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
433837 2jvf 15478 cing 4-filtered-FRED Wattos check violation distance


data_2jvf


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              949
    _Distance_constraint_stats_list.Viol_count                    581
    _Distance_constraint_stats_list.Viol_total                    477.849
    _Distance_constraint_stats_list.Viol_max                      0.298
    _Distance_constraint_stats_list.Viol_rms                      0.0096
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0013
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0411
    _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  5 LYS 0.680 0.186 11 0 "[    .    1    .    2]" 
       1  6 VAL 0.858 0.112 12 0 "[    .    1    .    2]" 
       1  7 ASP 0.218 0.077 16 0 "[    .    1    .    2]" 
       1  8 ILE 0.602 0.086 20 0 "[    .    1    .    2]" 
       1  9 THR 0.223 0.073  7 0 "[    .    1    .    2]" 
       1 10 ILE 0.108 0.079  1 0 "[    .    1    .    2]" 
       1 11 LYS 1.055 0.142 13 0 "[    .    1    .    2]" 
       1 12 ILE 0.076 0.056 13 0 "[    .    1    .    2]" 
       1 13 GLN 0.036 0.036 13 0 "[    .    1    .    2]" 
       1 14 ARG 0.920 0.267 12 0 "[    .    1    .    2]" 
       1 15 ASP 0.752 0.298 19 0 "[    .    1    .    2]" 
       1 16 GLY 0.450 0.298 19 0 "[    .    1    .    2]" 
       1 17 GLN 0.695 0.072  2 0 "[    .    1    .    2]" 
       1 18 GLU 0.019 0.019 16 0 "[    .    1    .    2]" 
       1 19 ILE 0.265 0.071 13 0 "[    .    1    .    2]" 
       1 20 GLU 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 21 ILE 1.297 0.142 13 0 "[    .    1    .    2]" 
       1 22 ASP 0.296 0.072 17 0 "[    .    1    .    2]" 
       1 23 ILE 0.070 0.064 17 0 "[    .    1    .    2]" 
       1 24 ARG 0.187 0.077 16 0 "[    .    1    .    2]" 
       1 25 VAL 0.186 0.085  9 0 "[    .    1    .    2]" 
       1 26 SER 0.386 0.113  3 0 "[    .    1    .    2]" 
       1 27 THR 0.322 0.113  3 0 "[    .    1    .    2]" 
       1 28 GLY 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 29 LYS 0.427 0.148 16 0 "[    .    1    .    2]" 
       1 30 GLU 0.304 0.154 18 0 "[    .    1    .    2]" 
       1 31 LEU 0.582 0.154 18 0 "[    .    1    .    2]" 
       1 32 GLU 0.936 0.152 13 0 "[    .    1    .    2]" 
       1 33 ARG 0.562 0.112 10 0 "[    .    1    .    2]" 
       1 34 ALA 0.086 0.037 12 0 "[    .    1    .    2]" 
       1 35 LEU 0.273 0.055 13 0 "[    .    1    .    2]" 
       1 36 GLN 2.486 0.115  2 0 "[    .    1    .    2]" 
       1 37 GLU 0.197 0.050 13 0 "[    .    1    .    2]" 
       1 38 LEU 0.074 0.023 13 0 "[    .    1    .    2]" 
       1 39 GLU 0.337 0.057 14 0 "[    .    1    .    2]" 
       1 40 LYS 0.238 0.078 18 0 "[    .    1    .    2]" 
       1 41 ALA 0.100 0.025  1 0 "[    .    1    .    2]" 
       1 42 LEU 0.479 0.080 15 0 "[    .    1    .    2]" 
       1 43 ALA 0.522 0.082  8 0 "[    .    1    .    2]" 
       1 44 ARG 0.850 0.080  1 0 "[    .    1    .    2]" 
       1 45 ALA 0.850 0.080  1 0 "[    .    1    .    2]" 
       1 46 GLY 0.330 0.082  8 0 "[    .    1    .    2]" 
       1 47 ALA 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 48 ARG 0.007 0.007 12 0 "[    .    1    .    2]" 
       1 49 ASN 0.187 0.066 12 0 "[    .    1    .    2]" 
       1 50 VAL 0.393 0.113 12 0 "[    .    1    .    2]" 
       1 51 GLN 0.496 0.123 10 0 "[    .    1    .    2]" 
       1 52 ILE 0.045 0.040 13 0 "[    .    1    .    2]" 
       1 53 THR 0.086 0.073  7 0 "[    .    1    .    2]" 
       1 54 ILE 0.012 0.012 10 0 "[    .    1    .    2]" 
       1 55 SER 0.575 0.086 20 0 "[    .    1    .    2]" 
       1 56 ALA 0.461 0.089 17 0 "[    .    1    .    2]" 
       1 57 GLU 0.260 0.070  6 0 "[    .    1    .    2]" 
       1 58 ASN 0.818 0.120  1 0 "[    .    1    .    2]" 
       1 59 ASP 0.988 0.120  1 0 "[    .    1    .    2]" 
       1 60 GLU 0.286 0.082  6 0 "[    .    1    .    2]" 
       1 61 GLN 0.732 0.082  6 0 "[    .    1    .    2]" 
       1 62 ALA 0.133 0.058 20 0 "[    .    1    .    2]" 
       1 63 LYS 0.654 0.070  1 0 "[    .    1    .    2]" 
       1 64 GLU 0.933 0.099 13 0 "[    .    1    .    2]" 
       1 65 LEU 0.105 0.040 13 0 "[    .    1    .    2]" 
       1 66 LEU 1.061 0.188  4 0 "[    .    1    .    2]" 
       1 67 GLU 1.110 0.188  4 0 "[    .    1    .    2]" 
       1 68 LEU 1.996 0.081 18 0 "[    .    1    .    2]" 
       1 69 ILE 0.544 0.081 18 0 "[    .    1    .    2]" 
       1 70 ALA 0.068 0.023  3 0 "[    .    1    .    2]" 
       1 71 ARG 0.275 0.047 18 0 "[    .    1    .    2]" 
       1 72 LEU 1.044 0.087 13 0 "[    .    1    .    2]" 
       1 73 LEU 0.082 0.029  2 0 "[    .    1    .    2]" 
       1 74 GLN 0.363 0.036 16 0 "[    .    1    .    2]" 
       1 75 LYS 0.055 0.022  4 0 "[    .    1    .    2]" 
       1 76 LEU 0.096 0.023 13 0 "[    .    1    .    2]" 
       1 77 GLY 0.477 0.098 17 0 "[    .    1    .    2]" 
       1 78 TYR 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 79 LYS 0.012 0.012  6 0 "[    .    1    .    2]" 
       1 80 ASP 0.027 0.014 14 0 "[    .    1    .    2]" 
       1 81 ILE 1.250 0.152 19 0 "[    .    1    .    2]" 
       1 82 ASN 0.423 0.061  2 0 "[    .    1    .    2]" 
       1 83 VAL 0.043 0.043  3 0 "[    .    1    .    2]" 
       1 84 ARG 0.139 0.060 15 0 "[    .    1    .    2]" 
       1 85 VAL 0.000 0.000  . 0 "[    .    1    .    2]" 
       1 86 ASN 0.184 0.062 16 0 "[    .    1    .    2]" 
       1 87 GLY 0.040 0.033  5 0 "[    .    1    .    2]" 
       1 88 THR 1.371 0.114 15 0 "[    .    1    .    2]" 
       1 89 GLU 0.744 0.102  5 0 "[    .    1    .    2]" 
       1 90 VAL 0.115 0.062 16 0 "[    .    1    .    2]" 
       1 91 LYS 0.563 0.123 10 0 "[    .    1    .    2]" 
       1 92 ILE 0.063 0.040 13 0 "[    .    1    .    2]" 
       1 93 GLU 0.573 0.198  2 0 "[    .    1    .    2]" 
       1 94 VAL 0.003 0.003  9 0 "[    .    1    .    2]" 
       1 95 ARG 1.751 0.198  2 0 "[    .    1    .    2]" 
       1 96 VAL 0.063 0.030  8 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  5 LYS H    1  5 LYS HB2  . .  4.000 3.043 2.393 4.186 0.186 11 0 "[    .    1    .    2]" 1 
         2 1  5 LYS H    1  5 LYS HB3  . .  4.000 3.647 2.914 4.033 0.033 17 0 "[    .    1    .    2]" 1 
         3 1  5 LYS HA   1  6 VAL H    . .  3.500 2.929 2.143 3.608 0.108  5 0 "[    .    1    .    2]" 1 
         4 1  5 LYS HB2  1  6 VAL H    . .  5.000 3.430 2.002 4.679     .  0 0 "[    .    1    .    2]" 1 
         5 1  5 LYS HB3  1  6 VAL H    . .  5.000 3.267 2.005 4.591     .  0 0 "[    .    1    .    2]" 1 
         6 1  5 LYS QG   1  6 VAL H    . .  6.880 3.656 1.937 4.657     .  0 0 "[    .    1    .    2]" 1 
         7 1  6 VAL H    1  6 VAL HB   . .  3.000 2.766 2.338 3.071 0.071  8 0 "[    .    1    .    2]" 1 
         8 1  6 VAL H    1  6 VAL MG2  . .  4.000 2.842 2.026 3.251     .  0 0 "[    .    1    .    2]" 1 
         9 1  6 VAL H    1 25 VAL H    . .  5.000 4.068 3.008 5.085 0.085  9 0 "[    .    1    .    2]" 1 
        10 1  6 VAL H    1 25 VAL MG2  . .  7.000 5.312 3.764 5.795     .  0 0 "[    .    1    .    2]" 1 
        11 1  6 VAL H    1 26 SER HA   . .  6.000 4.346 2.724 6.112 0.112 12 0 "[    .    1    .    2]" 1 
        12 1  6 VAL HA   1  7 ASP H    . .  2.500 2.226 2.057 2.429     .  0 0 "[    .    1    .    2]" 1 
        13 1  6 VAL HB   1  7 ASP H    . .  6.000 4.530 4.450 4.652     .  0 0 "[    .    1    .    2]" 1 
        14 1  6 VAL HB   1 25 VAL H    . .  4.000 3.463 2.923 3.973     .  0 0 "[    .    1    .    2]" 1 
        15 1  6 VAL HB   1 26 SER HA   . .  6.000 3.647 2.429 5.081     .  0 0 "[    .    1    .    2]" 1 
        16 1  6 VAL HB   1 27 THR H    . .  6.000 4.473 2.356 6.048 0.048 16 0 "[    .    1    .    2]" 1 
        17 1  6 VAL MG1  1  7 ASP H    . .  5.000 3.618 3.161 4.037     .  0 0 "[    .    1    .    2]" 1 
        18 1  6 VAL MG1  1 25 VAL H    . .  5.000 3.676 2.931 4.156     .  0 0 "[    .    1    .    2]" 1 
        19 1  6 VAL MG2  1 27 THR H    . .  6.000 4.228 2.673 4.901     .  0 0 "[    .    1    .    2]" 1 
        20 1  6 VAL MG2  1 56 ALA HA   . .  7.000 3.438 2.292 4.835     .  0 0 "[    .    1    .    2]" 1 
        21 1  6 VAL MG2  1 57 GLU HG3  . .  7.000 3.959 2.271 5.651     .  0 0 "[    .    1    .    2]" 1 
        22 1  7 ASP H    1  7 ASP HB3  . .  4.000 2.968 2.221 3.964     .  0 0 "[    .    1    .    2]" 1 
        23 1  7 ASP H    1 55 SER H    . .  4.000 3.400 2.990 3.932     .  0 0 "[    .    1    .    2]" 1 
        24 1  7 ASP H    1 55 SER HB3  . .  6.000 3.194 2.167 4.593     .  0 0 "[    .    1    .    2]" 1 
        25 1  7 ASP HA   1  8 ILE H    . .  2.500 2.176 2.084 2.330     .  0 0 "[    .    1    .    2]" 1 
        26 1  7 ASP HA   1 24 ARG HA   . .  2.500 2.275 2.055 2.577 0.077 16 0 "[    .    1    .    2]" 1 
        27 1  7 ASP HA   1 25 VAL H    . .  5.000 3.545 3.081 4.132     .  0 0 "[    .    1    .    2]" 1 
        28 1  7 ASP HB2  1  8 ILE H    . .  6.000 4.458 3.866 4.616     .  0 0 "[    .    1    .    2]" 1 
        29 1  7 ASP HB2  1 55 SER HB2  . .  6.000 4.328 2.940 5.567     .  0 0 "[    .    1    .    2]" 1 
        30 1  7 ASP HB2  1 55 SER HB3  . .  5.000 3.146 2.053 5.031 0.031  2 0 "[    .    1    .    2]" 1 
        31 1  7 ASP HB3  1  8 ILE H    . .  6.000 4.156 3.201 4.651     .  0 0 "[    .    1    .    2]" 1 
        32 1  7 ASP HB3  1 55 SER HB2  . .  5.000 3.730 2.536 4.905     .  0 0 "[    .    1    .    2]" 1 
        33 1  7 ASP HB3  1 55 SER HB3  . .  4.000 2.786 2.060 3.966     .  0 0 "[    .    1    .    2]" 1 
        34 1  8 ILE H    1  8 ILE HB   . .  4.000 3.208 2.404 4.053 0.053  4 0 "[    .    1    .    2]" 1 
        35 1  8 ILE H    1 23 ILE H    . .  4.000 3.481 2.606 4.064 0.064 17 0 "[    .    1    .    2]" 1 
        36 1  8 ILE H    1 24 ARG HA   . .  4.000 3.097 1.928 3.790     .  0 0 "[    .    1    .    2]" 1 
        37 1  8 ILE HA   1  9 THR H    . .  2.500 2.177 2.040 2.327     .  0 0 "[    .    1    .    2]" 1 
        38 1  8 ILE HA   1 54 ILE HA   . .  4.000 2.641 2.348 2.916     .  0 0 "[    .    1    .    2]" 1 
        39 1  8 ILE HA   1 54 ILE MD   . .  5.000 3.379 2.034 4.175     .  0 0 "[    .    1    .    2]" 1 
        40 1  8 ILE HA   1 54 ILE MG   . .  7.000 4.349 2.737 5.267     .  0 0 "[    .    1    .    2]" 1 
        41 1  8 ILE HA   1 55 SER H    . .  4.000 3.858 3.164 4.086 0.086 20 0 "[    .    1    .    2]" 1 
        42 1  8 ILE HB   1 23 ILE H    . .  6.000 4.269 2.899 5.808     .  0 0 "[    .    1    .    2]" 1 
        43 1  8 ILE MD   1  9 THR H    . .  7.000 5.012 3.107 5.803     .  0 0 "[    .    1    .    2]" 1 
        44 1  8 ILE MG   1  9 THR H    . .  5.000 3.815 3.217 4.195     .  0 0 "[    .    1    .    2]" 1 
        45 1  8 ILE MG   1  9 THR HA   . .  7.000 4.885 4.144 5.860     .  0 0 "[    .    1    .    2]" 1 
        46 1  8 ILE MG   1 10 ILE MD   . .  8.000 2.671 2.033 4.006     .  0 0 "[    .    1    .    2]" 1 
        47 1  8 ILE MG   1 23 ILE H    . .  7.000 4.467 2.944 5.778     .  0 0 "[    .    1    .    2]" 1 
        48 1  8 ILE MG   1 53 THR H    . .  7.000 5.293 4.082 5.987     .  0 0 "[    .    1    .    2]" 1 
        49 1  8 ILE MG   1 54 ILE QG   . .  8.000 3.239 1.984 4.060     .  0 0 "[    .    1    .    2]" 1 
        50 1  9 THR H    1  9 THR HB   . .  4.000 2.627 2.266 3.831     .  0 0 "[    .    1    .    2]" 1 
        51 1  9 THR H    1 10 ILE H    . .  6.000 4.287 4.125 4.510     .  0 0 "[    .    1    .    2]" 1 
        52 1  9 THR H    1 22 ASP HA   . .  6.000 4.695 4.461 5.171     .  0 0 "[    .    1    .    2]" 1 
        53 1  9 THR H    1 52 ILE MG   . .  7.000 4.676 3.643 5.810     .  0 0 "[    .    1    .    2]" 1 
        54 1  9 THR H    1 53 THR H    . .  4.000 3.609 2.998 4.073 0.073  7 0 "[    .    1    .    2]" 1 
        55 1  9 THR H    1 53 THR MG   . .  7.000 4.324 2.974 4.856     .  0 0 "[    .    1    .    2]" 1 
        56 1  9 THR H    1 54 ILE H    . .  6.000 4.930 4.674 5.152     .  0 0 "[    .    1    .    2]" 1 
        57 1  9 THR H    1 54 ILE HA   . .  6.000 3.291 2.830 4.053     .  0 0 "[    .    1    .    2]" 1 
        58 1  9 THR H    1 55 SER H    . .  6.000 4.178 3.634 4.817     .  0 0 "[    .    1    .    2]" 1 
        59 1  9 THR HA   1  9 THR MG   . .  3.600 2.525 2.341 2.777     .  0 0 "[    .    1    .    2]" 1 
        60 1  9 THR HA   1 10 ILE H    . .  3.000 2.136 2.076 2.224     .  0 0 "[    .    1    .    2]" 1 
        61 1  9 THR HA   1 10 ILE MG   . .  7.000 5.639 5.563 5.712     .  0 0 "[    .    1    .    2]" 1 
        62 1  9 THR HA   1 22 ASP HA   . .  2.500 2.229 2.045 2.572 0.072 17 0 "[    .    1    .    2]" 1 
        63 1  9 THR HA   1 23 ILE H    . .  5.000 3.464 2.792 4.446     .  0 0 "[    .    1    .    2]" 1 
        64 1  9 THR HB   1 53 THR HB   . .  6.000 2.524 2.085 4.259     .  0 0 "[    .    1    .    2]" 1 
        65 1  9 THR MG   1 10 ILE H    . .  5.000 3.435 3.026 4.114     .  0 0 "[    .    1    .    2]" 1 
        66 1  9 THR MG   1 11 LYS H    . .  7.000 4.324 3.510 5.930     .  0 0 "[    .    1    .    2]" 1 
        67 1  9 THR MG   1 11 LYS QD   . .  8.000 4.123 2.796 5.508     .  0 0 "[    .    1    .    2]" 1 
        68 1  9 THR MG   1 11 LYS QE   . .  6.000 3.475 2.071 4.464     .  0 0 "[    .    1    .    2]" 1 
        69 1  9 THR MG   1 21 ILE H    . .  7.000 4.485 3.562 5.530     .  0 0 "[    .    1    .    2]" 1 
        70 1  9 THR MG   1 22 ASP HA   . .  7.000 3.448 2.264 4.305     .  0 0 "[    .    1    .    2]" 1 
        71 1  9 THR MG   1 53 THR H    . .  7.000 4.112 2.990 4.907     .  0 0 "[    .    1    .    2]" 1 
        72 1 10 ILE H    1 10 ILE HB   . .  4.000 2.724 2.539 2.953     .  0 0 "[    .    1    .    2]" 1 
        73 1 10 ILE H    1 11 LYS H    . .  6.000 4.300 4.057 4.605     .  0 0 "[    .    1    .    2]" 1 
        74 1 10 ILE H    1 21 ILE H    . .  4.000 3.250 2.940 3.555     .  0 0 "[    .    1    .    2]" 1 
        75 1 10 ILE H    1 21 ILE HB   . .  5.000 3.929 3.166 5.079 0.079  1 0 "[    .    1    .    2]" 1 
        76 1 10 ILE H    1 21 ILE MG   . .  7.000 4.525 3.858 5.574     .  0 0 "[    .    1    .    2]" 1 
        77 1 10 ILE H    1 22 ASP HA   . .  4.000 3.400 2.825 3.830     .  0 0 "[    .    1    .    2]" 1 
        78 1 10 ILE HA   1 11 LYS H    . .  3.000 2.206 2.138 2.301     .  0 0 "[    .    1    .    2]" 1 
        79 1 10 ILE HA   1 11 LYS QB   . .  7.000 4.476 4.168 4.867     .  0 0 "[    .    1    .    2]" 1 
        80 1 10 ILE HA   1 53 THR H    . .  4.000 3.398 2.603 3.923     .  0 0 "[    .    1    .    2]" 1 
        81 1 10 ILE HB   1 11 LYS H    . .  6.000 4.415 4.156 4.571     .  0 0 "[    .    1    .    2]" 1 
        82 1 10 ILE HB   1 21 ILE H    . .  4.000 3.404 2.644 4.028 0.028 10 0 "[    .    1    .    2]" 1 
        83 1 10 ILE HB   1 21 ILE QG   . .  7.000 3.657 2.153 4.765     .  0 0 "[    .    1    .    2]" 1 
        84 1 10 ILE MD   1 11 LYS H    . .  7.000 4.909 4.184 5.667     .  0 0 "[    .    1    .    2]" 1 
        85 1 10 ILE MD   1 12 ILE QG   . .  8.000 5.042 4.474 5.719     .  0 0 "[    .    1    .    2]" 1 
        86 1 10 ILE MD   1 52 ILE HA   . .  7.000 4.027 2.296 5.403     .  0 0 "[    .    1    .    2]" 1 
        87 1 10 ILE QG   1 12 ILE MD   . .  8.000 4.963 4.274 5.869     .  0 0 "[    .    1    .    2]" 1 
        88 1 10 ILE QG   1 21 ILE H    . .  7.000 5.023 4.330 5.721     .  0 0 "[    .    1    .    2]" 1 
        89 1 10 ILE QG   1 23 ILE QG   . .  6.000 4.450 3.435 4.897     .  0 0 "[    .    1    .    2]" 1 
        90 1 10 ILE MG   1 11 LYS H    . .  5.000 3.287 2.763 3.562     .  0 0 "[    .    1    .    2]" 1 
        91 1 10 ILE MG   1 20 GLU HA   . .  7.000 4.866 3.539 5.722     .  0 0 "[    .    1    .    2]" 1 
        92 1 10 ILE MG   1 21 ILE H    . .  7.000 4.255 3.706 4.716     .  0 0 "[    .    1    .    2]" 1 
        93 1 10 ILE MG   1 21 ILE MG   . .  8.000 4.793 4.261 5.450     .  0 0 "[    .    1    .    2]" 1 
        94 1 10 ILE MG   1 51 GLN H    . .  7.000 4.644 4.031 5.302     .  0 0 "[    .    1    .    2]" 1 
        95 1 10 ILE MG   1 53 THR H    . .  7.000 4.977 3.990 5.773     .  0 0 "[    .    1    .    2]" 1 
        96 1 11 LYS H    1 51 GLN H    . .  4.000 3.696 3.357 4.025 0.025  7 0 "[    .    1    .    2]" 1 
        97 1 11 LYS H    1 52 ILE HA   . .  6.000 3.410 2.617 4.027     .  0 0 "[    .    1    .    2]" 1 
        98 1 11 LYS HA   1 12 ILE H    . .  3.000 2.122 1.988 2.190     .  0 0 "[    .    1    .    2]" 1 
        99 1 11 LYS HA   1 12 ILE HB   . .  6.000 4.737 4.337 5.938     .  0 0 "[    .    1    .    2]" 1 
       100 1 11 LYS HA   1 12 ILE QG   . .  7.000 3.955 3.106 4.430     .  0 0 "[    .    1    .    2]" 1 
       101 1 11 LYS HA   1 19 ILE HB   . .  6.000 5.252 4.643 5.999     .  0 0 "[    .    1    .    2]" 1 
       102 1 11 LYS HA   1 20 GLU HA   . .  3.000 2.305 2.030 2.780     .  0 0 "[    .    1    .    2]" 1 
       103 1 11 LYS HA   1 21 ILE H    . .  4.000 3.519 2.626 4.054 0.054  4 0 "[    .    1    .    2]" 1 
       104 1 11 LYS QB   1 12 ILE H    . .  7.000 3.660 2.847 3.985     .  0 0 "[    .    1    .    2]" 1 
       105 1 11 LYS QG   1 20 GLU HA   . .  6.880 3.206 2.590 4.349     .  0 0 "[    .    1    .    2]" 1 
       106 1 11 LYS HG2  1 12 ILE H    . .  6.000 4.516 3.397 5.614     .  0 0 "[    .    1    .    2]" 1 
       107 1 11 LYS HG2  1 21 ILE H    . .  6.000 5.298 3.858 6.142 0.142 13 0 "[    .    1    .    2]" 1 
       108 1 11 LYS HG3  1 12 ILE H    . .  6.000 4.725 3.616 5.812     .  0 0 "[    .    1    .    2]" 1 
       109 1 11 LYS HG3  1 21 ILE H    . .  6.000 5.055 4.068 6.136 0.136 10 0 "[    .    1    .    2]" 1 
       110 1 12 ILE H    1 12 ILE HB   . .  4.000 2.655 2.293 3.835     .  0 0 "[    .    1    .    2]" 1 
       111 1 12 ILE H    1 19 ILE H    . .  4.000 3.293 2.838 3.658     .  0 0 "[    .    1    .    2]" 1 
       112 1 12 ILE H    1 19 ILE MG   . .  6.000 4.222 3.675 4.868     .  0 0 "[    .    1    .    2]" 1 
       113 1 12 ILE H    1 20 GLU HA   . .  4.000 3.401 2.795 3.843     .  0 0 "[    .    1    .    2]" 1 
       114 1 12 ILE HA   1 13 GLN H    . .  2.500 2.213 2.103 2.364     .  0 0 "[    .    1    .    2]" 1 
       115 1 12 ILE HA   1 51 GLN H    . .  4.000 3.712 3.150 4.056 0.056 13 0 "[    .    1    .    2]" 1 
       116 1 12 ILE HB   1 13 GLN H    . .  5.000 4.471 3.531 4.670     .  0 0 "[    .    1    .    2]" 1 
       117 1 12 ILE HB   1 14 ARG QG   . .  7.000 4.955 3.464 6.272     .  0 0 "[    .    1    .    2]" 1 
       118 1 12 ILE HB   1 19 ILE MD   . .  7.000 3.840 2.253 5.475     .  0 0 "[    .    1    .    2]" 1 
       119 1 12 ILE HB   1 19 ILE MG   . .  7.000 3.754 2.999 5.665     .  0 0 "[    .    1    .    2]" 1 
       120 1 12 ILE MD   1 13 GLN H    . .  7.000 5.665 5.320 5.855     .  0 0 "[    .    1    .    2]" 1 
       121 1 12 ILE MD   1 19 ILE HG12 . .  7.000 5.292 4.037 5.728     .  0 0 "[    .    1    .    2]" 1 
       122 1 12 ILE MD   1 41 ALA MB   . .  6.000 3.589 2.578 4.058     .  0 0 "[    .    1    .    2]" 1 
       123 1 12 ILE MD   1 42 LEU HA   . .  5.000 3.575 2.189 4.065     .  0 0 "[    .    1    .    2]" 1 
       124 1 12 ILE QG   1 14 ARG QD   . .  8.000 5.928 4.945 6.480     .  0 0 "[    .    1    .    2]" 1 
       125 1 12 ILE QG   1 21 ILE QG   . .  8.000 4.558 3.187 5.485     .  0 0 "[    .    1    .    2]" 1 
       126 1 12 ILE QG   1 51 GLN H    . .  7.000 4.880 4.390 5.790     .  0 0 "[    .    1    .    2]" 1 
       127 1 12 ILE MG   1 13 GLN H    . .  5.000 3.465 3.126 3.818     .  0 0 "[    .    1    .    2]" 1 
       128 1 12 ILE MG   1 14 ARG QD   . .  8.000 3.308 2.126 5.383     .  0 0 "[    .    1    .    2]" 1 
       129 1 12 ILE MG   1 49 ASN H    . .  7.000 4.903 2.773 5.659     .  0 0 "[    .    1    .    2]" 1 
       130 1 12 ILE MG   1 50 VAL MG1  . .  8.000 3.534 2.205 4.774     .  0 0 "[    .    1    .    2]" 1 
       131 1 12 ILE MG   1 50 VAL MG2  . .  8.000 2.625 2.095 3.582     .  0 0 "[    .    1    .    2]" 1 
       132 1 12 ILE MG   1 51 GLN H    . .  7.000 5.443 3.635 5.788     .  0 0 "[    .    1    .    2]" 1 
       133 1 13 GLN H    1 13 GLN HB2  . .  4.000 2.716 2.428 3.783     .  0 0 "[    .    1    .    2]" 1 
       134 1 13 GLN H    1 13 GLN HB3  . .  4.000 2.946 2.375 3.777     .  0 0 "[    .    1    .    2]" 1 
       135 1 13 GLN H    1 19 ILE H    . .  6.000 4.772 4.458 5.025     .  0 0 "[    .    1    .    2]" 1 
       136 1 13 GLN H    1 49 ASN H    . .  5.000 4.039 3.264 4.553     .  0 0 "[    .    1    .    2]" 1 
       137 1 13 GLN H    1 49 ASN QB   . .  7.000 4.046 2.892 5.339     .  0 0 "[    .    1    .    2]" 1 
       138 1 13 GLN H    1 50 VAL HA   . .  6.000 2.953 2.576 3.491     .  0 0 "[    .    1    .    2]" 1 
       139 1 13 GLN H    1 51 GLN H    . .  6.000 3.860 3.348 4.248     .  0 0 "[    .    1    .    2]" 1 
       140 1 13 GLN HA   1 14 ARG H    . .  2.500 2.140 2.051 2.288     .  0 0 "[    .    1    .    2]" 1 
       141 1 13 GLN HA   1 18 GLU HA   . .  3.000 2.301 2.105 2.615     .  0 0 "[    .    1    .    2]" 1 
       142 1 13 GLN HA   1 19 ILE H    . .  4.000 3.494 3.078 4.036 0.036 13 0 "[    .    1    .    2]" 1 
       143 1 13 GLN HB2  1 14 ARG H    . .  6.000 4.418 3.417 4.638     .  0 0 "[    .    1    .    2]" 1 
       144 1 13 GLN HB3  1 14 ARG H    . .  6.000 4.228 3.485 4.609     .  0 0 "[    .    1    .    2]" 1 
       145 1 14 ARG H    1 14 ARG QG   . .  5.000 3.093 2.274 4.073     .  0 0 "[    .    1    .    2]" 1 
       146 1 14 ARG H    1 17 GLN H    . .  4.000 3.580 3.070 4.050 0.050 12 0 "[    .    1    .    2]" 1 
       147 1 14 ARG H    1 18 GLU HA   . .  4.000 3.425 2.830 3.940     .  0 0 "[    .    1    .    2]" 1 
       148 1 14 ARG H    1 19 ILE H    . .  6.000 4.081 3.424 5.280     .  0 0 "[    .    1    .    2]" 1 
       149 1 14 ARG HA   1 15 ASP H    . .  3.000 2.450 2.147 3.267 0.267 12 0 "[    .    1    .    2]" 1 
       150 1 14 ARG QD   1 19 ILE MD   . .  8.000 3.231 2.323 4.335     .  0 0 "[    .    1    .    2]" 1 
       151 1 14 ARG QD   1 47 ALA MB   . .  8.000 3.887 2.371 5.587     .  0 0 "[    .    1    .    2]" 1 
       152 1 14 ARG HE   1 17 GLN HB2  . .  6.000 4.976 2.240 6.068 0.068 13 0 "[    .    1    .    2]" 1 
       153 1 14 ARG HE   1 17 GLN HB3  . .  6.000 4.737 2.358 6.072 0.072  2 0 "[    .    1    .    2]" 1 
       154 1 15 ASP H    1 16 GLY H    . .  6.000 3.600 2.877 4.539     .  0 0 "[    .    1    .    2]" 1 
       155 1 15 ASP HA   1 16 GLY H    . .  3.000 2.388 2.110 3.298 0.298 19 0 "[    .    1    .    2]" 1 
       156 1 15 ASP HA   1 17 GLN H    . .  6.000 4.388 3.856 4.887     .  0 0 "[    .    1    .    2]" 1 
       157 1 16 GLY H    1 17 GLN H    . .  3.500 2.973 2.335 3.524 0.024  9 0 "[    .    1    .    2]" 1 
       158 1 17 GLN H    1 17 GLN HB2  . .  3.500 2.813 2.363 3.519 0.019  7 0 "[    .    1    .    2]" 1 
       159 1 17 GLN H    1 17 GLN HB3  . .  4.000 3.362 2.474 4.037 0.037  3 0 "[    .    1    .    2]" 1 
       160 1 17 GLN HA   1 18 GLU H    . .  2.500 2.246 2.120 2.374     .  0 0 "[    .    1    .    2]" 1 
       161 1 17 GLN HB2  1 18 GLU H    . .  6.000 4.553 4.344 4.726     .  0 0 "[    .    1    .    2]" 1 
       162 1 17 GLN HG2  1 18 GLU H    . .  6.000 4.602 3.235 5.464     .  0 0 "[    .    1    .    2]" 1 
       163 1 17 GLN HG3  1 18 GLU H    . .  6.000 4.757 3.319 6.019 0.019 16 0 "[    .    1    .    2]" 1 
       164 1 18 GLU H    1 19 ILE H    . .  6.000 4.387 4.247 4.613     .  0 0 "[    .    1    .    2]" 1 
       165 1 18 GLU HA   1 19 ILE H    . .  2.500 2.139 1.991 2.260     .  0 0 "[    .    1    .    2]" 1 
       166 1 19 ILE H    1 19 ILE HB   . .  3.000 2.660 2.400 3.071 0.071 13 0 "[    .    1    .    2]" 1 
       167 1 19 ILE H    1 19 ILE HG13 . .  4.000 3.520 2.536 4.050 0.050  6 0 "[    .    1    .    2]" 1 
       168 1 19 ILE H    1 20 GLU H    . .  6.000 4.202 3.873 4.410     .  0 0 "[    .    1    .    2]" 1 
       169 1 19 ILE HA   1 19 ILE HG12 . .  4.000 3.354 2.626 3.815     .  0 0 "[    .    1    .    2]" 1 
       170 1 19 ILE HA   1 20 GLU H    . .  3.000 2.197 2.080 2.430     .  0 0 "[    .    1    .    2]" 1 
       171 1 19 ILE MG   1 20 GLU H    . .  5.000 3.428 2.900 3.989     .  0 0 "[    .    1    .    2]" 1 
       172 1 19 ILE MG   1 21 ILE H    . .  7.000 4.554 3.894 5.661     .  0 0 "[    .    1    .    2]" 1 
       173 1 20 GLU H    1 21 ILE H    . .  6.000 4.495 4.371 4.620     .  0 0 "[    .    1    .    2]" 1 
       174 1 20 GLU HA   1 21 ILE H    . .  3.000 2.085 1.973 2.170     .  0 0 "[    .    1    .    2]" 1 
       175 1 20 GLU QG   1 21 ILE H    . .  5.000 4.023 2.828 4.558     .  0 0 "[    .    1    .    2]" 1 
       176 1 21 ILE HA   1 22 ASP H    . .  3.000 2.195 2.089 2.262     .  0 0 "[    .    1    .    2]" 1 
       177 1 21 ILE HB   1 22 ASP H    . .  4.500 4.157 2.786 4.542 0.042 14 0 "[    .    1    .    2]" 1 
       178 1 21 ILE MG   1 22 ASP H    . .  5.000 3.509 2.954 3.923     .  0 0 "[    .    1    .    2]" 1 
       179 1 22 ASP H    1 22 ASP HB2  . .  4.000 3.323 2.317 3.952     .  0 0 "[    .    1    .    2]" 1 
       180 1 22 ASP H    1 22 ASP HB3  . .  4.000 2.949 2.563 3.700     .  0 0 "[    .    1    .    2]" 1 
       181 1 22 ASP HA   1 23 ILE H    . .  3.000 2.162 2.076 2.330     .  0 0 "[    .    1    .    2]" 1 
       182 1 22 ASP HA   1 23 ILE MG   . .  7.000 4.792 3.980 5.728     .  0 0 "[    .    1    .    2]" 1 
       183 1 23 ILE HA   1 24 ARG H    . .  3.000 2.203 2.060 2.432     .  0 0 "[    .    1    .    2]" 1 
       184 1 23 ILE MG   1 24 ARG H    . .  5.000 3.654 2.397 4.204     .  0 0 "[    .    1    .    2]" 1 
       185 1 24 ARG HA   1 25 VAL H    . .  3.000 2.132 2.001 2.279     .  0 0 "[    .    1    .    2]" 1 
       186 1 24 ARG QG   1 25 VAL H    . .  5.000 4.153 3.015 4.600     .  0 0 "[    .    1    .    2]" 1 
       187 1 25 VAL H    1 25 VAL HB   . .  4.000 3.531 2.401 4.041 0.041  5 0 "[    .    1    .    2]" 1 
       188 1 25 VAL H    1 25 VAL MG2  . .  4.000 2.632 2.301 3.330     .  0 0 "[    .    1    .    2]" 1 
       189 1 25 VAL H    1 26 SER H    . .  6.000 4.086 3.099 4.636     .  0 0 "[    .    1    .    2]" 1 
       190 1 25 VAL HA   1 26 SER H    . .  3.000 2.257 2.085 2.576     .  0 0 "[    .    1    .    2]" 1 
       191 1 25 VAL HA   1 27 THR H    . .  6.000 4.875 3.936 5.626     .  0 0 "[    .    1    .    2]" 1 
       192 1 25 VAL HB   1 26 SER H    . .  6.000 3.858 2.254 4.481     .  0 0 "[    .    1    .    2]" 1 
       193 1 25 VAL HB   1 27 THR H    . .  6.000 4.488 2.400 5.922     .  0 0 "[    .    1    .    2]" 1 
       194 1 25 VAL MG1  1 26 SER H    . .  7.000 3.620 2.259 4.449     .  0 0 "[    .    1    .    2]" 1 
       195 1 25 VAL MG1  1 31 LEU H    . .  7.000 4.457 2.708 5.704     .  0 0 "[    .    1    .    2]" 1 
       196 1 25 VAL MG2  1 26 SER H    . .  7.000 4.145 3.388 4.499     .  0 0 "[    .    1    .    2]" 1 
       197 1 25 VAL MG2  1 27 THR MG   . .  7.000 3.726 2.204 4.744     .  0 0 "[    .    1    .    2]" 1 
       198 1 26 SER H    1 27 THR H    . .  4.000 3.728 2.757 4.113 0.113  3 0 "[    .    1    .    2]" 1 
       199 1 26 SER H    1 27 THR MG   . .  7.000 3.436 2.544 5.273     .  0 0 "[    .    1    .    2]" 1 
       200 1 26 SER HA   1 27 THR MG   . .  5.000 3.966 3.807 4.088     .  0 0 "[    .    1    .    2]" 1 
       201 1 26 SER HB3  1 27 THR H    . .  5.000 4.413 3.916 4.696     .  0 0 "[    .    1    .    2]" 1 
       202 1 26 SER HB3  1 27 THR MG   . .  7.000 5.165 3.600 5.722     .  0 0 "[    .    1    .    2]" 1 
       203 1 27 THR HB   1 28 GLY H    . .  6.000 3.690 2.422 4.291     .  0 0 "[    .    1    .    2]" 1 
       204 1 27 THR MG   1 28 GLY H    . .  7.000 3.177 1.961 4.389     .  0 0 "[    .    1    .    2]" 1 
       205 1 27 THR MG   1 30 GLU H    . .  7.000 3.672 1.734 5.869     .  0 0 "[    .    1    .    2]" 1 
       206 1 27 THR MG   1 31 LEU HA   . .  7.000 4.846 3.805 5.929     .  0 0 "[    .    1    .    2]" 1 
       207 1 29 LYS H    1 29 LYS QG   . .  4.000 2.969 2.368 3.646     .  0 0 "[    .    1    .    2]" 1 
       208 1 29 LYS HA   1 29 LYS QD   . .  5.000 3.629 2.143 4.476     .  0 0 "[    .    1    .    2]" 1 
       209 1 29 LYS HA   1 31 LEU H    . .  6.000 4.245 3.706 4.662     .  0 0 "[    .    1    .    2]" 1 
       210 1 29 LYS HA   1 32 GLU H    . .  4.000 3.423 2.618 4.148 0.148 16 0 "[    .    1    .    2]" 1 
       211 1 29 LYS HA   1 32 GLU QB   . .  5.000 2.881 2.053 4.328     .  0 0 "[    .    1    .    2]" 1 
       212 1 29 LYS HA   1 33 ARG H    . .  6.000 4.514 3.463 6.112 0.112 10 0 "[    .    1    .    2]" 1 
       213 1 29 LYS QB   1 30 GLU H    . .  5.000 3.229 2.097 4.089     .  0 0 "[    .    1    .    2]" 1 
       214 1 29 LYS QB   1 30 GLU QG   . .  8.000 4.302 3.399 5.487     .  0 0 "[    .    1    .    2]" 1 
       215 1 29 LYS QD   1 30 GLU H    . .  7.000 4.979 3.031 6.049     .  0 0 "[    .    1    .    2]" 1 
       216 1 30 GLU H    1 30 GLU QG   . .  4.000 2.811 2.146 3.822     .  0 0 "[    .    1    .    2]" 1 
       217 1 30 GLU H    1 31 LEU H    . .  3.500 2.886 2.332 3.654 0.154 18 0 "[    .    1    .    2]" 1 
       218 1 30 GLU H    1 32 GLU H    . .  5.000 4.233 2.883 5.063 0.063 17 0 "[    .    1    .    2]" 1 
       219 1 30 GLU H    1 33 ARG H    . .  6.000 4.830 3.126 6.028 0.028 17 0 "[    .    1    .    2]" 1 
       220 1 30 GLU HA   1 32 GLU H    . .  6.000 4.409 3.578 4.901     .  0 0 "[    .    1    .    2]" 1 
       221 1 30 GLU HA   1 33 ARG H    . .  4.000 3.404 2.858 3.887     .  0 0 "[    .    1    .    2]" 1 
       222 1 30 GLU HA   1 33 ARG HB2  . .  6.000 2.870 2.173 4.579     .  0 0 "[    .    1    .    2]" 1 
       223 1 30 GLU HA   1 33 ARG HB3  . .  6.000 4.500 3.820 5.949     .  0 0 "[    .    1    .    2]" 1 
       224 1 30 GLU HA   1 34 ALA H    . .  6.000 4.004 3.382 5.233     .  0 0 "[    .    1    .    2]" 1 
       225 1 30 GLU QG   1 31 LEU H    . .  7.000 4.391 3.798 4.833     .  0 0 "[    .    1    .    2]" 1 
       226 1 30 GLU QG   1 33 ARG HE   . .  7.000 4.897 2.421 6.356     .  0 0 "[    .    1    .    2]" 1 
       227 1 30 GLU QG   1 33 ARG QG   . .  8.000 5.366 4.080 6.181     .  0 0 "[    .    1    .    2]" 1 
       228 1 31 LEU H    1 32 GLU H    . .  3.000 2.810 2.216 3.015 0.015  3 0 "[    .    1    .    2]" 1 
       229 1 31 LEU H    1 32 GLU QB   . .  7.000 4.475 3.733 4.768     .  0 0 "[    .    1    .    2]" 1 
       230 1 31 LEU H    1 33 ARG H    . .  6.000 4.326 2.883 4.702     .  0 0 "[    .    1    .    2]" 1 
       231 1 31 LEU H    1 34 ALA H    . .  6.000 4.803 3.580 5.472     .  0 0 "[    .    1    .    2]" 1 
       232 1 31 LEU HA   1 33 ARG H    . .  6.000 4.586 3.987 4.899     .  0 0 "[    .    1    .    2]" 1 
       233 1 31 LEU HA   1 34 ALA H    . .  4.000 3.541 2.951 4.007 0.007  1 0 "[    .    1    .    2]" 1 
       234 1 31 LEU HA   1 34 ALA MB   . .  4.000 2.552 2.234 2.981     .  0 0 "[    .    1    .    2]" 1 
       235 1 31 LEU HA   1 35 LEU H    . .  6.000 3.639 3.295 3.923     .  0 0 "[    .    1    .    2]" 1 
       236 1 31 LEU QD   1 32 GLU H    . .  8.400 3.383 2.116 4.138     .  0 0 "[    .    1    .    2]" 1 
       237 1 31 LEU QD   1 32 GLU QG   . .  9.400 5.043 2.727 6.026     .  0 0 "[    .    1    .    2]" 1 
       238 1 31 LEU QD   1 34 ALA H    . .  8.400 4.937 3.991 5.563     .  0 0 "[    .    1    .    2]" 1 
       239 1 31 LEU QD   1 35 LEU H    . .  8.400 4.030 2.742 5.291     .  0 0 "[    .    1    .    2]" 1 
       240 1 31 LEU HG   1 32 GLU H    . .  4.500 3.680 2.893 4.652 0.152 13 0 "[    .    1    .    2]" 1 
       241 1 31 LEU HG   1 35 LEU QB   . .  5.000 3.813 2.990 4.514     .  0 0 "[    .    1    .    2]" 1 
       242 1 32 GLU H    1 32 GLU QG   . .  5.000 3.767 2.381 4.147     .  0 0 "[    .    1    .    2]" 1 
       243 1 32 GLU H    1 33 ARG H    . .  3.000 2.941 2.692 3.100 0.100 13 0 "[    .    1    .    2]" 1 
       244 1 32 GLU H    1 34 ALA H    . .  6.000 4.465 4.192 4.666     .  0 0 "[    .    1    .    2]" 1 
       245 1 32 GLU HA   1 34 ALA H    . .  6.000 4.836 4.547 4.989     .  0 0 "[    .    1    .    2]" 1 
       246 1 32 GLU HA   1 35 LEU H    . .  4.000 3.780 3.268 4.055 0.055 13 0 "[    .    1    .    2]" 1 
       247 1 32 GLU HA   1 35 LEU QB   . .  4.000 2.670 2.250 3.089     .  0 0 "[    .    1    .    2]" 1 
       248 1 32 GLU HA   1 36 GLN H    . .  6.000 3.946 3.421 4.252     .  0 0 "[    .    1    .    2]" 1 
       249 1 32 GLU QB   1 33 ARG H    . .  4.000 2.533 2.319 2.792     .  0 0 "[    .    1    .    2]" 1 
       250 1 32 GLU QB   1 35 LEU MD2  . .  8.000 4.813 4.034 5.235     .  0 0 "[    .    1    .    2]" 1 
       251 1 32 GLU QG   1 33 ARG H    . .  6.000 3.798 3.265 4.598     .  0 0 "[    .    1    .    2]" 1 
       252 1 32 GLU QG   1 35 LEU MD2  . .  7.000 4.257 3.270 4.963     .  0 0 "[    .    1    .    2]" 1 
       253 1 33 ARG H    1 33 ARG HB2  . .  3.000 2.548 2.423 2.877     .  0 0 "[    .    1    .    2]" 1 
       254 1 33 ARG H    1 33 ARG HB3  . .  4.000 3.719 3.656 3.844     .  0 0 "[    .    1    .    2]" 1 
       255 1 33 ARG H    1 34 ALA H    . .  3.000 2.854 2.635 3.017 0.017  7 0 "[    .    1    .    2]" 1 
       256 1 33 ARG H    1 34 ALA MB   . .  7.000 4.514 4.330 4.667     .  0 0 "[    .    1    .    2]" 1 
       257 1 33 ARG H    1 35 LEU H    . .  6.000 4.356 4.075 4.678     .  0 0 "[    .    1    .    2]" 1 
       258 1 33 ARG HA   1 35 LEU H    . .  6.000 4.789 4.526 5.055     .  0 0 "[    .    1    .    2]" 1 
       259 1 33 ARG HA   1 36 GLN H    . .  4.000 3.679 3.371 4.065 0.065 12 0 "[    .    1    .    2]" 1 
       260 1 33 ARG HA   1 36 GLN HB2  . .  6.000 3.486 2.499 4.492     .  0 0 "[    .    1    .    2]" 1 
       261 1 33 ARG HA   1 36 GLN HB3  . .  6.000 3.337 2.272 4.635     .  0 0 "[    .    1    .    2]" 1 
       262 1 33 ARG HA   1 37 GLU H    . .  6.000 4.151 3.861 4.635     .  0 0 "[    .    1    .    2]" 1 
       263 1 33 ARG HB2  1 34 ALA H    . .  3.000 2.687 2.385 3.001 0.001 13 0 "[    .    1    .    2]" 1 
       264 1 33 ARG HB3  1 34 ALA H    . .  4.000 3.500 3.278 3.787     .  0 0 "[    .    1    .    2]" 1 
       265 1 34 ALA H    1 35 LEU H    . .  3.000 2.905 2.713 2.974     .  0 0 "[    .    1    .    2]" 1 
       266 1 34 ALA H    1 36 GLN H    . .  6.000 4.422 4.251 4.567     .  0 0 "[    .    1    .    2]" 1 
       267 1 34 ALA H    1 37 GLU QB   . .  6.000 5.193 4.778 5.416     .  0 0 "[    .    1    .    2]" 1 
       268 1 34 ALA HA   1 35 LEU HA   . .  6.000 4.926 4.839 5.004     .  0 0 "[    .    1    .    2]" 1 
       269 1 34 ALA HA   1 36 GLN H    . .  6.000 4.656 4.489 4.856     .  0 0 "[    .    1    .    2]" 1 
       270 1 34 ALA HA   1 37 GLU H    . .  4.000 3.613 3.327 4.037 0.037 12 0 "[    .    1    .    2]" 1 
       271 1 34 ALA HA   1 37 GLU QB   . .  5.000 3.012 2.525 3.472     .  0 0 "[    .    1    .    2]" 1 
       272 1 34 ALA HA   1 38 LEU H    . .  6.000 3.856 3.536 4.243     .  0 0 "[    .    1    .    2]" 1 
       273 1 34 ALA HA   1 38 LEU HG   . .  6.000 3.925 3.330 4.581     .  0 0 "[    .    1    .    2]" 1 
       274 1 34 ALA MB   1 36 GLN H    . .  7.000 4.779 4.699 4.843     .  0 0 "[    .    1    .    2]" 1 
       275 1 34 ALA MB   1 38 LEU MD1  . .  8.000 2.952 2.511 3.854     .  0 0 "[    .    1    .    2]" 1 
       276 1 35 LEU H    1 36 GLN H    . .  3.000 2.970 2.850 3.039 0.039  2 0 "[    .    1    .    2]" 1 
       277 1 35 LEU H    1 37 GLU H    . .  6.000 4.520 4.225 4.712     .  0 0 "[    .    1    .    2]" 1 
       278 1 35 LEU H    1 38 LEU H    . .  6.000 4.774 4.630 4.987     .  0 0 "[    .    1    .    2]" 1 
       279 1 35 LEU HA   1 35 LEU MD1  . .  4.000 2.689 2.247 3.388     .  0 0 "[    .    1    .    2]" 1 
       280 1 35 LEU HA   1 37 GLU H    . .  6.000 4.714 4.329 4.902     .  0 0 "[    .    1    .    2]" 1 
       281 1 35 LEU HA   1 38 LEU H    . .  4.000 3.589 3.121 3.938     .  0 0 "[    .    1    .    2]" 1 
       282 1 35 LEU HA   1 38 LEU HB2  . .  6.000 2.512 2.266 2.906     .  0 0 "[    .    1    .    2]" 1 
       283 1 35 LEU HA   1 38 LEU HB3  . .  6.000 4.086 3.833 4.492     .  0 0 "[    .    1    .    2]" 1 
       284 1 35 LEU HA   1 38 LEU MD1  . .  4.000 2.633 2.188 3.019     .  0 0 "[    .    1    .    2]" 1 
       285 1 35 LEU HA   1 38 LEU HG   . .  6.000 4.026 2.951 4.498     .  0 0 "[    .    1    .    2]" 1 
       286 1 35 LEU HA   1 39 GLU H    . .  6.000 3.824 3.632 4.060     .  0 0 "[    .    1    .    2]" 1 
       287 1 35 LEU QB   1 36 GLN H    . .  4.000 2.671 2.458 2.840     .  0 0 "[    .    1    .    2]" 1 
       288 1 35 LEU MD1  1 36 GLN H    . .  7.000 4.907 4.727 5.141     .  0 0 "[    .    1    .    2]" 1 
       289 1 35 LEU MD1  1 39 GLU H    . .  7.000 4.960 4.089 5.848     .  0 0 "[    .    1    .    2]" 1 
       290 1 35 LEU MD1  1 69 ILE HA   . .  5.000 3.831 3.447 4.055     .  0 0 "[    .    1    .    2]" 1 
       291 1 35 LEU MD2  1 36 GLN H    . .  7.000 3.956 3.079 4.516     .  0 0 "[    .    1    .    2]" 1 
       292 1 35 LEU HG   1 39 GLU H    . .  5.000 4.481 4.071 4.864     .  0 0 "[    .    1    .    2]" 1 
       293 1 36 GLN H    1 36 GLN HB2  . .  3.000 2.395 2.304 2.475     .  0 0 "[    .    1    .    2]" 1 
       294 1 36 GLN H    1 36 GLN HB3  . .  3.500 2.877 2.429 3.615 0.115  2 0 "[    .    1    .    2]" 1 
       295 1 36 GLN H    1 36 GLN HG2  . .  4.500 4.272 3.059 4.578 0.078 17 0 "[    .    1    .    2]" 1 
       296 1 36 GLN H    1 36 GLN HG3  . .  4.500 3.996 2.464 4.610 0.110 12 0 "[    .    1    .    2]" 1 
       297 1 36 GLN H    1 37 GLU H    . .  3.000 2.925 2.781 3.020 0.020 14 0 "[    .    1    .    2]" 1 
       298 1 36 GLN H    1 38 LEU H    . .  6.000 4.321 4.148 4.467     .  0 0 "[    .    1    .    2]" 1 
       299 1 36 GLN HA   1 36 GLN HB2  . .  3.000 2.712 2.487 3.076 0.076  5 0 "[    .    1    .    2]" 1 
       300 1 36 GLN HA   1 38 LEU H    . .  6.000 4.684 4.453 4.852     .  0 0 "[    .    1    .    2]" 1 
       301 1 36 GLN HA   1 39 GLU H    . .  4.000 3.644 3.095 4.032 0.032 14 0 "[    .    1    .    2]" 1 
       302 1 36 GLN HA   1 39 GLU QB   . .  4.000 2.921 2.187 3.674     .  0 0 "[    .    1    .    2]" 1 
       303 1 36 GLN HA   1 39 GLU QG   . .  7.000 3.807 1.926 5.415     .  0 0 "[    .    1    .    2]" 1 
       304 1 36 GLN HA   1 40 LYS H    . .  6.000 4.148 3.612 4.614     .  0 0 "[    .    1    .    2]" 1 
       305 1 36 GLN HB2  1 37 GLU H    . .  4.000 3.616 2.561 4.050 0.050 13 0 "[    .    1    .    2]" 1 
       306 1 36 GLN HB3  1 37 GLU H    . .  4.000 2.942 2.529 3.919     .  0 0 "[    .    1    .    2]" 1 
       307 1 37 GLU H    1 38 LEU H    . .  3.000 2.766 2.451 2.891     .  0 0 "[    .    1    .    2]" 1 
       308 1 37 GLU H    1 38 LEU HG   . .  6.000 4.882 4.452 5.192     .  0 0 "[    .    1    .    2]" 1 
       309 1 37 GLU H    1 39 GLU H    . .  6.000 4.391 4.089 4.551     .  0 0 "[    .    1    .    2]" 1 
       310 1 37 GLU HA   1 39 GLU H    . .  6.000 4.604 4.464 4.798     .  0 0 "[    .    1    .    2]" 1 
       311 1 37 GLU HA   1 40 LYS H    . .  4.000 3.418 3.043 3.801     .  0 0 "[    .    1    .    2]" 1 
       312 1 37 GLU HA   1 40 LYS QB   . .  5.000 2.345 2.097 2.571     .  0 0 "[    .    1    .    2]" 1 
       313 1 37 GLU HA   1 40 LYS QD   . .  7.000 3.167 2.158 4.908     .  0 0 "[    .    1    .    2]" 1 
       314 1 37 GLU HA   1 41 ALA H    . .  6.000 3.804 3.489 4.149     .  0 0 "[    .    1    .    2]" 1 
       315 1 37 GLU QB   1 38 LEU H    . .  4.000 2.853 2.592 3.094     .  0 0 "[    .    1    .    2]" 1 
       316 1 37 GLU QB   1 38 LEU MD2  . .  8.000 4.699 4.428 4.943     .  0 0 "[    .    1    .    2]" 1 
       317 1 37 GLU QG   1 38 LEU H    . .  5.000 3.959 3.740 4.124     .  0 0 "[    .    1    .    2]" 1 
       318 1 37 GLU QG   1 38 LEU HA   . .  7.000 4.289 4.095 4.525     .  0 0 "[    .    1    .    2]" 1 
       319 1 37 GLU QG   1 38 LEU MD2  . .  6.500 4.469 4.133 4.687     .  0 0 "[    .    1    .    2]" 1 
       320 1 37 GLU QG   1 40 LYS QB   . .  8.000 4.077 3.584 4.597     .  0 0 "[    .    1    .    2]" 1 
       321 1 38 LEU H    1 38 LEU HB2  . .  3.500 2.528 2.419 2.755     .  0 0 "[    .    1    .    2]" 1 
       322 1 38 LEU H    1 38 LEU HB3  . .  4.000 3.708 3.646 3.808     .  0 0 "[    .    1    .    2]" 1 
       323 1 38 LEU H    1 38 LEU HG   . .  3.000 2.503 2.395 2.610     .  0 0 "[    .    1    .    2]" 1 
       324 1 38 LEU H    1 39 GLU H    . .  3.000 2.951 2.858 3.023 0.023 13 0 "[    .    1    .    2]" 1 
       325 1 38 LEU H    1 40 LYS H    . .  6.000 4.430 4.151 4.612     .  0 0 "[    .    1    .    2]" 1 
       326 1 38 LEU HA   1 38 LEU MD2  . .  4.000 2.239 2.165 2.300     .  0 0 "[    .    1    .    2]" 1 
       327 1 38 LEU HA   1 38 LEU HG   . .  4.000 2.992 2.819 3.212     .  0 0 "[    .    1    .    2]" 1 
       328 1 38 LEU HA   1 40 LYS H    . .  6.000 4.627 4.232 4.868     .  0 0 "[    .    1    .    2]" 1 
       329 1 38 LEU HA   1 41 ALA H    . .  4.000 3.367 3.002 3.725     .  0 0 "[    .    1    .    2]" 1 
       330 1 38 LEU HA   1 41 ALA MB   . .  4.000 2.396 2.165 2.722     .  0 0 "[    .    1    .    2]" 1 
       331 1 38 LEU HA   1 42 LEU H    . .  6.000 3.702 3.393 4.072     .  0 0 "[    .    1    .    2]" 1 
       332 1 38 LEU HB2  1 39 GLU H    . .  4.000 2.728 2.545 2.919     .  0 0 "[    .    1    .    2]" 1 
       333 1 38 LEU HB3  1 39 GLU H    . .  4.000 3.568 3.407 3.675     .  0 0 "[    .    1    .    2]" 1 
       334 1 38 LEU MD2  1 39 GLU H    . .  7.000 4.923 4.822 4.986     .  0 0 "[    .    1    .    2]" 1 
       335 1 38 LEU MD2  1 41 ALA MB   . .  8.000 3.172 2.829 3.663     .  0 0 "[    .    1    .    2]" 1 
       336 1 38 LEU HG   1 39 GLU H    . .  6.000 4.689 4.518 4.826     .  0 0 "[    .    1    .    2]" 1 
       337 1 39 GLU H    1 40 LYS H    . .  3.000 2.942 2.809 3.037 0.037  4 0 "[    .    1    .    2]" 1 
       338 1 39 GLU H    1 41 ALA H    . .  6.000 4.455 4.080 4.640     .  0 0 "[    .    1    .    2]" 1 
       339 1 39 GLU HA   1 42 LEU H    . .  4.000 3.786 3.471 4.013 0.013  4 0 "[    .    1    .    2]" 1 
       340 1 39 GLU HA   1 42 LEU HB2  . .  5.000 3.295 2.286 4.176     .  0 0 "[    .    1    .    2]" 1 
       341 1 39 GLU HA   1 42 LEU HB3  . .  6.000 3.852 2.313 5.030     .  0 0 "[    .    1    .    2]" 1 
       342 1 39 GLU HA   1 42 LEU QD   . .  6.400 3.337 2.470 4.749     .  0 0 "[    .    1    .    2]" 1 
       343 1 39 GLU HA   1 42 LEU HG   . .  6.000 4.901 3.574 6.057 0.057 14 0 "[    .    1    .    2]" 1 
       344 1 39 GLU HA   1 43 ALA H    . .  6.000 4.109 3.493 4.908     .  0 0 "[    .    1    .    2]" 1 
       345 1 39 GLU HA   1 72 LEU MD1  . .  5.000 3.668 2.438 4.064     .  0 0 "[    .    1    .    2]" 1 
       346 1 39 GLU HA   1 76 LEU QD   . .  6.400 2.780 2.117 4.035     .  0 0 "[    .    1    .    2]" 1 
       347 1 39 GLU QB   1 72 LEU MD1  . .  5.000 2.102 1.968 2.353     .  0 0 "[    .    1    .    2]" 1 
       348 1 39 GLU QB   1 76 LEU QD   . .  7.400 3.089 1.952 3.926     .  0 0 "[    .    1    .    2]" 1 
       349 1 39 GLU QG   1 40 LYS HA   . .  7.000 4.276 3.619 5.434     .  0 0 "[    .    1    .    2]" 1 
       350 1 39 GLU QG   1 40 LYS QB   . .  8.000 4.434 3.164 5.964     .  0 0 "[    .    1    .    2]" 1 
       351 1 40 LYS H    1 41 ALA H    . .  4.000 2.996 2.710 3.128     .  0 0 "[    .    1    .    2]" 1 
       352 1 40 LYS H    1 41 ALA MB   . .  7.000 4.617 4.343 4.771     .  0 0 "[    .    1    .    2]" 1 
       353 1 40 LYS H    1 42 LEU H    . .  6.000 4.452 4.075 4.723     .  0 0 "[    .    1    .    2]" 1 
       354 1 40 LYS HA   1 42 LEU H    . .  6.000 4.741 4.385 4.930     .  0 0 "[    .    1    .    2]" 1 
       355 1 40 LYS HA   1 43 ALA H    . .  4.000 3.802 3.376 4.078 0.078 18 0 "[    .    1    .    2]" 1 
       356 1 40 LYS HA   1 43 ALA MB   . .  5.000 2.895 2.465 3.217     .  0 0 "[    .    1    .    2]" 1 
       357 1 40 LYS QB   1 41 ALA H    . .  4.000 2.540 2.402 2.763     .  0 0 "[    .    1    .    2]" 1 
       358 1 41 ALA H    1 42 LEU H    . .  3.000 2.964 2.828 3.025 0.025  1 0 "[    .    1    .    2]" 1 
       359 1 41 ALA H    1 43 ALA H    . .  6.000 4.550 4.262 4.755     .  0 0 "[    .    1    .    2]" 1 
       360 1 41 ALA HA   1 43 ALA H    . .  6.000 4.711 4.239 4.944     .  0 0 "[    .    1    .    2]" 1 
       361 1 41 ALA HA   1 44 ARG H    . .  6.000 3.613 2.958 3.999     .  0 0 "[    .    1    .    2]" 1 
       362 1 42 LEU H    1 42 LEU HB2  . .  3.000 2.428 2.239 2.628     .  0 0 "[    .    1    .    2]" 1 
       363 1 42 LEU H    1 42 LEU HB3  . .  4.000 3.216 2.402 3.743     .  0 0 "[    .    1    .    2]" 1 
       364 1 42 LEU H    1 42 LEU HG   . .  4.500 3.732 2.452 4.580 0.080 15 0 "[    .    1    .    2]" 1 
       365 1 42 LEU H    1 43 ALA H    . .  3.000 2.906 2.782 3.022 0.022 20 0 "[    .    1    .    2]" 1 
       366 1 42 LEU H    1 44 ARG H    . .  6.000 4.392 4.175 4.483     .  0 0 "[    .    1    .    2]" 1 
       367 1 42 LEU HA   1 43 ALA HA   . .  6.000 4.859 4.791 4.934     .  0 0 "[    .    1    .    2]" 1 
       368 1 42 LEU HA   1 43 ALA MB   . .  7.000 5.113 5.083 5.155     .  0 0 "[    .    1    .    2]" 1 
       369 1 42 LEU HA   1 44 ARG H    . .  6.000 4.823 4.601 5.046     .  0 0 "[    .    1    .    2]" 1 
       370 1 42 LEU HA   1 78 TYR QE   . .  8.000 6.073 4.094 7.374     .  0 0 "[    .    1    .    2]" 1 
       371 1 42 LEU HB2  1 43 ALA H    . .  5.000 3.210 2.540 4.092     .  0 0 "[    .    1    .    2]" 1 
       372 1 42 LEU HB3  1 78 TYR QE   . .  8.000 4.432 2.848 5.763     .  0 0 "[    .    1    .    2]" 1 
       373 1 42 LEU QD   1 43 ALA H    . .  8.400 3.932 3.022 4.294     .  0 0 "[    .    1    .    2]" 1 
       374 1 42 LEU QD   1 78 TYR QD   . . 10.400 4.419 3.424 6.186     .  0 0 "[    .    1    .    2]" 1 
       375 1 42 LEU QD   1 78 TYR QE   . .  8.400 3.057 2.122 4.612     .  0 0 "[    .    1    .    2]" 1 
       376 1 42 LEU HG   1 76 LEU QD   . .  8.400 4.362 2.436 5.946     .  0 0 "[    .    1    .    2]" 1 
       377 1 43 ALA H    1 43 ALA MB   . .  3.500 2.279 2.248 2.337     .  0 0 "[    .    1    .    2]" 1 
       378 1 43 ALA H    1 44 ARG H    . .  3.500 2.852 2.685 2.961     .  0 0 "[    .    1    .    2]" 1 
       379 1 43 ALA H    1 76 LEU QD   . .  7.400 3.249 2.543 4.496     .  0 0 "[    .    1    .    2]" 1 
       380 1 43 ALA HA   1 46 GLY H    . .  4.000 3.935 3.725 4.082 0.082  8 0 "[    .    1    .    2]" 1 
       381 1 44 ARG H    1 44 ARG QB   . .  3.500 2.304 2.144 2.680     .  0 0 "[    .    1    .    2]" 1 
       382 1 44 ARG H    1 45 ALA H    . .  6.000 3.114 2.763 3.779     .  0 0 "[    .    1    .    2]" 1 
       383 1 44 ARG HA   1 44 ARG QG   . .  4.000 2.510 2.283 3.023     .  0 0 "[    .    1    .    2]" 1 
       384 1 44 ARG HA   1 45 ALA H    . .  3.500 3.201 2.380 3.580 0.080  1 0 "[    .    1    .    2]" 1 
       385 1 44 ARG HA   1 45 ALA MB   . .  7.000 4.843 3.953 5.102     .  0 0 "[    .    1    .    2]" 1 
       386 1 44 ARG HA   1 46 GLY H    . .  6.000 4.730 3.892 5.148     .  0 0 "[    .    1    .    2]" 1 
       387 1 45 ALA H    1 46 GLY H    . .  6.000 2.681 2.306 2.984     .  0 0 "[    .    1    .    2]" 1 
       388 1 45 ALA MB   1 47 ALA H    . .  5.000 3.903 3.655 4.006     .  0 0 "[    .    1    .    2]" 1 
       389 1 46 GLY H    1 47 ALA H    . .  4.000 3.001 2.650 3.861     .  0 0 "[    .    1    .    2]" 1 
       390 1 46 GLY HA2  1 47 ALA H    . .  3.000 2.494 2.370 2.637     .  0 0 "[    .    1    .    2]" 1 
       391 1 47 ALA H    1 47 ALA MB   . .  3.600 2.341 2.200 2.924     .  0 0 "[    .    1    .    2]" 1 
       392 1 47 ALA H    1 48 ARG H    . .  6.000 4.535 4.068 4.727     .  0 0 "[    .    1    .    2]" 1 
       393 1 47 ALA H    1 50 VAL MG2  . .  5.500 4.239 3.368 4.757     .  0 0 "[    .    1    .    2]" 1 
       394 1 47 ALA H    1 96 VAL MG2  . .  7.000 5.005 4.169 5.674     .  0 0 "[    .    1    .    2]" 1 
       395 1 47 ALA HA   1 48 ARG H    . .  3.000 2.193 2.094 2.334     .  0 0 "[    .    1    .    2]" 1 
       396 1 47 ALA HA   1 49 ASN H    . .  6.000 4.333 3.840 5.081     .  0 0 "[    .    1    .    2]" 1 
       397 1 47 ALA HA   1 96 VAL MG2  . .  7.000 5.373 4.407 5.793     .  0 0 "[    .    1    .    2]" 1 
       398 1 47 ALA MB   1 49 ASN H    . .  5.000 3.674 2.061 4.079     .  0 0 "[    .    1    .    2]" 1 
       399 1 47 ALA MB   1 78 TYR QE   . .  7.500 4.113 2.248 5.219     .  0 0 "[    .    1    .    2]" 1 
       400 1 48 ARG H    1 49 ASN H    . .  3.500 2.752 2.250 3.150     .  0 0 "[    .    1    .    2]" 1 
       401 1 48 ARG H    1 96 VAL MG2  . .  7.000 4.736 4.069 5.166     .  0 0 "[    .    1    .    2]" 1 
       402 1 48 ARG HA   1 96 VAL H    . .  4.000 3.476 2.518 4.007 0.007 12 0 "[    .    1    .    2]" 1 
       403 1 48 ARG HA   1 96 VAL MG2  . .  6.000 2.643 2.211 3.243     .  0 0 "[    .    1    .    2]" 1 
       404 1 48 ARG QB   1 49 ASN QB   . .  7.880 4.142 3.466 5.111     .  0 0 "[    .    1    .    2]" 1 
       405 1 48 ARG QG   1 49 ASN H    . .  6.880 3.944 2.415 4.618     .  0 0 "[    .    1    .    2]" 1 
       406 1 49 ASN H    1 50 VAL MG2  . .  6.000 3.777 3.131 4.325     .  0 0 "[    .    1    .    2]" 1 
       407 1 49 ASN H    1 96 VAL MG2  . .  7.000 5.010 4.535 5.664     .  0 0 "[    .    1    .    2]" 1 
       408 1 49 ASN HA   1 50 VAL H    . .  2.500 2.166 2.064 2.247     .  0 0 "[    .    1    .    2]" 1 
       409 1 49 ASN HA   1 50 VAL MG2  . .  5.000 3.803 3.310 3.960     .  0 0 "[    .    1    .    2]" 1 
       410 1 49 ASN HA   1 94 VAL MG2  . .  7.000 4.508 3.430 5.577     .  0 0 "[    .    1    .    2]" 1 
       411 1 49 ASN HA   1 95 ARG HG2  . .  6.000 3.990 2.292 6.057 0.057 11 0 "[    .    1    .    2]" 1 
       412 1 49 ASN HA   1 95 ARG HG3  . .  6.000 4.198 2.386 6.066 0.066 12 0 "[    .    1    .    2]" 1 
       413 1 49 ASN HA   1 96 VAL H    . .  5.000 3.996 3.341 5.030 0.030  8 0 "[    .    1    .    2]" 1 
       414 1 49 ASN HA   1 96 VAL MG2  . .  7.000 4.644 4.072 5.443     .  0 0 "[    .    1    .    2]" 1 
       415 1 49 ASN QB   1 93 GLU HG3  . .  6.000 4.628 2.901 5.389     .  0 0 "[    .    1    .    2]" 1 
       416 1 50 VAL H    1 50 VAL HB   . .  3.000 2.805 2.442 3.055 0.055 15 0 "[    .    1    .    2]" 1 
       417 1 50 VAL H    1 51 GLN H    . .  6.000 4.266 4.063 4.406     .  0 0 "[    .    1    .    2]" 1 
       418 1 50 VAL H    1 94 VAL H    . .  4.000 3.242 2.919 3.668     .  0 0 "[    .    1    .    2]" 1 
       419 1 50 VAL H    1 94 VAL HA   . .  6.000 4.785 4.382 5.052     .  0 0 "[    .    1    .    2]" 1 
       420 1 50 VAL H    1 94 VAL HB   . .  6.000 4.492 2.142 5.382     .  0 0 "[    .    1    .    2]" 1 
       421 1 50 VAL H    1 94 VAL MG2  . .  5.000 3.084 2.350 4.165     .  0 0 "[    .    1    .    2]" 1 
       422 1 50 VAL H    1 95 ARG HA   . .  4.000 3.745 3.390 4.113 0.113 12 0 "[    .    1    .    2]" 1 
       423 1 50 VAL HA   1 51 GLN H    . .  3.000 2.142 2.088 2.233     .  0 0 "[    .    1    .    2]" 1 
       424 1 50 VAL HB   1 51 GLN H    . .  6.000 4.370 4.109 4.609     .  0 0 "[    .    1    .    2]" 1 
       425 1 50 VAL HB   1 73 LEU MD2  . .  7.000 4.167 3.179 5.132     .  0 0 "[    .    1    .    2]" 1 
       426 1 50 VAL HB   1 94 VAL H    . .  6.000 3.655 3.184 4.593     .  0 0 "[    .    1    .    2]" 1 
       427 1 50 VAL MG1  1 51 GLN H    . .  5.000 3.148 2.668 3.683     .  0 0 "[    .    1    .    2]" 1 
       428 1 50 VAL MG1  1 52 ILE H    . .  7.000 3.793 3.170 4.345     .  0 0 "[    .    1    .    2]" 1 
       429 1 50 VAL MG1  1 73 LEU MD2  . .  6.000 3.606 2.547 4.069     .  0 0 "[    .    1    .    2]" 1 
       430 1 50 VAL MG1  1 78 TYR QE   . .  7.000 4.635 3.399 5.345     .  0 0 "[    .    1    .    2]" 1 
       431 1 50 VAL MG2  1 51 GLN H    . .  7.000 4.281 3.902 4.451     .  0 0 "[    .    1    .    2]" 1 
       432 1 50 VAL MG2  1 78 TYR QE   . .  9.000 2.986 2.322 4.221     .  0 0 "[    .    1    .    2]" 1 
       433 1 51 GLN H    1 52 ILE H    . .  6.000 4.199 3.906 4.343     .  0 0 "[    .    1    .    2]" 1 
       434 1 51 GLN HA   1 52 ILE H    . .  3.000 2.169 2.027 2.309     .  0 0 "[    .    1    .    2]" 1 
       435 1 51 GLN HA   1 52 ILE HB   . .  6.000 4.737 4.565 4.949     .  0 0 "[    .    1    .    2]" 1 
       436 1 51 GLN HA   1 91 LYS HE2  . .  6.000 5.124 3.665 6.116 0.116  7 0 "[    .    1    .    2]" 1 
       437 1 51 GLN HA   1 91 LYS HE3  . .  6.000 4.903 3.394 6.123 0.123 10 0 "[    .    1    .    2]" 1 
       438 1 51 GLN HA   1 93 GLU HA   . .  2.500 2.261 2.054 2.494     .  0 0 "[    .    1    .    2]" 1 
       439 1 51 GLN HA   1 94 VAL H    . .  4.000 3.511 2.935 3.983     .  0 0 "[    .    1    .    2]" 1 
       440 1 51 GLN QB   1 93 GLU HA   . .  6.880 3.715 2.352 4.580     .  0 0 "[    .    1    .    2]" 1 
       441 1 51 GLN HG2  1 93 GLU HA   . .  6.000 4.178 2.474 5.469     .  0 0 "[    .    1    .    2]" 1 
       442 1 52 ILE H    1 52 ILE HB   . .  4.000 2.611 2.384 2.894     .  0 0 "[    .    1    .    2]" 1 
       443 1 52 ILE H    1 92 ILE H    . .  4.000 3.599 3.323 4.040 0.040 13 0 "[    .    1    .    2]" 1 
       444 1 52 ILE H    1 92 ILE MG   . .  7.000 4.483 3.962 4.779     .  0 0 "[    .    1    .    2]" 1 
       445 1 52 ILE H    1 93 GLU HA   . .  6.000 3.374 2.672 3.815     .  0 0 "[    .    1    .    2]" 1 
       446 1 52 ILE HA   1 53 THR H    . .  3.000 2.190 2.121 2.281     .  0 0 "[    .    1    .    2]" 1 
       447 1 52 ILE MD   1 73 LEU MD1  . .  8.000 2.898 2.040 5.337     .  0 0 "[    .    1    .    2]" 1 
       448 1 52 ILE MD   1 73 LEU MD2  . .  8.000 2.363 2.027 3.680     .  0 0 "[    .    1    .    2]" 1 
       449 1 52 ILE MD   1 92 ILE MG   . .  8.000 4.021 3.385 5.345     .  0 0 "[    .    1    .    2]" 1 
       450 1 52 ILE QG   1 53 THR H    . .  7.000 4.219 2.699 4.578     .  0 0 "[    .    1    .    2]" 1 
       451 1 52 ILE MG   1 53 THR H    . .  5.000 3.242 2.648 4.043     .  0 0 "[    .    1    .    2]" 1 
       452 1 52 ILE MG   1 53 THR HA   . .  5.000 3.959 3.856 4.077     .  0 0 "[    .    1    .    2]" 1 
       453 1 53 THR H    1 53 THR HB   . .  4.000 2.823 2.552 3.130     .  0 0 "[    .    1    .    2]" 1 
       454 1 53 THR H    1 54 ILE QG   . .  7.000 5.659 4.495 6.242     .  0 0 "[    .    1    .    2]" 1 
       455 1 53 THR HA   1 53 THR MG   . .  3.600 2.423 2.336 2.827     .  0 0 "[    .    1    .    2]" 1 
       456 1 53 THR HA   1 54 ILE H    . .  2.500 2.133 2.080 2.198     .  0 0 "[    .    1    .    2]" 1 
       457 1 53 THR HA   1 54 ILE QG   . .  7.000 5.298 4.063 6.051     .  0 0 "[    .    1    .    2]" 1 
       458 1 53 THR HA   1 54 ILE MG   . .  7.000 4.760 4.015 5.716     .  0 0 "[    .    1    .    2]" 1 
       459 1 53 THR HA   1 90 VAL HB   . .  6.000 4.988 4.119 5.528     .  0 0 "[    .    1    .    2]" 1 
       460 1 53 THR HA   1 90 VAL QG   . .  8.400 4.608 4.093 4.954     .  0 0 "[    .    1    .    2]" 1 
       461 1 53 THR HA   1 91 LYS HA   . .  3.000 2.195 2.128 2.381     .  0 0 "[    .    1    .    2]" 1 
       462 1 53 THR HA   1 91 LYS HG3  . .  6.000 4.261 2.739 5.748     .  0 0 "[    .    1    .    2]" 1 
       463 1 53 THR HA   1 92 ILE H    . .  4.000 3.450 2.928 3.692     .  0 0 "[    .    1    .    2]" 1 
       464 1 53 THR HB   1 91 LYS HB2  . .  6.000 5.069 4.668 5.559     .  0 0 "[    .    1    .    2]" 1 
       465 1 53 THR MG   1 54 ILE H    . .  4.000 3.137 2.581 3.242     .  0 0 "[    .    1    .    2]" 1 
       466 1 53 THR MG   1 54 ILE HA   . .  7.000 4.088 3.442 4.359     .  0 0 "[    .    1    .    2]" 1 
       467 1 53 THR MG   1 89 GLU HB2  . .  5.000 4.099 3.641 4.273     .  0 0 "[    .    1    .    2]" 1 
       468 1 53 THR MG   1 89 GLU HB3  . .  7.000 3.078 2.333 4.672     .  0 0 "[    .    1    .    2]" 1 
       469 1 53 THR MG   1 89 GLU QG   . .  7.000 3.487 2.038 4.919     .  0 0 "[    .    1    .    2]" 1 
       470 1 53 THR MG   1 91 LYS QD   . .  7.000 4.018 2.159 5.228     .  0 0 "[    .    1    .    2]" 1 
       471 1 53 THR MG   1 91 LYS QE   . .  8.000 4.504 2.256 5.623     .  0 0 "[    .    1    .    2]" 1 
       472 1 54 ILE H    1 54 ILE HB   . .  4.000 2.926 2.440 3.306     .  0 0 "[    .    1    .    2]" 1 
       473 1 54 ILE H    1 54 ILE QG   . .  5.000 3.786 2.642 4.529     .  0 0 "[    .    1    .    2]" 1 
       474 1 54 ILE H    1 90 VAL H    . .  4.000 3.289 2.754 3.586     .  0 0 "[    .    1    .    2]" 1 
       475 1 54 ILE H    1 90 VAL HB   . .  4.000 3.338 2.694 3.757     .  0 0 "[    .    1    .    2]" 1 
       476 1 54 ILE H    1 90 VAL QG   . .  8.400 3.779 3.498 4.213     .  0 0 "[    .    1    .    2]" 1 
       477 1 54 ILE H    1 91 LYS HA   . .  4.000 3.596 3.212 4.012 0.012 10 0 "[    .    1    .    2]" 1 
       478 1 54 ILE HA   1 55 SER H    . .  2.500 2.124 2.060 2.204     .  0 0 "[    .    1    .    2]" 1 
       479 1 54 ILE HB   1 90 VAL H    . .  6.000 4.647 3.203 5.531     .  0 0 "[    .    1    .    2]" 1 
       480 1 54 ILE QG   1 90 VAL HB   . .  7.000 4.484 2.834 5.462     .  0 0 "[    .    1    .    2]" 1 
       481 1 54 ILE MG   1 55 SER H    . .  7.000 3.834 2.985 4.336     .  0 0 "[    .    1    .    2]" 1 
       482 1 54 ILE MG   1 56 ALA H    . .  7.000 4.054 3.513 4.863     .  0 0 "[    .    1    .    2]" 1 
       483 1 55 SER H    1 55 SER HB3  . .  4.000 2.638 2.113 2.856     .  0 0 "[    .    1    .    2]" 1 
       484 1 55 SER HA   1 56 ALA H    . .  2.500 2.179 2.090 2.367     .  0 0 "[    .    1    .    2]" 1 
       485 1 55 SER HA   1 56 ALA MB   . .  7.000 4.036 3.896 4.208     .  0 0 "[    .    1    .    2]" 1 
       486 1 55 SER HA   1 89 GLU HA   . .  2.500 2.300 2.057 2.556 0.056 13 0 "[    .    1    .    2]" 1 
       487 1 55 SER HA   1 90 VAL H    . .  4.000 3.491 3.054 3.877     .  0 0 "[    .    1    .    2]" 1 
       488 1 55 SER HB3  1 56 ALA H    . .  6.000 4.474 4.196 4.686     .  0 0 "[    .    1    .    2]" 1 
       489 1 56 ALA H    1 56 ALA MB   . .  3.600 2.295 2.234 2.502     .  0 0 "[    .    1    .    2]" 1 
       490 1 56 ALA H    1 88 THR HB   . .  6.000 3.355 2.451 5.346     .  0 0 "[    .    1    .    2]" 1 
       491 1 56 ALA H    1 89 GLU HA   . .  4.000 3.195 1.961 4.019 0.019 14 0 "[    .    1    .    2]" 1 
       492 1 56 ALA HA   1 57 GLU H    . .  3.000 2.278 2.147 2.526     .  0 0 "[    .    1    .    2]" 1 
       493 1 56 ALA HA   1 58 ASN H    . .  4.500 4.435 3.947 4.589 0.089 17 0 "[    .    1    .    2]" 1 
       494 1 56 ALA MB   1 57 GLU H    . .  4.000 2.643 2.219 3.023     .  0 0 "[    .    1    .    2]" 1 
       495 1 56 ALA MB   1 58 ASN H    . .  4.000 2.963 2.552 3.134     .  0 0 "[    .    1    .    2]" 1 
       496 1 56 ALA MB   1 59 ASP HA   . .  7.000 4.677 3.833 5.124     .  0 0 "[    .    1    .    2]" 1 
       497 1 56 ALA MB   1 62 ALA HA   . .  4.000 2.820 2.326 3.470     .  0 0 "[    .    1    .    2]" 1 
       498 1 57 GLU H    1 57 GLU HG2  . .  4.000 3.126 2.133 3.940     .  0 0 "[    .    1    .    2]" 1 
       499 1 57 GLU H    1 57 GLU HG3  . .  4.000 2.944 2.181 3.755     .  0 0 "[    .    1    .    2]" 1 
       500 1 57 GLU H    1 58 ASN H    . .  3.000 2.791 2.595 2.975     .  0 0 "[    .    1    .    2]" 1 
       501 1 57 GLU H    1 61 GLN HB2  . .  4.000 3.830 3.454 4.070 0.070  6 0 "[    .    1    .    2]" 1 
       502 1 57 GLU QB   1 58 ASN HD21 . .  7.000 3.581 2.411 5.740     .  0 0 "[    .    1    .    2]" 1 
       503 1 57 GLU QB   1 58 ASN HD22 . .  7.000 4.254 2.989 6.275     .  0 0 "[    .    1    .    2]" 1 
       504 1 57 GLU QB   1 61 GLN HE22 . .  7.000 4.405 2.162 6.231     .  0 0 "[    .    1    .    2]" 1 
       505 1 57 GLU HG2  1 58 ASN H    . .  6.000 4.535 2.528 5.256     .  0 0 "[    .    1    .    2]" 1 
       506 1 58 ASN H    1 59 ASP H    . .  6.000 4.537 4.454 4.652     .  0 0 "[    .    1    .    2]" 1 
       507 1 58 ASN H    1 61 GLN HB2  . .  6.000 2.439 2.029 3.089     .  0 0 "[    .    1    .    2]" 1 
       508 1 58 ASN H    1 61 GLN HB3  . .  6.000 3.750 3.119 4.632     .  0 0 "[    .    1    .    2]" 1 
       509 1 58 ASN H    1 88 THR MG   . .  7.000 3.671 3.117 4.242     .  0 0 "[    .    1    .    2]" 1 
       510 1 58 ASN HA   1 59 ASP H    . .  3.500 2.363 2.246 2.589     .  0 0 "[    .    1    .    2]" 1 
       511 1 58 ASN HB2  1 58 ASN HD21 . .  3.500 2.557 2.266 3.557 0.057 19 0 "[    .    1    .    2]" 1 
       512 1 58 ASN HB2  1 58 ASN HD22 . .  4.000 3.683 3.565 4.058 0.058 19 0 "[    .    1    .    2]" 1 
       513 1 58 ASN HB2  1 59 ASP H    . .  4.500 3.687 2.297 4.183     .  0 0 "[    .    1    .    2]" 1 
       514 1 58 ASN HB3  1 59 ASP H    . .  3.500 2.756 2.290 3.620 0.120  1 0 "[    .    1    .    2]" 1 
       515 1 59 ASP H    1 60 GLU H    . .  4.000 2.965 2.759 3.325     .  0 0 "[    .    1    .    2]" 1 
       516 1 59 ASP H    1 88 THR MG   . .  5.000 3.356 2.966 4.112     .  0 0 "[    .    1    .    2]" 1 
       517 1 59 ASP HA   1 61 GLN H    . .  6.000 4.477 4.140 4.982     .  0 0 "[    .    1    .    2]" 1 
       518 1 59 ASP HA   1 62 ALA H    . .  4.000 3.373 2.820 3.730     .  0 0 "[    .    1    .    2]" 1 
       519 1 59 ASP HA   1 62 ALA MB   . .  4.000 2.377 2.200 2.749     .  0 0 "[    .    1    .    2]" 1 
       520 1 59 ASP HA   1 63 LYS H    . .  6.000 4.055 2.710 4.854     .  0 0 "[    .    1    .    2]" 1 
       521 1 59 ASP HA   1 88 THR HA   . .  4.000 3.961 3.141 4.114 0.114 15 0 "[    .    1    .    2]" 1 
       522 1 59 ASP QB   1 62 ALA MB   . .  8.000 3.855 3.393 4.431     .  0 0 "[    .    1    .    2]" 1 
       523 1 59 ASP QB   1 85 VAL MG1  . .  8.000 5.265 3.359 5.982     .  0 0 "[    .    1    .    2]" 1 
       524 1 60 GLU H    1 60 GLU QB   . .  3.500 2.556 2.407 2.813     .  0 0 "[    .    1    .    2]" 1 
       525 1 60 GLU H    1 60 GLU QG   . .  4.000 2.551 2.274 3.375     .  0 0 "[    .    1    .    2]" 1 
       526 1 60 GLU H    1 61 GLN H    . .  3.000 2.924 2.148 3.082 0.082  6 0 "[    .    1    .    2]" 1 
       527 1 60 GLU H    1 62 ALA H    . .  6.000 4.366 3.217 4.645     .  0 0 "[    .    1    .    2]" 1 
       528 1 60 GLU H    1 63 LYS H    . .  6.000 4.796 3.800 5.546     .  0 0 "[    .    1    .    2]" 1 
       529 1 60 GLU HA   1 62 ALA H    . .  6.000 4.603 4.162 4.850     .  0 0 "[    .    1    .    2]" 1 
       530 1 60 GLU HA   1 63 LYS H    . .  4.000 3.408 2.783 3.942     .  0 0 "[    .    1    .    2]" 1 
       531 1 60 GLU HA   1 63 LYS QB   . .  5.000 2.679 2.189 4.188     .  0 0 "[    .    1    .    2]" 1 
       532 1 60 GLU HA   1 64 GLU H    . .  6.000 4.233 3.788 5.522     .  0 0 "[    .    1    .    2]" 1 
       533 1 60 GLU QB   1 61 GLN QG   . .  7.880 3.966 3.531 4.693     .  0 0 "[    .    1    .    2]" 1 
       534 1 60 GLU QG   1 63 LYS QD   . .  8.000 4.645 3.122 6.351     .  0 0 "[    .    1    .    2]" 1 
       535 1 61 GLN H    1 61 GLN HB2  . .  3.000 2.521 2.349 2.718     .  0 0 "[    .    1    .    2]" 1 
       536 1 61 GLN H    1 61 GLN HB3  . .  4.000 3.719 3.630 3.799     .  0 0 "[    .    1    .    2]" 1 
       537 1 61 GLN H    1 61 GLN HG2  . .  4.000 3.319 2.635 4.070 0.070  6 0 "[    .    1    .    2]" 1 
       538 1 61 GLN H    1 61 GLN HG3  . .  4.000 3.301 2.475 3.913     .  0 0 "[    .    1    .    2]" 1 
       539 1 61 GLN H    1 62 ALA H    . .  3.000 2.803 2.657 3.030 0.030  6 0 "[    .    1    .    2]" 1 
       540 1 61 GLN H    1 62 ALA MB   . .  6.000 4.414 4.216 4.714     .  0 0 "[    .    1    .    2]" 1 
       541 1 61 GLN H    1 63 LYS H    . .  6.000 4.261 4.090 4.524     .  0 0 "[    .    1    .    2]" 1 
       542 1 61 GLN HA   1 62 ALA HA   . .  6.000 4.919 4.854 4.965     .  0 0 "[    .    1    .    2]" 1 
       543 1 61 GLN HA   1 63 LYS H    . .  6.000 4.547 4.238 4.811     .  0 0 "[    .    1    .    2]" 1 
       544 1 61 GLN HA   1 64 GLU H    . .  4.000 3.675 3.093 4.033 0.033  8 0 "[    .    1    .    2]" 1 
       545 1 61 GLN HA   1 64 GLU QB   . .  7.000 3.279 2.339 4.874     .  0 0 "[    .    1    .    2]" 1 
       546 1 61 GLN HA   1 65 LEU H    . .  6.000 3.923 3.677 4.391     .  0 0 "[    .    1    .    2]" 1 
       547 1 61 GLN HB2  1 62 ALA H    . .  4.000 2.660 2.430 3.025     .  0 0 "[    .    1    .    2]" 1 
       548 1 61 GLN HB3  1 62 ALA H    . .  5.000 3.451 3.221 3.702     .  0 0 "[    .    1    .    2]" 1 
       549 1 61 GLN HB3  1 62 ALA HA   . .  6.000 4.526 4.317 4.771     .  0 0 "[    .    1    .    2]" 1 
       550 1 61 GLN HG2  1 62 ALA H    . .  6.000 4.934 4.498 5.358     .  0 0 "[    .    1    .    2]" 1 
       551 1 61 GLN HG3  1 62 ALA H    . .  6.000 4.842 4.508 5.191     .  0 0 "[    .    1    .    2]" 1 
       552 1 62 ALA H    1 62 ALA MB   . .  3.500 2.260 2.219 2.333     .  0 0 "[    .    1    .    2]" 1 
       553 1 62 ALA H    1 63 LYS H    . .  3.000 2.946 2.770 3.058 0.058 20 0 "[    .    1    .    2]" 1 
       554 1 62 ALA H    1 64 GLU H    . .  6.000 4.701 4.422 5.143     .  0 0 "[    .    1    .    2]" 1 
       555 1 62 ALA H    1 65 LEU MD1  . .  7.000 4.021 3.744 4.566     .  0 0 "[    .    1    .    2]" 1 
       556 1 62 ALA HA   1 64 GLU H    . .  6.000 4.840 4.626 5.087     .  0 0 "[    .    1    .    2]" 1 
       557 1 62 ALA HA   1 65 LEU H    . .  6.000 3.659 3.480 3.886     .  0 0 "[    .    1    .    2]" 1 
       558 1 62 ALA HA   1 65 LEU HB2  . .  4.000 2.542 2.290 2.774     .  0 0 "[    .    1    .    2]" 1 
       559 1 62 ALA HA   1 65 LEU HB3  . .  6.000 4.110 3.801 4.414     .  0 0 "[    .    1    .    2]" 1 
       560 1 62 ALA HA   1 65 LEU MD1  . .  4.000 2.892 2.514 3.044     .  0 0 "[    .    1    .    2]" 1 
       561 1 62 ALA HA   1 66 LEU H    . .  6.000 3.712 3.509 4.001     .  0 0 "[    .    1    .    2]" 1 
       562 1 62 ALA MB   1 65 LEU HB2  . .  7.000 4.208 3.986 4.410     .  0 0 "[    .    1    .    2]" 1 
       563 1 63 LYS H    1 63 LYS QB   . .  3.500 2.295 2.077 2.770     .  0 0 "[    .    1    .    2]" 1 
       564 1 63 LYS H    1 63 LYS QD   . .  6.000 4.347 3.245 5.140     .  0 0 "[    .    1    .    2]" 1 
       565 1 63 LYS H    1 64 GLU H    . .  3.000 3.019 2.904 3.070 0.070  1 0 "[    .    1    .    2]" 1 
       566 1 63 LYS H    1 65 LEU H    . .  6.000 4.380 4.070 4.545     .  0 0 "[    .    1    .    2]" 1 
       567 1 63 LYS H    1 90 VAL QG   . .  6.900 4.462 4.013 4.785     .  0 0 "[    .    1    .    2]" 1 
       568 1 63 LYS HA   1 63 LYS QD   . .  5.000 4.008 3.099 4.406     .  0 0 "[    .    1    .    2]" 1 
       569 1 63 LYS HA   1 65 LEU H    . .  6.000 4.789 4.685 4.900     .  0 0 "[    .    1    .    2]" 1 
       570 1 63 LYS HA   1 66 LEU H    . .  4.000 3.721 3.364 4.004 0.004 17 0 "[    .    1    .    2]" 1 
       571 1 63 LYS HA   1 66 LEU HB2  . .  4.000 3.713 3.423 4.044 0.044 13 0 "[    .    1    .    2]" 1 
       572 1 63 LYS HA   1 66 LEU HB3  . .  4.000 2.619 2.308 2.936     .  0 0 "[    .    1    .    2]" 1 
       573 1 63 LYS HA   1 66 LEU QD   . .  5.400 2.877 2.598 3.274     .  0 0 "[    .    1    .    2]" 1 
       574 1 63 LYS HA   1 67 GLU H    . .  6.000 4.197 3.830 4.681     .  0 0 "[    .    1    .    2]" 1 
       575 1 63 LYS QB   1 64 GLU H    . .  4.000 2.604 2.357 3.497     .  0 0 "[    .    1    .    2]" 1 
       576 1 63 LYS QG   1 64 GLU H    . .  5.000 3.744 2.183 4.498     .  0 0 "[    .    1    .    2]" 1 
       577 1 63 LYS QG   1 66 LEU QD   . .  9.400 3.654 2.800 5.314     .  0 0 "[    .    1    .    2]" 1 
       578 1 63 LYS QG   1 67 GLU H    . .  7.000 4.882 3.942 6.156     .  0 0 "[    .    1    .    2]" 1 
       579 1 64 GLU H    1 64 GLU HG2  . .  4.000 3.069 2.256 3.888     .  0 0 "[    .    1    .    2]" 1 
       580 1 64 GLU H    1 64 GLU HG3  . .  4.000 3.385 2.419 4.099 0.099 13 0 "[    .    1    .    2]" 1 
       581 1 64 GLU H    1 65 LEU H    . .  3.000 2.865 2.597 3.034 0.034  2 0 "[    .    1    .    2]" 1 
       582 1 64 GLU H    1 66 LEU H    . .  6.000 4.378 4.210 4.575     .  0 0 "[    .    1    .    2]" 1 
       583 1 64 GLU HA   1 64 GLU HG2  . .  4.000 2.934 2.386 3.928     .  0 0 "[    .    1    .    2]" 1 
       584 1 64 GLU HA   1 64 GLU HG3  . .  4.000 3.543 3.076 3.982     .  0 0 "[    .    1    .    2]" 1 
       585 1 64 GLU HA   1 66 LEU H    . .  6.000 4.541 4.309 4.827     .  0 0 "[    .    1    .    2]" 1 
       586 1 64 GLU HA   1 67 GLU H    . .  4.000 3.446 3.098 3.794     .  0 0 "[    .    1    .    2]" 1 
       587 1 64 GLU HA   1 67 GLU QB   . .  5.000 2.717 2.156 3.217     .  0 0 "[    .    1    .    2]" 1 
       588 1 64 GLU HA   1 68 LEU H    . .  6.000 3.855 3.269 4.493     .  0 0 "[    .    1    .    2]" 1 
       589 1 64 GLU QB   1 65 LEU H    . .  4.000 2.839 2.415 3.688     .  0 0 "[    .    1    .    2]" 1 
       590 1 65 LEU H    1 65 LEU HB2  . .  3.000 2.496 2.427 2.559     .  0 0 "[    .    1    .    2]" 1 
       591 1 65 LEU H    1 65 LEU HB3  . .  4.000 3.690 3.652 3.722     .  0 0 "[    .    1    .    2]" 1 
       592 1 65 LEU H    1 65 LEU MD1  . .  5.000 3.529 3.373 3.707     .  0 0 "[    .    1    .    2]" 1 
       593 1 65 LEU H    1 66 LEU H    . .  3.000 2.893 2.800 2.974     .  0 0 "[    .    1    .    2]" 1 
       594 1 65 LEU H    1 67 GLU H    . .  6.000 4.489 4.287 4.720     .  0 0 "[    .    1    .    2]" 1 
       595 1 65 LEU H    1 68 LEU QD   . .  8.400 4.927 3.961 5.959     .  0 0 "[    .    1    .    2]" 1 
       596 1 65 LEU HA   1 65 LEU MD2  . .  4.000 2.256 2.197 2.301     .  0 0 "[    .    1    .    2]" 1 
       597 1 65 LEU HA   1 67 GLU H    . .  6.000 4.655 4.344 5.012     .  0 0 "[    .    1    .    2]" 1 
       598 1 65 LEU HA   1 68 LEU H    . .  4.000 3.394 3.147 3.799     .  0 0 "[    .    1    .    2]" 1 
       599 1 65 LEU HA   1 68 LEU HB2  . .  6.000 3.152 2.257 4.032     .  0 0 "[    .    1    .    2]" 1 
       600 1 65 LEU HA   1 68 LEU HB3  . .  6.000 2.775 2.224 4.111     .  0 0 "[    .    1    .    2]" 1 
       601 1 65 LEU HA   1 68 LEU QD   . .  8.400 3.115 2.400 3.941     .  0 0 "[    .    1    .    2]" 1 
       602 1 65 LEU HA   1 68 LEU HG   . .  6.000 4.681 3.673 5.504     .  0 0 "[    .    1    .    2]" 1 
       603 1 65 LEU HA   1 69 ILE H    . .  4.000 3.740 3.395 4.040 0.040 13 0 "[    .    1    .    2]" 1 
       604 1 65 LEU HB2  1 66 LEU H    . .  3.500 2.815 2.632 2.953     .  0 0 "[    .    1    .    2]" 1 
       605 1 66 LEU H    1 66 LEU HB3  . .  2.500 2.342 2.215 2.459     .  0 0 "[    .    1    .    2]" 1 
       606 1 66 LEU H    1 66 LEU HG   . .  4.500 4.476 4.397 4.536 0.036 19 0 "[    .    1    .    2]" 1 
       607 1 66 LEU H    1 67 GLU H    . .  3.000 2.992 2.816 3.053 0.053 14 0 "[    .    1    .    2]" 1 
       608 1 66 LEU H    1 68 LEU H    . .  6.000 4.435 4.195 4.570     .  0 0 "[    .    1    .    2]" 1 
       609 1 66 LEU H    1 69 ILE H    . .  6.000 4.901 4.746 5.155     .  0 0 "[    .    1    .    2]" 1 
       610 1 66 LEU HA   1 66 LEU HB2  . .  3.000 2.428 2.348 2.463     .  0 0 "[    .    1    .    2]" 1 
       611 1 66 LEU HA   1 66 LEU HG   . .  4.000 3.333 2.669 3.571     .  0 0 "[    .    1    .    2]" 1 
       612 1 66 LEU HA   1 68 LEU H    . .  6.000 4.856 4.453 5.090     .  0 0 "[    .    1    .    2]" 1 
       613 1 66 LEU HA   1 69 ILE H    . .  6.000 3.870 3.509 4.127     .  0 0 "[    .    1    .    2]" 1 
       614 1 66 LEU HA   1 69 ILE HB   . .  4.000 3.327 2.904 3.738     .  0 0 "[    .    1    .    2]" 1 
       615 1 66 LEU HA   1 70 ALA H    . .  6.000 3.944 3.602 4.268     .  0 0 "[    .    1    .    2]" 1 
       616 1 66 LEU HA   1 70 ALA MB   . .  7.000 4.400 4.038 4.905     .  0 0 "[    .    1    .    2]" 1 
       617 1 66 LEU HB2  1 67 GLU H    . .  4.000 3.941 3.753 4.020 0.020  5 0 "[    .    1    .    2]" 1 
       618 1 66 LEU HB3  1 67 GLU H    . .  3.000 2.586 2.380 2.686     .  0 0 "[    .    1    .    2]" 1 
       619 1 66 LEU QD   1 67 GLU H    . .  6.400 3.550 2.402 3.893     .  0 0 "[    .    1    .    2]" 1 
       620 1 66 LEU QD   1 67 GLU HA   . .  8.400 4.052 3.174 4.446     .  0 0 "[    .    1    .    2]" 1 
       621 1 66 LEU QD   1 67 GLU QG   . .  9.400 4.130 2.480 6.040     .  0 0 "[    .    1    .    2]" 1 
       622 1 66 LEU QD   1 69 ILE H    . .  8.400 5.100 4.774 5.510     .  0 0 "[    .    1    .    2]" 1 
       623 1 66 LEU QD   1 70 ALA H    . .  6.400 4.020 3.383 4.782     .  0 0 "[    .    1    .    2]" 1 
       624 1 66 LEU QD   1 70 ALA MB   . .  9.400 3.138 2.623 3.789     .  0 0 "[    .    1    .    2]" 1 
       625 1 66 LEU HG   1 67 GLU H    . .  3.500 3.350 3.016 3.688 0.188  4 0 "[    .    1    .    2]" 1 
       626 1 66 LEU HG   1 70 ALA MB   . .  7.000 3.954 3.525 4.400     .  0 0 "[    .    1    .    2]" 1 
       627 1 67 GLU H    1 67 GLU QB   . .  3.500 2.373 2.141 2.841     .  0 0 "[    .    1    .    2]" 1 
       628 1 67 GLU H    1 67 GLU QG   . .  5.000 3.174 2.301 4.142     .  0 0 "[    .    1    .    2]" 1 
       629 1 67 GLU H    1 68 LEU H    . .  3.000 2.950 2.804 3.064 0.064 10 0 "[    .    1    .    2]" 1 
       630 1 67 GLU H    1 69 ILE H    . .  6.000 4.533 4.329 4.719     .  0 0 "[    .    1    .    2]" 1 
       631 1 67 GLU HA   1 69 ILE H    . .  6.000 4.681 4.283 4.991     .  0 0 "[    .    1    .    2]" 1 
       632 1 67 GLU HA   1 70 ALA H    . .  4.000 3.636 3.004 4.023 0.023  3 0 "[    .    1    .    2]" 1 
       633 1 67 GLU HA   1 70 ALA MB   . .  5.000 2.574 2.208 3.120     .  0 0 "[    .    1    .    2]" 1 
       634 1 67 GLU HA   1 71 ARG H    . .  6.000 3.705 3.163 4.090     .  0 0 "[    .    1    .    2]" 1 
       635 1 67 GLU QB   1 68 LEU H    . .  4.000 2.689 2.477 3.002     .  0 0 "[    .    1    .    2]" 1 
       636 1 67 GLU QB   1 71 ARG QD   . .  8.000 4.292 2.979 5.528     .  0 0 "[    .    1    .    2]" 1 
       637 1 68 LEU H    1 68 LEU HB2  . .  3.000 2.435 2.273 2.582     .  0 0 "[    .    1    .    2]" 1 
       638 1 68 LEU H    1 68 LEU HB3  . .  4.000 2.840 2.377 3.733     .  0 0 "[    .    1    .    2]" 1 
       639 1 68 LEU H    1 69 ILE H    . .  3.000 3.011 2.935 3.066 0.066  8 0 "[    .    1    .    2]" 1 
       640 1 68 LEU H    1 70 ALA H    . .  6.000 4.528 4.372 4.814     .  0 0 "[    .    1    .    2]" 1 
       641 1 68 LEU H    1 71 ARG H    . .  6.000 4.865 4.751 4.998     .  0 0 "[    .    1    .    2]" 1 
       642 1 68 LEU HA   1 68 LEU HB3  . .  3.000 2.957 2.584 3.063 0.063  8 0 "[    .    1    .    2]" 1 
       643 1 68 LEU HA   1 70 ALA H    . .  6.000 4.861 4.690 5.099     .  0 0 "[    .    1    .    2]" 1 
       644 1 68 LEU HA   1 71 ARG H    . .  4.000 3.822 3.553 4.047 0.047 18 0 "[    .    1    .    2]" 1 
       645 1 68 LEU HA   1 71 ARG QB   . .  5.000 2.708 2.388 3.305     .  0 0 "[    .    1    .    2]" 1 
       646 1 68 LEU HA   1 71 ARG HG2  . .  6.000 4.699 3.854 5.372     .  0 0 "[    .    1    .    2]" 1 
       647 1 68 LEU HA   1 72 LEU H    . .  6.000 4.086 3.824 4.362     .  0 0 "[    .    1    .    2]" 1 
       648 1 68 LEU HB2  1 69 ILE H    . .  6.000 3.680 2.782 4.071     .  0 0 "[    .    1    .    2]" 1 
       649 1 68 LEU HB3  1 68 LEU HG   . .  3.000 2.713 2.458 3.072 0.072  5 0 "[    .    1    .    2]" 1 
       650 1 68 LEU QD   1 69 ILE H    . .  8.400 3.826 3.025 4.336     .  0 0 "[    .    1    .    2]" 1 
       651 1 68 LEU HG   1 69 ILE H    . .  5.000 4.378 3.547 5.081 0.081 18 0 "[    .    1    .    2]" 1 
       652 1 69 ILE H    1 69 ILE MD   . .  5.000 3.560 3.284 3.815     .  0 0 "[    .    1    .    2]" 1 
       653 1 69 ILE H    1 69 ILE HG12 . .  4.000 3.795 3.697 3.901     .  0 0 "[    .    1    .    2]" 1 
       654 1 69 ILE H    1 69 ILE HG13 . .  4.000 2.407 2.277 2.581     .  0 0 "[    .    1    .    2]" 1 
       655 1 69 ILE H    1 70 ALA H    . .  3.000 2.867 2.773 2.940     .  0 0 "[    .    1    .    2]" 1 
       656 1 69 ILE H    1 71 ARG H    . .  6.000 4.414 4.154 4.488     .  0 0 "[    .    1    .    2]" 1 
       657 1 69 ILE H    1 72 LEU H    . .  6.000 4.799 4.571 4.974     .  0 0 "[    .    1    .    2]" 1 
       658 1 69 ILE HA   1 69 ILE HG12 . .  4.000 2.860 2.523 3.106     .  0 0 "[    .    1    .    2]" 1 
       659 1 69 ILE HA   1 69 ILE HG13 . .  4.000 3.015 2.837 3.222     .  0 0 "[    .    1    .    2]" 1 
       660 1 69 ILE HA   1 71 ARG H    . .  6.000 4.719 4.507 4.846     .  0 0 "[    .    1    .    2]" 1 
       661 1 69 ILE HA   1 72 LEU H    . .  4.000 3.431 3.234 3.684     .  0 0 "[    .    1    .    2]" 1 
       662 1 69 ILE HA   1 72 LEU HB3  . .  4.000 2.529 2.298 2.883     .  0 0 "[    .    1    .    2]" 1 
       663 1 69 ILE HA   1 72 LEU MD2  . .  7.000 3.299 2.840 3.943     .  0 0 "[    .    1    .    2]" 1 
       664 1 69 ILE HA   1 73 LEU H    . .  6.000 3.914 3.776 4.105     .  0 0 "[    .    1    .    2]" 1 
       665 1 69 ILE HB   1 70 ALA H    . .  3.000 2.709 2.495 2.894     .  0 0 "[    .    1    .    2]" 1 
       666 1 69 ILE MD   1 70 ALA H    . .  7.000 4.521 4.126 4.906     .  0 0 "[    .    1    .    2]" 1 
       667 1 69 ILE MD   1 92 ILE H    . .  5.000 4.023 3.400 4.174     .  0 0 "[    .    1    .    2]" 1 
       668 1 69 ILE HG13 1 70 ALA H    . .  5.000 4.539 4.213 4.737     .  0 0 "[    .    1    .    2]" 1 
       669 1 69 ILE MG   1 70 ALA H    . .  6.000 3.540 3.362 3.751     .  0 0 "[    .    1    .    2]" 1 
       670 1 69 ILE MG   1 72 LEU HB3  . .  4.500 3.547 3.196 3.657     .  0 0 "[    .    1    .    2]" 1 
       671 1 69 ILE MG   1 73 LEU H    . .  7.000 3.817 3.670 3.909     .  0 0 "[    .    1    .    2]" 1 
       672 1 69 ILE MG   1 73 LEU MD2  . .  5.000 2.905 1.955 3.397     .  0 0 "[    .    1    .    2]" 1 
       673 1 70 ALA H    1 71 ARG H    . .  3.000 2.957 2.838 3.010 0.010 14 0 "[    .    1    .    2]" 1 
       674 1 70 ALA H    1 72 LEU H    . .  6.000 4.353 4.235 4.460     .  0 0 "[    .    1    .    2]" 1 
       675 1 70 ALA HA   1 71 ARG HA   . .  6.000 4.950 4.809 5.061     .  0 0 "[    .    1    .    2]" 1 
       676 1 70 ALA HA   1 72 LEU H    . .  6.000 4.557 4.376 4.737     .  0 0 "[    .    1    .    2]" 1 
       677 1 70 ALA HA   1 73 LEU H    . .  4.000 3.551 3.306 3.720     .  0 0 "[    .    1    .    2]" 1 
       678 1 70 ALA HA   1 73 LEU MD1  . .  7.000 3.519 2.194 5.960     .  0 0 "[    .    1    .    2]" 1 
       679 1 70 ALA HA   1 74 GLN H    . .  6.000 3.758 3.547 4.048     .  0 0 "[    .    1    .    2]" 1 
       680 1 70 ALA HA   1 92 ILE MG   . .  5.000 3.780 3.041 4.114     .  0 0 "[    .    1    .    2]" 1 
       681 1 70 ALA MB   1 71 ARG H    . .  4.000 2.582 2.493 2.777     .  0 0 "[    .    1    .    2]" 1 
       682 1 70 ALA MB   1 72 LEU H    . .  7.000 4.737 4.661 4.801     .  0 0 "[    .    1    .    2]" 1 
       683 1 70 ALA MB   1 92 ILE MG   . .  8.000 3.814 3.219 4.412     .  0 0 "[    .    1    .    2]" 1 
       684 1 71 ARG H    1 71 ARG HG2  . .  5.000 4.118 2.482 4.611     .  0 0 "[    .    1    .    2]" 1 
       685 1 71 ARG H    1 71 ARG HG3  . .  5.000 3.822 2.322 4.636     .  0 0 "[    .    1    .    2]" 1 
       686 1 71 ARG H    1 72 LEU H    . .  3.000 2.931 2.744 3.022 0.022  8 0 "[    .    1    .    2]" 1 
       687 1 71 ARG H    1 73 LEU H    . .  6.000 4.531 4.327 4.740     .  0 0 "[    .    1    .    2]" 1 
       688 1 71 ARG HA   1 71 ARG HE   . .  6.000 5.079 4.484 5.639     .  0 0 "[    .    1    .    2]" 1 
       689 1 71 ARG HA   1 71 ARG HG2  . .  4.000 3.191 2.456 3.879     .  0 0 "[    .    1    .    2]" 1 
       690 1 71 ARG HA   1 71 ARG HG3  . .  4.000 2.874 2.338 3.880     .  0 0 "[    .    1    .    2]" 1 
       691 1 71 ARG HA   1 73 LEU H    . .  6.000 4.834 4.550 5.034     .  0 0 "[    .    1    .    2]" 1 
       692 1 71 ARG HA   1 74 GLN H    . .  4.000 3.842 3.339 4.017 0.017 16 0 "[    .    1    .    2]" 1 
       693 1 71 ARG HA   1 74 GLN QB   . .  5.000 2.791 2.281 3.123     .  0 0 "[    .    1    .    2]" 1 
       694 1 71 ARG HA   1 75 LYS H    . .  6.000 3.980 3.528 4.441     .  0 0 "[    .    1    .    2]" 1 
       695 1 72 LEU H    1 72 LEU HB3  . .  2.500 2.533 2.415 2.587 0.087 13 0 "[    .    1    .    2]" 1 
       696 1 72 LEU H    1 73 LEU H    . .  4.000 2.893 2.724 3.021     .  0 0 "[    .    1    .    2]" 1 
       697 1 72 LEU H    1 74 GLN H    . .  6.000 4.435 4.320 4.597     .  0 0 "[    .    1    .    2]" 1 
       698 1 72 LEU HA   1 72 LEU MD1  . .  4.000 2.610 2.181 3.464     .  0 0 "[    .    1    .    2]" 1 
       699 1 72 LEU HA   1 73 LEU HA   . .  6.000 4.861 4.752 5.013     .  0 0 "[    .    1    .    2]" 1 
       700 1 72 LEU HA   1 74 GLN H    . .  6.000 4.841 4.672 4.997     .  0 0 "[    .    1    .    2]" 1 
       701 1 72 LEU HA   1 75 LYS H    . .  4.000 3.754 3.513 4.019 0.019 14 0 "[    .    1    .    2]" 1 
       702 1 72 LEU HA   1 75 LYS HB2  . .  6.000 3.719 3.271 4.035     .  0 0 "[    .    1    .    2]" 1 
       703 1 72 LEU HA   1 75 LYS HB3  . .  6.000 2.753 2.445 3.108     .  0 0 "[    .    1    .    2]" 1 
       704 1 72 LEU HA   1 76 LEU H    . .  6.000 4.173 3.926 4.563     .  0 0 "[    .    1    .    2]" 1 
       705 1 72 LEU HB3  1 73 LEU H    . .  2.500 2.437 2.349 2.529 0.029  2 0 "[    .    1    .    2]" 1 
       706 1 72 LEU HB3  1 73 LEU MD1  . .  7.000 4.659 4.301 5.447     .  0 0 "[    .    1    .    2]" 1 
       707 1 72 LEU HB3  1 73 LEU MD2  . .  5.000 3.707 2.537 4.122     .  0 0 "[    .    1    .    2]" 1 
       708 1 72 LEU HB3  1 74 GLN H    . .  6.000 5.150 4.983 5.300     .  0 0 "[    .    1    .    2]" 1 
       709 1 72 LEU MD1  1 73 LEU MD2  . .  8.000 4.610 3.904 5.325     .  0 0 "[    .    1    .    2]" 1 
       710 1 72 LEU MD1  1 75 LYS HD3  . .  7.000 4.455 2.664 5.823     .  0 0 "[    .    1    .    2]" 1 
       711 1 72 LEU MD1  1 76 LEU H    . .  7.000 5.075 4.152 5.907     .  0 0 "[    .    1    .    2]" 1 
       712 1 72 LEU MD1  1 76 LEU HG   . .  7.000 4.722 2.852 5.826     .  0 0 "[    .    1    .    2]" 1 
       713 1 72 LEU MD2  1 73 LEU MD2  . .  6.000 2.824 2.141 3.668     .  0 0 "[    .    1    .    2]" 1 
       714 1 73 LEU H    1 73 LEU MD1  . .  5.000 3.672 3.444 3.997     .  0 0 "[    .    1    .    2]" 1 
       715 1 73 LEU H    1 73 LEU MD2  . .  5.000 3.218 2.388 3.542     .  0 0 "[    .    1    .    2]" 1 
       716 1 73 LEU H    1 74 GLN H    . .  4.000 2.883 2.790 3.034     .  0 0 "[    .    1    .    2]" 1 
       717 1 73 LEU H    1 75 LYS H    . .  6.000 4.280 4.155 4.512     .  0 0 "[    .    1    .    2]" 1 
       718 1 73 LEU H    1 76 LEU H    . .  6.000 4.788 4.646 4.998     .  0 0 "[    .    1    .    2]" 1 
       719 1 73 LEU HA   1 73 LEU MD2  . .  4.000 2.369 2.167 2.984     .  0 0 "[    .    1    .    2]" 1 
       720 1 73 LEU HA   1 75 LYS H    . .  6.000 4.472 4.223 4.745     .  0 0 "[    .    1    .    2]" 1 
       721 1 73 LEU HA   1 76 LEU H    . .  4.000 3.326 2.992 3.740     .  0 0 "[    .    1    .    2]" 1 
       722 1 73 LEU HA   1 76 LEU HB2  . .  4.000 2.548 2.201 2.977     .  0 0 "[    .    1    .    2]" 1 
       723 1 73 LEU HA   1 78 TYR QD   . .  5.000 3.006 2.222 3.717     .  0 0 "[    .    1    .    2]" 1 
       724 1 73 LEU HA   1 78 TYR QE   . .  8.000 4.199 2.884 5.442     .  0 0 "[    .    1    .    2]" 1 
       725 1 73 LEU HA   1 94 VAL MG2  . .  5.500 4.382 4.102 4.642     .  0 0 "[    .    1    .    2]" 1 
       726 1 73 LEU QB   1 74 GLN H    . .  5.000 2.736 2.410 3.074     .  0 0 "[    .    1    .    2]" 1 
       727 1 73 LEU QB   1 78 TYR QD   . .  9.000 3.346 2.254 4.474     .  0 0 "[    .    1    .    2]" 1 
       728 1 73 LEU MD2  1 76 LEU HB3  . .  7.000 4.729 4.112 5.649     .  0 0 "[    .    1    .    2]" 1 
       729 1 73 LEU MD2  1 76 LEU QD   . .  9.400 3.237 2.150 4.593     .  0 0 "[    .    1    .    2]" 1 
       730 1 73 LEU MD2  1 76 LEU HG   . .  7.000 4.409 3.293 5.425     .  0 0 "[    .    1    .    2]" 1 
       731 1 73 LEU MD2  1 78 TYR HB2  . .  7.000 3.986 2.774 5.056     .  0 0 "[    .    1    .    2]" 1 
       732 1 73 LEU MD2  1 78 TYR HB3  . .  7.000 4.694 3.511 5.899     .  0 0 "[    .    1    .    2]" 1 
       733 1 73 LEU MD2  1 78 TYR QD   . .  6.500 3.455 2.247 5.012     .  0 0 "[    .    1    .    2]" 1 
       734 1 73 LEU MD2  1 78 TYR QE   . .  8.000 3.753 2.199 5.678     .  0 0 "[    .    1    .    2]" 1 
       735 1 73 LEU MD2  1 94 VAL MG1  . .  6.000 2.966 2.025 3.631     .  0 0 "[    .    1    .    2]" 1 
       736 1 73 LEU MD2  1 94 VAL MG2  . .  5.000 2.352 1.942 3.414     .  0 0 "[    .    1    .    2]" 1 
       737 1 74 GLN H    1 74 GLN QB   . .  3.500 2.376 2.187 2.476     .  0 0 "[    .    1    .    2]" 1 
       738 1 74 GLN H    1 74 GLN HG3  . .  4.500 3.213 2.423 4.536 0.036 16 0 "[    .    1    .    2]" 1 
       739 1 74 GLN H    1 75 LYS H    . .  3.000 2.834 2.735 2.930     .  0 0 "[    .    1    .    2]" 1 
       740 1 74 GLN H    1 76 LEU H    . .  6.000 4.389 4.223 4.579     .  0 0 "[    .    1    .    2]" 1 
       741 1 74 GLN H    1 81 ILE MD   . .  7.000 4.145 3.510 5.031     .  0 0 "[    .    1    .    2]" 1 
       742 1 74 GLN HA   1 76 LEU H    . .  6.000 4.685 4.437 4.892     .  0 0 "[    .    1    .    2]" 1 
       743 1 74 GLN HA   1 81 ILE MD   . .  5.000 3.908 3.167 4.338     .  0 0 "[    .    1    .    2]" 1 
       744 1 74 GLN HE22 1 74 GLN HG3  . .  4.000 3.765 3.570 4.034 0.034 13 0 "[    .    1    .    2]" 1 
       745 1 74 GLN HG3  1 81 ILE MD   . .  6.000 3.552 2.219 5.094     .  0 0 "[    .    1    .    2]" 1 
       746 1 75 LYS H    1 75 LYS HB2  . .  3.000 2.510 2.406 2.634     .  0 0 "[    .    1    .    2]" 1 
       747 1 75 LYS H    1 75 LYS HB3  . .  3.000 2.539 2.350 2.780     .  0 0 "[    .    1    .    2]" 1 
       748 1 75 LYS H    1 75 LYS HD3  . .  6.000 4.924 4.688 5.249     .  0 0 "[    .    1    .    2]" 1 
       749 1 75 LYS H    1 76 LEU H    . .  3.000 2.912 2.722 3.022 0.022  4 0 "[    .    1    .    2]" 1 
       750 1 75 LYS H    1 77 GLY H    . .  6.000 4.334 4.103 4.599     .  0 0 "[    .    1    .    2]" 1 
       751 1 75 LYS HA   1 76 LEU HA   . .  6.000 4.862 4.765 4.923     .  0 0 "[    .    1    .    2]" 1 
       752 1 75 LYS HA   1 77 GLY H    . .  6.000 4.572 3.868 4.867     .  0 0 "[    .    1    .    2]" 1 
       753 1 75 LYS HD3  1 76 LEU QD   . .  8.400 4.141 2.346 5.939     .  0 0 "[    .    1    .    2]" 1 
       754 1 75 LYS QE   1 76 LEU QD   . .  7.900 3.400 2.210 4.588     .  0 0 "[    .    1    .    2]" 1 
       755 1 75 LYS QG   1 76 LEU HA   . .  7.000 4.458 3.887 5.287     .  0 0 "[    .    1    .    2]" 1 
       756 1 75 LYS QG   1 76 LEU QD   . .  7.400 4.062 2.319 4.954     .  0 0 "[    .    1    .    2]" 1 
       757 1 75 LYS QG   1 77 GLY H    . .  7.000 5.758 5.066 6.139     .  0 0 "[    .    1    .    2]" 1 
       758 1 76 LEU H    1 76 LEU HB2  . .  2.500 2.384 2.209 2.523 0.023 13 0 "[    .    1    .    2]" 1 
       759 1 76 LEU H    1 76 LEU HB3  . .  4.000 3.623 3.223 3.726     .  0 0 "[    .    1    .    2]" 1 
       760 1 76 LEU H    1 78 TYR H    . .  6.000 4.921 4.380 5.516     .  0 0 "[    .    1    .    2]" 1 
       761 1 76 LEU H    1 78 TYR QD   . .  8.000 4.608 4.150 5.136     .  0 0 "[    .    1    .    2]" 1 
       762 1 76 LEU HA   1 77 GLY HA3  . .  6.000 4.669 4.470 4.729     .  0 0 "[    .    1    .    2]" 1 
       763 1 76 LEU HA   1 78 TYR QD   . .  8.000 5.120 4.489 5.934     .  0 0 "[    .    1    .    2]" 1 
       764 1 76 LEU HB2  1 77 GLY H    . .  6.000 2.943 2.608 3.959     .  0 0 "[    .    1    .    2]" 1 
       765 1 76 LEU HB2  1 78 TYR HB2  . .  6.000 4.785 3.866 5.538     .  0 0 "[    .    1    .    2]" 1 
       766 1 76 LEU HB2  1 78 TYR QD   . .  5.000 2.788 2.347 3.434     .  0 0 "[    .    1    .    2]" 1 
       767 1 76 LEU HB2  1 78 TYR QE   . .  6.000 3.197 2.454 4.102     .  0 0 "[    .    1    .    2]" 1 
       768 1 76 LEU HB3  1 78 TYR H    . .  6.000 4.630 3.798 5.516     .  0 0 "[    .    1    .    2]" 1 
       769 1 76 LEU HB3  1 78 TYR QD   . .  5.000 2.980 2.317 4.124     .  0 0 "[    .    1    .    2]" 1 
       770 1 76 LEU HB3  1 78 TYR QE   . .  5.500 2.643 2.328 3.121     .  0 0 "[    .    1    .    2]" 1 
       771 1 76 LEU QD   1 77 GLY H    . .  7.400 4.157 3.937 4.616     .  0 0 "[    .    1    .    2]" 1 
       772 1 76 LEU QD   1 78 TYR QD   . .  7.900 3.858 3.122 4.454     .  0 0 "[    .    1    .    2]" 1 
       773 1 76 LEU QD   1 78 TYR QE   . .  7.400 2.997 2.182 3.698     .  0 0 "[    .    1    .    2]" 1 
       774 1 77 GLY H    1 77 GLY HA2  . .  2.500 2.515 2.427 2.598 0.098 17 0 "[    .    1    .    2]" 1 
       775 1 77 GLY H    1 78 TYR H    . .  3.000 2.499 2.270 2.792     .  0 0 "[    .    1    .    2]" 1 
       776 1 77 GLY H    1 78 TYR QD   . .  8.000 3.450 2.620 4.123     .  0 0 "[    .    1    .    2]" 1 
       777 1 78 TYR H    1 78 TYR HB2  . .  3.000 2.517 2.357 2.728     .  0 0 "[    .    1    .    2]" 1 
       778 1 78 TYR H    1 78 TYR HB3  . .  4.000 3.716 3.604 3.861     .  0 0 "[    .    1    .    2]" 1 
       779 1 78 TYR H    1 78 TYR QE   . .  7.000 5.051 4.574 5.436     .  0 0 "[    .    1    .    2]" 1 
       780 1 78 TYR H    1 79 LYS H    . .  6.000 4.454 4.097 4.715     .  0 0 "[    .    1    .    2]" 1 
       781 1 78 TYR H    1 81 ILE MD   . .  7.000 4.313 3.045 5.357     .  0 0 "[    .    1    .    2]" 1 
       782 1 78 TYR HA   1 79 LYS H    . .  2.500 2.181 2.104 2.413     .  0 0 "[    .    1    .    2]" 1 
       783 1 78 TYR HA   1 79 LYS QG   . .  7.000 3.952 3.205 4.448     .  0 0 "[    .    1    .    2]" 1 
       784 1 78 TYR HA   1 80 ASP H    . .  6.000 4.376 3.845 5.037     .  0 0 "[    .    1    .    2]" 1 
       785 1 78 TYR HB2  1 79 LYS H    . .  6.000 4.301 3.676 4.576     .  0 0 "[    .    1    .    2]" 1 
       786 1 78 TYR HB2  1 81 ILE MD   . .  7.000 3.648 2.326 4.591     .  0 0 "[    .    1    .    2]" 1 
       787 1 78 TYR HB2  1 81 ILE QG   . .  7.000 3.613 2.464 4.780     .  0 0 "[    .    1    .    2]" 1 
       788 1 78 TYR HB2  1 94 VAL MG1  . .  7.000 3.166 2.589 3.822     .  0 0 "[    .    1    .    2]" 1 
       789 1 78 TYR HB2  1 94 VAL MG2  . .  5.000 3.367 2.871 3.921     .  0 0 "[    .    1    .    2]" 1 
       790 1 78 TYR HB2  1 96 VAL MG2  . .  7.000 5.273 4.696 5.739     .  0 0 "[    .    1    .    2]" 1 
       791 1 78 TYR HB3  1 79 LYS H    . .  5.000 3.357 2.340 3.998     .  0 0 "[    .    1    .    2]" 1 
       792 1 78 TYR HB3  1 80 ASP H    . .  6.000 4.022 3.481 4.841     .  0 0 "[    .    1    .    2]" 1 
       793 1 78 TYR HB3  1 81 ILE MD   . .  6.000 4.093 2.426 4.879     .  0 0 "[    .    1    .    2]" 1 
       794 1 78 TYR HB3  1 94 VAL MG1  . .  4.500 2.967 2.232 3.664     .  0 0 "[    .    1    .    2]" 1 
       795 1 78 TYR HB3  1 94 VAL MG2  . .  5.000 3.185 2.355 3.762     .  0 0 "[    .    1    .    2]" 1 
       796 1 78 TYR HB3  1 96 VAL MG2  . .  7.000 4.457 3.529 5.195     .  0 0 "[    .    1    .    2]" 1 
       797 1 78 TYR QD   1 79 LYS H    . .  8.000 4.031 3.146 4.798     .  0 0 "[    .    1    .    2]" 1 
       798 1 78 TYR QD   1 81 ILE QG   . .  9.000 4.908 3.411 5.924     .  0 0 "[    .    1    .    2]" 1 
       799 1 78 TYR QD   1 94 VAL HB   . .  8.000 3.188 2.477 5.214     .  0 0 "[    .    1    .    2]" 1 
       800 1 78 TYR QD   1 94 VAL MG1  . .  9.000 3.726 2.423 4.446     .  0 0 "[    .    1    .    2]" 1 
       801 1 78 TYR QD   1 94 VAL MG2  . .  6.500 2.827 2.309 4.086     .  0 0 "[    .    1    .    2]" 1 
       802 1 78 TYR QD   1 96 VAL MG1  . .  9.000 4.488 3.223 4.956     .  0 0 "[    .    1    .    2]" 1 
       803 1 78 TYR QE   1 94 VAL MG2  . .  9.000 3.189 2.704 4.718     .  0 0 "[    .    1    .    2]" 1 
       804 1 78 TYR QE   1 96 VAL H    . .  8.000 4.290 3.204 6.587     .  0 0 "[    .    1    .    2]" 1 
       805 1 78 TYR QE   1 96 VAL MG1  . .  7.000 4.635 3.916 4.949     .  0 0 "[    .    1    .    2]" 1 
       806 1 79 LYS H    1 79 LYS HB2  . .  4.000 3.308 2.543 3.920     .  0 0 "[    .    1    .    2]" 1 
       807 1 79 LYS H    1 79 LYS QG   . .  5.000 2.541 2.188 2.993     .  0 0 "[    .    1    .    2]" 1 
       808 1 79 LYS H    1 80 ASP H    . .  3.000 2.751 2.355 3.012 0.012  6 0 "[    .    1    .    2]" 1 
       809 1 79 LYS H    1 80 ASP HA   . .  6.000 5.481 5.058 5.715     .  0 0 "[    .    1    .    2]" 1 
       810 1 79 LYS HA   1 81 ILE MD   . .  7.000 3.850 3.192 4.618     .  0 0 "[    .    1    .    2]" 1 
       811 1 79 LYS HA   1 81 ILE QG   . .  7.000 3.858 3.223 4.639     .  0 0 "[    .    1    .    2]" 1 
       812 1 79 LYS HB2  1 80 ASP H    . .  5.000 3.479 2.230 4.189     .  0 0 "[    .    1    .    2]" 1 
       813 1 79 LYS HB3  1 80 ASP H    . .  6.000 3.930 2.996 4.362     .  0 0 "[    .    1    .    2]" 1 
       814 1 79 LYS QG   1 80 ASP H    . .  7.000 3.138 1.995 4.389     .  0 0 "[    .    1    .    2]" 1 
       815 1 79 LYS QG   1 81 ILE MD   . .  8.000 5.676 5.062 5.921     .  0 0 "[    .    1    .    2]" 1 
       816 1 79 LYS QG   1 96 VAL MG1  . .  8.000 4.461 3.241 5.771     .  0 0 "[    .    1    .    2]" 1 
       817 1 80 ASP H    1 80 ASP HB2  . .  4.000 2.721 2.362 3.116     .  0 0 "[    .    1    .    2]" 1 
       818 1 80 ASP H    1 80 ASP HB3  . .  4.000 3.065 2.416 3.738     .  0 0 "[    .    1    .    2]" 1 
       819 1 80 ASP H    1 94 VAL MG1  . .  7.000 4.943 4.005 5.629     .  0 0 "[    .    1    .    2]" 1 
       820 1 80 ASP H    1 94 VAL MG2  . .  7.000 5.832 5.657 5.931     .  0 0 "[    .    1    .    2]" 1 
       821 1 80 ASP H    1 95 ARG H    . .  4.000 3.467 2.836 4.014 0.014 14 0 "[    .    1    .    2]" 1 
       822 1 80 ASP HA   1 81 ILE H    . .  2.500 2.220 2.104 2.355     .  0 0 "[    .    1    .    2]" 1 
       823 1 80 ASP HB2  1 95 ARG H    . .  6.000 3.628 2.283 4.957     .  0 0 "[    .    1    .    2]" 1 
       824 1 80 ASP HB3  1 95 ARG H    . .  5.000 3.234 2.251 4.380     .  0 0 "[    .    1    .    2]" 1 
       825 1 81 ILE H    1 81 ILE HB   . .  3.000 2.666 2.494 2.902     .  0 0 "[    .    1    .    2]" 1 
       826 1 81 ILE H    1 81 ILE MD   . .  5.000 3.771 3.231 4.157     .  0 0 "[    .    1    .    2]" 1 
       827 1 81 ILE H    1 81 ILE QG   . .  5.000 2.687 2.325 3.180     .  0 0 "[    .    1    .    2]" 1 
       828 1 81 ILE HA   1 82 ASN H    . .  2.500 2.184 2.129 2.292     .  0 0 "[    .    1    .    2]" 1 
       829 1 81 ILE HA   1 82 ASN QB   . .  7.000 4.239 3.870 4.589     .  0 0 "[    .    1    .    2]" 1 
       830 1 81 ILE HA   1 94 VAL MG2  . .  7.000 4.614 3.202 4.938     .  0 0 "[    .    1    .    2]" 1 
       831 1 81 ILE HA   1 95 ARG H    . .  4.000 3.962 3.456 4.152 0.152 19 0 "[    .    1    .    2]" 1 
       832 1 81 ILE HB   1 82 ASN H    . .  4.500 4.510 4.402 4.561 0.061  2 0 "[    .    1    .    2]" 1 
       833 1 81 ILE QG   1 92 ILE MG   . .  8.000 4.079 3.586 4.651     .  0 0 "[    .    1    .    2]" 1 
       834 1 81 ILE QG   1 94 VAL MG2  . .  8.000 4.192 2.312 5.900     .  0 0 "[    .    1    .    2]" 1 
       835 1 81 ILE MG   1 82 ASN H    . .  5.000 3.472 3.233 3.732     .  0 0 "[    .    1    .    2]" 1 
       836 1 81 ILE MG   1 82 ASN HA   . .  7.000 4.364 4.104 4.620     .  0 0 "[    .    1    .    2]" 1 
       837 1 81 ILE MG   1 93 GLU H    . .  7.000 4.575 3.499 5.467     .  0 0 "[    .    1    .    2]" 1 
       838 1 82 ASN H    1 92 ILE MG   . .  6.000 3.958 3.289 4.745     .  0 0 "[    .    1    .    2]" 1 
       839 1 82 ASN H    1 93 GLU H    . .  4.000 3.546 3.370 4.006 0.006 10 0 "[    .    1    .    2]" 1 
       840 1 82 ASN H    1 94 VAL HA   . .  4.000 3.243 2.926 3.680     .  0 0 "[    .    1    .    2]" 1 
       841 1 82 ASN H    1 95 ARG H    . .  6.000 4.530 4.119 5.005     .  0 0 "[    .    1    .    2]" 1 
       842 1 82 ASN HA   1 83 VAL H    . .  2.500 2.176 2.128 2.260     .  0 0 "[    .    1    .    2]" 1 
       843 1 82 ASN HA   1 83 VAL HB   . .  6.000 4.662 4.388 4.901     .  0 0 "[    .    1    .    2]" 1 
       844 1 82 ASN HA   1 83 VAL MG2  . .  7.000 4.469 3.554 5.684     .  0 0 "[    .    1    .    2]" 1 
       845 1 82 ASN QB   1 93 GLU H    . .  5.000 3.348 3.066 3.766     .  0 0 "[    .    1    .    2]" 1 
       846 1 82 ASN QB   1 93 GLU HB2  . .  5.000 3.821 3.173 4.124     .  0 0 "[    .    1    .    2]" 1 
       847 1 82 ASN QB   1 93 GLU HB3  . .  5.000 2.211 1.984 2.613     .  0 0 "[    .    1    .    2]" 1 
       848 1 83 VAL H    1 83 VAL HB   . .  3.000 2.599 2.455 2.771     .  0 0 "[    .    1    .    2]" 1 
       849 1 83 VAL H    1 83 VAL MG2  . .  4.500 2.993 2.237 3.928     .  0 0 "[    .    1    .    2]" 1 
       850 1 83 VAL H    1 84 ARG H    . .  6.000 4.515 4.326 4.633     .  0 0 "[    .    1    .    2]" 1 
       851 1 83 VAL HA   1 84 ARG H    . .  2.500 2.154 2.079 2.265     .  0 0 "[    .    1    .    2]" 1 
       852 1 83 VAL HA   1 93 GLU H    . .  4.000 3.559 3.235 4.043 0.043  3 0 "[    .    1    .    2]" 1 
       853 1 83 VAL MG1  1 84 ARG H    . .  5.000 3.521 2.850 4.216     .  0 0 "[    .    1    .    2]" 1 
       854 1 83 VAL MG2  1 84 ARG H    . .  7.000 3.753 2.566 4.400     .  0 0 "[    .    1    .    2]" 1 
       855 1 83 VAL MG2  1 93 GLU H    . .  7.000 4.697 4.014 5.511     .  0 0 "[    .    1    .    2]" 1 
       856 1 84 ARG H    1 84 ARG HB2  . .  4.000 3.039 2.587 3.418     .  0 0 "[    .    1    .    2]" 1 
       857 1 84 ARG H    1 84 ARG HB3  . .  4.000 3.131 2.407 3.980     .  0 0 "[    .    1    .    2]" 1 
       858 1 84 ARG H    1 91 LYS H    . .  4.000 3.773 3.492 4.060 0.060 15 0 "[    .    1    .    2]" 1 
       859 1 84 ARG H    1 92 ILE HA   . .  4.000 3.471 2.939 3.981     .  0 0 "[    .    1    .    2]" 1 
       860 1 84 ARG H    1 92 ILE MG   . .  7.000 5.067 4.398 5.806     .  0 0 "[    .    1    .    2]" 1 
       861 1 84 ARG H    1 93 GLU H    . .  6.000 4.269 3.870 4.570     .  0 0 "[    .    1    .    2]" 1 
       862 1 84 ARG HA   1 85 VAL H    . .  2.500 2.210 2.058 2.437     .  0 0 "[    .    1    .    2]" 1 
       863 1 84 ARG HB2  1 85 VAL H    . .  6.000 4.540 4.323 4.715     .  0 0 "[    .    1    .    2]" 1 
       864 1 84 ARG HB3  1 85 VAL H    . .  6.000 4.265 3.275 4.634     .  0 0 "[    .    1    .    2]" 1 
       865 1 84 ARG QG   1 85 VAL H    . .  5.000 3.745 2.917 4.509     .  0 0 "[    .    1    .    2]" 1 
       866 1 85 VAL H    1 85 VAL HB   . .  3.000 2.671 2.525 2.840     .  0 0 "[    .    1    .    2]" 1 
       867 1 85 VAL H    1 85 VAL MG2  . .  4.500 2.813 2.364 3.952     .  0 0 "[    .    1    .    2]" 1 
       868 1 85 VAL HA   1 86 ASN H    . .  2.500 2.159 2.077 2.235     .  0 0 "[    .    1    .    2]" 1 
       869 1 85 VAL HA   1 86 ASN HB2  . .  6.000 4.643 4.440 5.059     .  0 0 "[    .    1    .    2]" 1 
       870 1 85 VAL HA   1 90 VAL QG   . .  7.400 3.370 2.238 3.946     .  0 0 "[    .    1    .    2]" 1 
       871 1 85 VAL HA   1 91 LYS H    . .  4.000 3.005 2.482 3.683     .  0 0 "[    .    1    .    2]" 1 
       872 1 85 VAL HB   1 86 ASN H    . .  6.000 4.411 4.213 4.530     .  0 0 "[    .    1    .    2]" 1 
       873 1 85 VAL MG1  1 86 ASN H    . .  5.000 3.335 2.810 4.195     .  0 0 "[    .    1    .    2]" 1 
       874 1 85 VAL MG1  1 87 GLY H    . .  5.000 2.996 2.406 3.722     .  0 0 "[    .    1    .    2]" 1 
       875 1 85 VAL MG1  1 87 GLY HA2  . .  7.000 3.936 3.310 5.018     .  0 0 "[    .    1    .    2]" 1 
       876 1 85 VAL MG1  1 88 THR HA   . .  7.000 3.802 2.893 5.213     .  0 0 "[    .    1    .    2]" 1 
       877 1 85 VAL MG1  1 89 GLU H    . .  7.000 4.274 3.160 5.592     .  0 0 "[    .    1    .    2]" 1 
       878 1 85 VAL MG2  1 86 ASN H    . .  7.000 4.065 2.871 4.400     .  0 0 "[    .    1    .    2]" 1 
       879 1 86 ASN H    1 86 ASN HB2  . .  4.000 2.868 2.653 3.075     .  0 0 "[    .    1    .    2]" 1 
       880 1 86 ASN H    1 89 GLU H    . .  4.000 3.610 3.092 4.004 0.004 13 0 "[    .    1    .    2]" 1 
       881 1 86 ASN H    1 89 GLU HB2  . .  6.000 3.257 2.341 5.116     .  0 0 "[    .    1    .    2]" 1 
       882 1 86 ASN H    1 90 VAL HA   . .  4.000 3.674 2.995 4.062 0.062 16 0 "[    .    1    .    2]" 1 
       883 1 86 ASN HA   1 86 ASN HB2  . .  3.000 2.567 2.436 3.033 0.033  7 0 "[    .    1    .    2]" 1 
       884 1 86 ASN HA   1 87 GLY H    . .  2.500 2.354 2.263 2.533 0.033  5 0 "[    .    1    .    2]" 1 
       885 1 86 ASN HB2  1 87 GLY H    . .  5.000 4.632 4.464 4.696     .  0 0 "[    .    1    .    2]" 1 
       886 1 86 ASN HB3  1 86 ASN QD   . .  3.430 2.277 2.183 2.850     .  0 0 "[    .    1    .    2]" 1 
       887 1 86 ASN HB3  1 86 ASN HD22 . .  4.000 3.594 3.532 3.781     .  0 0 "[    .    1    .    2]" 1 
       888 1 86 ASN HB3  1 89 GLU H    . .  6.000 3.837 3.342 4.659     .  0 0 "[    .    1    .    2]" 1 
       889 1 86 ASN HB3  1 89 GLU HB2  . .  6.000 2.465 2.030 3.929     .  0 0 "[    .    1    .    2]" 1 
       890 1 86 ASN HB3  1 89 GLU HB3  . .  6.000 3.373 2.120 5.384     .  0 0 "[    .    1    .    2]" 1 
       891 1 87 GLY H    1 88 THR H    . .  6.000 4.189 3.786 4.403     .  0 0 "[    .    1    .    2]" 1 
       892 1 87 GLY HA2  1 88 THR H    . .  3.500 3.425 3.361 3.504 0.004  7 0 "[    .    1    .    2]" 1 
       893 1 87 GLY HA2  1 88 THR MG   . .  7.000 4.394 4.230 4.839     .  0 0 "[    .    1    .    2]" 1 
       894 1 87 GLY HA2  1 89 GLU H    . .  6.000 4.837 4.640 5.521     .  0 0 "[    .    1    .    2]" 1 
       895 1 87 GLY HA3  1 88 THR H    . .  2.500 2.243 2.170 2.428     .  0 0 "[    .    1    .    2]" 1 
       896 1 87 GLY HA3  1 88 THR HA   . .  6.000 4.578 4.518 4.608     .  0 0 "[    .    1    .    2]" 1 
       897 1 87 GLY HA3  1 88 THR MG   . .  5.000 3.934 3.685 4.020     .  0 0 "[    .    1    .    2]" 1 
       898 1 87 GLY HA3  1 89 GLU H    . .  5.000 3.900 3.604 4.669     .  0 0 "[    .    1    .    2]" 1 
       899 1 88 THR H    1 88 THR MG   . .  4.000 2.945 2.719 3.242     .  0 0 "[    .    1    .    2]" 1 
       900 1 88 THR H    1 89 GLU H    . .  3.000 2.241 2.045 2.520     .  0 0 "[    .    1    .    2]" 1 
       901 1 88 THR H    1 89 GLU HB2  . .  4.500 4.509 4.238 4.602 0.102  5 0 "[    .    1    .    2]" 1 
       902 1 89 GLU H    1 89 GLU HB2  . .  3.000 2.598 2.293 2.749     .  0 0 "[    .    1    .    2]" 1 
       903 1 89 GLU H    1 89 GLU HB3  . .  4.000 3.509 2.322 3.874     .  0 0 "[    .    1    .    2]" 1 
       904 1 89 GLU H    1 89 GLU QG   . .  5.000 2.898 2.184 4.180     .  0 0 "[    .    1    .    2]" 1 
       905 1 89 GLU H    1 90 VAL QG   . .  8.400 4.510 3.975 5.207     .  0 0 "[    .    1    .    2]" 1 
       906 1 89 GLU HA   1 90 VAL H    . .  2.500 2.182 2.081 2.237     .  0 0 "[    .    1    .    2]" 1 
       907 1 89 GLU HA   1 90 VAL QG   . .  8.400 3.908 3.601 4.273     .  0 0 "[    .    1    .    2]" 1 
       908 1 89 GLU HB3  1 90 VAL H    . .  6.000 3.886 3.424 4.568     .  0 0 "[    .    1    .    2]" 1 
       909 1 89 GLU QG   1 90 VAL H    . .  7.000 4.332 3.252 4.699     .  0 0 "[    .    1    .    2]" 1 
       910 1 90 VAL H    1 90 VAL HB   . .  3.000 2.537 2.411 2.951     .  0 0 "[    .    1    .    2]" 1 
       911 1 90 VAL HA   1 91 LYS H    . .  2.500 2.229 2.084 2.400     .  0 0 "[    .    1    .    2]" 1 
       912 1 90 VAL HB   1 91 LYS H    . .  6.000 4.563 4.208 4.682     .  0 0 "[    .    1    .    2]" 1 
       913 1 90 VAL QG   1 91 LYS H    . .  6.400 3.429 2.849 3.722     .  0 0 "[    .    1    .    2]" 1 
       914 1 90 VAL QG   1 92 ILE H    . .  7.400 3.813 3.371 4.249     .  0 0 "[    .    1    .    2]" 1 
       915 1 91 LYS H    1 91 LYS HB2  . .  4.000 2.990 2.540 3.932     .  0 0 "[    .    1    .    2]" 1 
       916 1 91 LYS H    1 91 LYS HB3  . .  3.500 2.719 2.412 3.126     .  0 0 "[    .    1    .    2]" 1 
       917 1 91 LYS H    1 92 ILE H    . .  6.000 4.295 4.095 4.492     .  0 0 "[    .    1    .    2]" 1 
       918 1 91 LYS HA   1 92 ILE H    . .  2.500 2.164 2.074 2.241     .  0 0 "[    .    1    .    2]" 1 
       919 1 91 LYS HA   1 92 ILE HB   . .  5.000 4.816 4.523 5.018 0.018 11 0 "[    .    1    .    2]" 1 
       920 1 91 LYS HA   1 92 ILE MD   . .  7.000 4.868 3.180 5.652     .  0 0 "[    .    1    .    2]" 1 
       921 1 92 ILE H    1 92 ILE HB   . .  3.000 2.684 2.399 2.878     .  0 0 "[    .    1    .    2]" 1 
       922 1 92 ILE H    1 92 ILE MD   . .  5.000 3.644 2.299 4.240     .  0 0 "[    .    1    .    2]" 1 
       923 1 92 ILE HA   1 93 GLU H    . .  2.500 2.112 2.023 2.212     .  0 0 "[    .    1    .    2]" 1 
       924 1 92 ILE HB   1 93 GLU H    . .  6.000 4.418 4.282 4.576     .  0 0 "[    .    1    .    2]" 1 
       925 1 92 ILE MD   1 93 GLU H    . .  7.000 5.011 4.024 5.583     .  0 0 "[    .    1    .    2]" 1 
       926 1 92 ILE MG   1 93 GLU H    . .  4.500 3.224 2.957 3.465     .  0 0 "[    .    1    .    2]" 1 
       927 1 92 ILE MG   1 93 GLU HA   . .  7.000 4.300 3.918 4.482     .  0 0 "[    .    1    .    2]" 1 
       928 1 92 ILE MG   1 94 VAL H    . .  7.000 4.136 3.619 4.560     .  0 0 "[    .    1    .    2]" 1 
       929 1 92 ILE MG   1 94 VAL MG1  . .  8.000 2.657 1.945 5.473     .  0 0 "[    .    1    .    2]" 1 
       930 1 93 GLU HA   1 94 VAL H    . .  2.500 2.166 2.076 2.294     .  0 0 "[    .    1    .    2]" 1 
       931 1 93 GLU HA   1 94 VAL MG1  . .  7.000 4.399 3.582 5.680     .  0 0 "[    .    1    .    2]" 1 
       932 1 93 GLU HA   1 94 VAL MG2  . .  7.000 4.141 3.908 4.545     .  0 0 "[    .    1    .    2]" 1 
       933 1 93 GLU HB2  1 94 VAL H    . .  6.000 4.453 4.316 4.677     .  0 0 "[    .    1    .    2]" 1 
       934 1 93 GLU HB3  1 94 VAL H    . .  6.000 4.497 4.352 4.605     .  0 0 "[    .    1    .    2]" 1 
       935 1 93 GLU HG2  1 94 VAL H    . .  6.000 3.795 3.188 4.366     .  0 0 "[    .    1    .    2]" 1 
       936 1 93 GLU HG2  1 95 ARG HG2  . .  6.000 4.844 2.966 6.073 0.073 15 0 "[    .    1    .    2]" 1 
       937 1 93 GLU HG2  1 95 ARG HG3  . .  6.000 4.395 2.504 6.198 0.198  2 0 "[    .    1    .    2]" 1 
       938 1 93 GLU HG3  1 94 VAL H    . .  6.000 4.041 3.319 4.878     .  0 0 "[    .    1    .    2]" 1 
       939 1 94 VAL H    1 94 VAL HB   . .  4.000 3.692 2.288 4.003 0.003  9 0 "[    .    1    .    2]" 1 
       940 1 94 VAL H    1 94 VAL MG2  . .  4.000 2.477 2.315 2.656     .  0 0 "[    .    1    .    2]" 1 
       941 1 94 VAL HA   1 95 ARG H    . .  2.500 2.112 2.041 2.191     .  0 0 "[    .    1    .    2]" 1 
       942 1 94 VAL HA   1 95 ARG QB   . .  6.000 4.461 3.892 4.806     .  0 0 "[    .    1    .    2]" 1 
       943 1 94 VAL MG1  1 95 ARG H    . .  5.000 3.651 2.767 4.031     .  0 0 "[    .    1    .    2]" 1 
       944 1 94 VAL MG2  1 95 ARG H    . .  7.000 4.043 3.738 4.286     .  0 0 "[    .    1    .    2]" 1 
       945 1 95 ARG HA   1 96 VAL H    . .  2.500 2.189 2.106 2.311     .  0 0 "[    .    1    .    2]" 1 
       946 1 95 ARG QG   1 96 VAL H    . .  6.880 4.031 3.224 4.654     .  0 0 "[    .    1    .    2]" 1 
       947 1 96 VAL H    1 96 VAL HB   . .  3.000 2.659 2.547 2.957     .  0 0 "[    .    1    .    2]" 1 
       948 1 96 VAL H    1 96 VAL MG2  . .  4.000 2.421 2.185 2.960     .  0 0 "[    .    1    .    2]" 1 
       949 1 96 VAL HA   1 96 VAL MG1  . .  3.600 2.502 2.390 2.596     .  0 0 "[    .    1    .    2]" 1 
    stop_

save_



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