 0 "[    .    1    .    2]" 1 
       570 1 52 LEU HB2  1 54 SER H    1.800 . 5.000 4.250 4.053 4.730     .  0 0 "[    .    1    .    2]" 1 
       571 1 52 LEU HB3  1 52 LEU QD   1.800 . 3.500 2.064 2.025 2.115     .  0 0 "[    .    1    .    2]" 1 
       572 1 52 LEU HB3  1 53 SER H    1.800 . 5.000 2.345 1.650 2.659 0.150  3 0 "[    .    1    .    2]" 1 
       573 1 52 LEU HB3  1 54 SER H    1.800 . 5.000 2.913 2.557 3.775     .  0 0 "[    .    1    .    2]" 1 
       574 1 52 LEU QD   1 53 SER H    1.800 . 5.000 3.286 2.276 3.603     .  0 0 "[    .    1    .    2]" 1 
       575 1 52 LEU QD   1 54 SER H    1.800 . 5.000 1.796 1.669 2.478 0.131  1 0 "[    .    1    .    2]" 1 
       576 1 52 LEU QD   1 55 VAL HB   1.800 . 5.000 4.888 3.751 5.204 0.204 10 0 "[    .    1    .    2]" 1 
       577 1 52 LEU MD1  1 56 PRO QD   1.800 . 3.500 3.172 2.191 3.675 0.175  8 0 "[    .    1    .    2]" 1 
       578 1 52 LEU MD2  1 56 PRO QD   1.800 . 3.500 2.560 1.941 3.600 0.100 10 0 "[    .    1    .    2]" 1 
       579 1 53 SER H    1 53 SER QB   1.800 . 3.500 3.029 2.791 3.528 0.028  1 0 "[    .    1    .    2]" 1 
       580 1 53 SER H    1 54 SER H    1.800 . 2.900 2.981 2.861 3.105 0.205  7 0 "[    .    1    .    2]" 1 
       581 1 53 SER HA   1 54 SER H    1.800 . 3.500 3.328 3.177 3.513 0.013  1 0 "[    .    1    .    2]" 1 
       582 1 53 SER QB   1 54 SER H    1.800 . 5.000 3.384 2.937 3.715     .  0 0 "[    .    1    .    2]" 1 
       583 1 54 SER H    1 54 SER HA   1.800 . 2.900 2.924 2.892 2.969 0.069 17 0 "[    .    1    .    2]" 1 
       584 1 54 SER H    1 54 SER QB   1.800 . 2.900 2.363 2.170 2.680     .  0 0 "[    .    1    .    2]" 1 
       585 1 54 SER H    1 55 VAL H    1.800 . 2.900 2.428 2.187 2.610     .  0 0 "[    .    1    .    2]" 1 
       586 1 54 SER HA   1 55 VAL H    1.800 . 3.500 3.491 3.273 3.532 0.032 10 0 "[    .    1    .    2]" 1 
       587 1 54 SER HA   1 55 VAL QG   1.800 . 5.000 4.074 3.588 4.528     .  0 0 "[    .    1    .    2]" 1 
       588 1 54 SER HA   1 55 VAL MG2  1.800 . 5.000 4.202 3.633 4.792     .  0 0 "[    .    1    .    2]" 1 
       589 1 54 SER QB   1 55 VAL H    1.800 . 3.500 3.033 2.648 3.544 0.044 11 0 "[    .    1    .    2]" 1 
       590 1 55 VAL H    1 55 VAL HA   1.800 . 2.900 2.363 2.347 2.407     .  0 0 "[    .    1    .    2]" 1 
       591 1 55 VAL H    1 55 VAL HB   1.800 . 3.500 3.456 3.211 3.576 0.076 13 0 "[    .    1    .    2]" 1 
       592 1 55 VAL H    1 55 VAL MG1  1.800 . 5.000 3.998 3.910 4.074     .  0 0 "[    .    1    .    2]" 1 
       593 1 55 VAL H    1 55 VAL MG2  1.800 . 3.500 2.435 2.204 2.703     .  0 0 "[    .    1    .    2]" 1 
       594 1 55 VAL HA   1 55 VAL MG1  1.800 . 2.900 2.329 2.246 2.440     .  0 0 "[    .    1    .    2]" 1 
       595 1 55 VAL HA   1 55 VAL MG2  1.800 . 2.900 2.340 2.202 2.465     .  0 0 "[    .    1    .    2]" 1 
       596 1 55 VAL HA   1 56 PRO HD2  1.800 . 3.500 2.309 2.269 2.474     .  0 0 "[    .    1    .    2]" 1 
       597 1 55 VAL QG   1 56 PRO HD2  1.800 . 5.000 3.373 3.111 3.629     .  0 0 "[    .    1    .    2]" 1 
       598 1 55 VAL QG   1 56 PRO HD3  1.800 . 5.000 3.736 3.655 3.872     .  0 0 "[    .    1    .    2]" 1 
       599 1 55 VAL MG1  1 56 PRO QD   1.800 . 5.000 3.374 3.069 3.626     .  0 0 "[    .    1    .    2]" 1 
       600 1 55 VAL MG1  1 57 SER HA   1.800 . 5.000 4.078 2.894 4.338     .  0 0 "[    .    1    .    2]" 1 
       601 1 56 PRO HA   1 56 PRO QG   1.800 . 3.500 2.934 2.891 2.969     .  0 0 "[    .    1    .    2]" 1 
       602 1 56 PRO HA   1 57 SER H    1.800 . 3.500 3.521 3.441 3.582 0.082  3 0 "[    .    1    .    2]" 1 
       603 1 56 PRO HB2  1 57 SER H    1.800 . 5.000 2.980 2.497 3.267     .  0 0 "[    .    1    .    2]" 1 
       604 1 56 PRO HB3  1 57 SER H    1.800 . 5.000 4.212 3.908 4.369     .  0 0 "[    .    1    .    2]" 1 
       605 1 57 SER H    1 57 SER HA   1.800 . 2.900 2.944 2.351 2.991 0.091 16 0 "[    .    1    .    2]" 1 
       606 1 57 SER H    1 57 SER QB   1.800 . 3.500 2.855 2.527 3.116     .  0 0 "[    .    1    .    2]" 1 
       607 1 57 SER H    1 58 GLU H    1.800 . 5.000 4.402 3.117 4.531     .  0 0 "[    .    1    .    2]" 1 
       608 1 57 SER H    1 59 ASP HA   1.800 . 6.000 5.156 5.041 5.214     .  0 0 "[    .    1    .    2]" 1 
       609 1 57 SER HA   1 58 GLU H    1.800 . 3.500 2.488 2.362 3.511 0.011  1 0 "[    .    1    .    2]" 1 
       610 1 57 SER QB   1 58 GLU H    1.800 . 3.500 2.731 2.388 3.461     .  0 0 "[    .    1    .    2]" 1 
       611 1 58 GLU H    1 58 GLU HA   1.800 . 2.900 2.821 2.808 2.840     .  0 0 "[    .    1    .    2]" 1 
       612 1 58 GLU H    1 58 GLU QB   1.800 . 2.900 2.493 2.463 2.515     .  0 0 "[    .    1    .    2]" 1 
       613 1 58 GLU H    1 58 GLU HG2  1.800 . 3.500 3.281 3.248 3.320     .  0 0 "[    .    1    .    2]" 1 
       614 1 58 GLU H    1 58 GLU HG3  1.800 . 3.500 2.094 2.065 2.128     .  0 0 "[    .    1    .    2]" 1 
       615 1 58 GLU H    1 59 ASP QB   1.800 . 5.000 5.017 4.760 5.055 0.055 14 0 "[    .    1    .    2]" 1 
       616 1 58 GLU H    1 60 GLU H    1.800 . 5.000 4.200 3.948 4.931     .  0 0 "[    .    1    .    2]" 1 
       617 1 58 GLU HA   1 58 GLU HB2  1.800 . 2.900 3.027 3.025 3.029 0.129  6 0 "[    .    1    .    2]" 1 
       618 1 58 GLU HA   1 58 GLU HB3  1.800 . 2.900 2.491 2.488 2.494     .  0 0 "[    .    1    .    2]" 1 
       619 1 58 GLU HA   1 58 GLU HG2  1.800 . 3.500 2.447 2.439 2.453     .  0 0 "[    .    1    .    2]" 1 
       620 1 58 GLU HA   1 58 GLU HG3  1.800 . 3.500 3.053 3.046 3.063     .  0 0 "[    .    1    .    2]" 1 
       621 1 58 GLU HA   1 59 ASP H    1.800 . 3.500 3.522 3.496 3.535 0.035 10 0 "[    .    1    .    2]" 1 
       622 1 58 GLU QB   1 59 ASP H    1.800 . 5.000 2.626 2.538 2.764     .  0 0 "[    .    1    .    2]" 1 
       623 1 58 GLU HG2  1 59 ASP H    1.800 . 5.000 4.952 4.923 5.002 0.002  1 0 "[    .    1    .    2]" 1 
       624 1 58 GLU HG3  1 59 ASP H    1.800 . 5.000 4.251 4.229 4.317     .  0 0 "[    .    1    .    2]" 1 
       625 1 59 ASP H    1 59 ASP HA   1.800 . 2.900 2.822 2.336 2.858     .  0 0 "[    .    1    .    2]" 1 
       626 1 59 ASP H    1 59 ASP HB3  1.800 . 3.500 3.253 3.206 3.584 0.084  1 0 "[    .    1    .    2]" 1 
       627 1 59 ASP H    1 60 GLU H    1.800 . 3.500 1.972 1.763 2.871 0.037  3 0 "[    .    1    .    2]" 1 
       628 1 59 ASP H    1 60 GLU QB   1.800 . 5.000 3.920 3.662 4.869     .  0 0 "[    .    1    .    2]" 1 
       629 1 59 ASP HA   1 60 GLU H    1.800 . 3.500 3.518 3.329 3.579 0.079 15 0 "[    .    1    .    2]" 1 
       630 1 59 ASP HB2  1 60 GLU H    1.800 . 5.000 3.919 3.399 4.339     .  0 0 "[    .    1    .    2]" 1 
       631 1 59 ASP HB3  1 60 GLU H    1.800 . 3.500 2.776 2.062 3.490     .  0 0 "[    .    1    .    2]" 1 
       632 1 60 GLU H    1 60 GLU HA   1.800 . 2.900 2.937 2.840 2.982 0.082  1 0 "[    .    1    .    2]" 1 
       633 1 60 GLU H    1 60 GLU QB   1.800 . 2.900 2.362 2.301 2.422     .  0 0 "[    .    1    .    2]" 1 
       634 1 60 GLU H    1 60 GLU QG   1.800 . 5.000 3.694 2.341 4.065     .  0 0 "[    .    1    .    2]" 1 
       635 1 60 GLU H    1 61 TRP H    1.800 . 5.000 4.547 4.198 4.655     .  0 0 "[    .    1    .    2]" 1 
       636 1 60 GLU HA   1 60 GLU QG   1.800 . 2.900 2.360 2.233 2.784     .  0 0 "[    .    1    .    2]" 1 
       637 1 60 GLU HA   1 61 TRP H    1.800 . 3.500 2.217 2.200 2.243     .  0 0 "[    .    1    .    2]" 1 
       638 1 60 GLU QB   1 61 TRP H    1.800 . 5.000 3.555 2.824 3.960     .  0 0 "[    .    1    .    2]" 1 
       639 1 60 GLU QG   1 61 TRP H    1.800 . 3.500 2.839 2.504 3.726 0.226  2 0 "[    .    1    .    2]" 1 
       640 1 61 TRP H    1 61 TRP HA   1.800 . 2.900 2.883 2.764 2.964 0.064 18 0 "[    .    1    .    2]" 1 
       641 1 61 TRP H    1 61 TRP QB   1.800 . 3.500 3.015 2.627 3.254     .  0 0 "[    .    1    .    2]" 1 
       642 1 61 TRP H    1 62 TYR H    1.800 . 5.000 4.338 4.076 4.416     .  0 0 "[    .    1    .    2]" 1 
       643 1 61 TRP HA   1 61 TRP HD1  1.800 . 5.000 4.115 3.886 4.398     .  0 0 "[    .    1    .    2]" 1 
       644 1 61 TRP HA   1 62 TYR H    1.800 . 3.500 2.515 2.245 2.998     .  0 0 "[    .    1    .    2]" 1 
       645 1 61 TRP HA   1 62 TYR QD   1.800 . 5.000 4.055 3.720 4.356     .  0 0 "[    .    1    .    2]" 1 
       646 1 61 TRP QB   1 61 TRP HD1  1.800 . 3.500 2.824 2.547 3.015     .  0 0 "[    .    1    .    2]" 1 
       647 1 61 TRP QB   1 62 TYR H    1.800 . 5.000 2.851 1.978 3.552     .  0 0 "[    .    1    .    2]" 1 
       648 1 61 TRP HE1  1 62 TYR HA   1.800 . 6.000 4.669 4.216 5.261     .  0 0 "[    .    1    .    2]" 1 
       649 1 62 TYR H    1 62 TYR HA   1.800 . 2.900 2.978 2.968 2.982 0.082 12 0 "[    .    1    .    2]" 1 
       650 1 62 TYR H    1 63 CYS H    1.800 . 5.000 4.495 4.449 4.577     .  0 0 "[    .    1    .    2]" 1 
       651 1 62 TYR HA   1 63 CYS H    1.800 . 3.500 2.274 2.235 2.308     .  0 0 "[    .    1    .    2]" 1 
       652 1 62 TYR QB   1 68 ASN H    1.800 . 6.000 5.716 5.230 6.064 0.064 14 0 "[    .    1    .    2]" 1 
       653 1 62 TYR HB2  1 62 TYR QD   1.800 . 2.900 2.309 2.288 2.341     .  0 0 "[    .    1    .    2]" 1 
       654 1 62 TYR HB2  1 67 ARG HA   1.800 . 6.000 4.200 3.108 5.275     .  0 0 "[    .    1    .    2]" 1 
       655 1 62 TYR HB2  1 67 ARG QB   1.800 . 5.000 3.402 3.164 3.709     .  0 0 "[    .    1    .    2]" 1 
       656 1 62 TYR HB3  1 62 TYR QD   1.800 . 2.900 2.590 2.502 2.652     .  0 0 "[    .    1    .    2]" 1 
       657 1 62 TYR HB3  1 67 ARG HA   1.800 . 6.000 3.682 2.367 4.655     .  0 0 "[    .    1    .    2]" 1 
       658 1 62 TYR HB3  1 67 ARG QB   1.800 . 5.000 3.363 2.408 3.711     .  0 0 "[    .    1    .    2]" 1 
       659 1 62 TYR QE   1 67 ARG QD   1.800 . 5.000 5.023 4.477 5.121 0.121 13 0 "[    .    1    .    2]" 1 
       660 1 63 CYS H    1 63 CYS HB2  1.800 . 3.500 3.260 2.916 3.631 0.131 13 0 "[    .    1    .    2]" 1 
       661 1 63 CYS H    1 63 CYS HB3  1.800 . 3.500 3.154 2.507 3.580 0.080 16 0 "[    .    1    .    2]" 1 
       662 1 63 CYS H    1 64 PRO QD   1.800 . 5.000 4.429 4.423 4.446     .  0 0 "[    .    1    .    2]" 1 
       663 1 63 CYS H    1 66 CYS H    1.800 . 5.000 4.044 3.606 4.664     .  0 0 "[    .    1    .    2]" 1 
       664 1 63 CYS H    1 66 CYS QB   1.800 . 5.000 3.814 2.353 4.931     .  0 0 "[    .    1    .    2]" 1 
       665 1 63 CYS H    1 67 ARG H    1.800 . 5.000 4.700 4.186 5.012 0.012 19 0 "[    .    1    .    2]" 1 
       666 1 63 CYS HA   1 64 PRO QD   1.800 . 2.900 2.091 2.077 2.102     .  0 0 "[    .    1    .    2]" 1 
       667 1 63 CYS QB   1 64 PRO QD   1.800 . 2.900 2.272 2.213 2.476     .  0 0 "[    .    1    .    2]" 1 
       668 1 64 PRO HA   1 64 PRO HD2  1.800 . 5.000 4.032 3.930 4.087     .  0 0 "[    .    1    .    2]" 1 
       669 1 64 PRO HA   1 64 PRO HD3  1.800 . 5.000 3.400 3.331 3.547     .  0 0 "[    .    1    .    2]" 1 
       670 1 64 PRO HA   1 64 PRO QG   1.800 . 3.500 3.350 2.938 3.500 0.000 16 0 "[    .    1    .    2]" 1 
       671 1 64 PRO HA   1 65 GLU H    1.800 . 3.500 3.512 3.446 3.553 0.053  7 0 "[    .    1    .    2]" 1 
       672 1 64 PRO HA   1 66 CYS H    1.800 . 5.000 4.329 4.077 4.883     .  0 0 "[    .    1    .    2]" 1 
       673 1 64 PRO HA   1 67 ARG H    1.800 . 5.000 3.233 2.912 3.742     .  0 0 "[    .    1    .    2]" 1 
       674 1 64 PRO HA   1 67 ARG HB2  1.800 . 5.000 2.867 2.328 3.802     .  0 0 "[    .    1    .    2]" 1 
       675 1 64 PRO HA   1 67 ARG HB3  1.800 . 5.000 2.555 2.260 3.296     .  0 0 "[    .    1    .    2]" 1 
       676 1 64 PRO HA   1 68 ASN H    1.800 . 5.000 4.459 4.072 4.949     .  0 0 "[    .    1    .    2]" 1 
       677 1 64 PRO QB   1 64 PRO QD   1.800 . 3.500 2.861 2.818 2.939     .  0 0 "[    .    1    .    2]" 1 
       678 1 64 PRO QB   1 65 GLU H    1.800 . 5.000 3.125 2.687 3.451     .  0 0 "[    .    1    .    2]" 1 
       679 1 65 GLU H    1 65 GLU HA   1.800 . 2.900 2.889 2.872 2.916 0.016 16 0 "[    .    1    .    2]" 1 
       680 1 65 GLU H    1 65 GLU QB   1.800 . 3.500 2.339 2.280 2.478     .  0 0 "[    .    1    .    2]" 1 
       681 1 65 GLU H    1 65 GLU QG   1.800 . 5.000 3.412 2.043 3.988     .  0 0 "[    .    1    .    2]" 1 
       682 1 65 GLU H    1 66 CYS HA   1.800 . 5.000 5.202 5.175 5.254 0.254 19 0 "[    .    1    .    2]" 1 
       683 1 65 GLU HA   1 65 GLU HG2  1.800 . 3.500 2.808 2.446 2.979     .  0 0 "[    .    1    .    2]" 1 
       684 1 65 GLU HA   1 65 GLU HG3  1.800 . 3.500 2.675 2.495 3.115     .  0 0 "[    .    1    .    2]" 1 
       685 1 65 GLU HA   1 66 CYS H    1.800 . 3.500 3.532 3.516 3.561 0.061 16 0 "[    .    1    .    2]" 1 
       686 1 65 GLU HA   1 67 ARG H    1.800 . 5.000 4.221 4.008 4.379     .  0 0 "[    .    1    .    2]" 1 
       687 1 65 GLU HA   1 68 ASN H    1.800 . 5.000 4.133 3.418 4.711     .  0 0 "[    .    1    .    2]" 1 
       688 1 65 GLU QB   1 66 CYS H    1.800 . 3.500 2.596 2.362 2.675     .  0 0 "[    .    1    .    2]" 1 
       689 1 65 GLU QB   1 67 ARG H    1.800 . 6.000 4.485 4.381 4.708     .  0 0 "[    .    1    .    2]" 1 
       690 1 65 GLU QG   1 67 ARG H    1.800 . 5.000 5.113 5.003 5.226 0.226  5 0 "[    .    1    .    2]" 1 
       691 1 65 GLU HG2  1 66 CYS H    1.800 . 5.000 4.154 3.611 4.915     .  0 0 "[    .    1    .    2]" 1 
       692 1 65 GLU HG3  1 66 CYS H    1.800 . 5.000 4.610 4.029 4.873     .  0 0 "[    .    1    .    2]" 1 
       693 1 66 CYS H    1 66 CYS HA   1.800 . 2.900 2.926 2.852 2.960 0.060 13 0 "[    .    1    .    2]" 1 
       694 1 66 CYS H    1 66 CYS HB2  1.800 . 3.500 3.315 2.179 3.712 0.212 13 0 "[    .    1    .    2]" 1 
       695 1 66 CYS H    1 66 CYS HB3  1.800 . 3.500 2.917 2.251 3.621 0.121  3 0 "[    .    1    .    2]" 1 
       696 1 66 CYS HA   1 67 ARG H    1.800 . 3.500 3.417 3.260 3.528 0.028 10 0 "[    .    1    .    2]" 1 
       697 1 66 CYS HA   1 68 ASN H    1.800 . 5.000 3.662 3.423 3.978     .  0 0 "[    .    1    .    2]" 1 
       698 1 66 CYS HA   1 69 ASP H    1.800 . 6.000 4.626 3.879 6.173 0.173  3 0 "[    .    1    .    2]" 1 
       699 1 66 CYS HB2  1 67 ARG H    1.800 . 5.000 3.901 2.842 4.478     .  0 0 "[    .    1    .    2]" 1 
       700 1 66 CYS HB3  1 67 ARG H    1.800 . 5.000 4.025 3.332 4.281     .  0 0 "[    .    1    .    2]" 1 
       701 1 67 ARG H    1 67 ARG HA   1.800 . 2.900 2.904 2.884 2.952 0.052 11 0 "[    .    1    .    2]" 1 
       702 1 67 ARG H    1 67 ARG HB2  1.800 . 3.500 2.466 2.176 2.596     .  0 0 "[    .    1    .    2]" 1 
       703 1 67 ARG H    1 67 ARG HB3  1.800 . 3.500 2.709 2.508 3.121     .  0 0 "[    .    1    .    2]" 1 
       704 1 67 ARG H    1 67 ARG QD   1.800 . 5.000 4.241 4.050 4.606     .  0 0 "[    .    1    .    2]" 1 
       705 1 67 ARG H    1 67 ARG QG   1.800 . 5.000 4.015 3.699 4.114     .  0 0 "[    .    1    .    2]" 1 
       706 1 67 ARG HA   1 67 ARG QD   1.800 . 2.900 2.198 2.175 2.261     .  0 0 "[    .    1    .    2]" 1 
       707 1 67 ARG HA   1 67 ARG QG   1.800 . 2.900 2.589 2.236 2.833     .  0 0 "[    .    1    .    2]" 1 
       708 1 67 ARG HA   1 68 ASN H    1.800 . 3.500 3.410 3.226 3.468     .  0 0 "[    .    1    .    2]" 1 
       709 1 67 ARG QB   1 69 ASP H    1.800 . 5.000 4.314 2.539 5.048 0.048 14 0 "[    .    1    .    2]" 1 
       710 1 67 ARG HB2  1 68 ASN H    1.800 . 5.000 4.050 3.947 4.265     .  0 0 "[    .    1    .    2]" 1 
       711 1 67 ARG HB3  1 68 ASN H    1.800 . 5.000 3.198 2.995 3.759     .  0 0 "[    .    1    .    2]" 1 
       712 1 67 ARG QD   1 68 ASN H    1.800 . 5.000 4.926 4.557 5.077 0.077  7 0 "[    .    1    .    2]" 1 
       713 1 67 ARG QD   1 69 ASP H    1.800 . 5.000 4.780 3.779 5.118 0.118  3 0 "[    .    1    .    2]" 1 
       714 1 67 ARG QG   1 68 ASN H    1.800 . 5.000 4.226 3.944 4.864     .  0 0 "[    .    1    .    2]" 1 
       715 1 67 ARG QG   1 69 ASP H    1.800 . 5.000 4.397 3.163 5.023 0.023 13 0 "[    .    1    .    2]" 1 
       716 1 68 ASN H    1 68 ASN HA   1.800 . 2.900 2.865 2.340 2.932 0.032 15 0 "[    .    1    .    2]" 1 
       717 1 68 ASN H    1 68 ASN HB2  1.800 . 3.500 2.604 2.440 3.631 0.131  7 0 "[    .    1    .    2]" 1 
       718 1 68 ASN H    1 68 ASN HB3  1.800 . 3.500 3.333 2.512 3.649 0.149  3 0 "[    .    1    .    2]" 1 
       719 1 68 ASN HA   1 69 ASP H    1.800 . 2.900 3.023 2.426 3.125 0.225 16 0 "[    .    1    .    2]" 1 
       720 1 68 ASN QB   1 69 ASP H    1.800 . 5.000 3.666 3.558 4.051     .  0 0 "[    .    1    .    2]" 1 
    stop_

save_



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

Contact the webmaster for help, if required. Saturday, June 1, 2024 1:42:39 AM GMT (wattos1)