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
448149 2nmb 4263 cing 4-filtered-FRED Wattos check violation distance


data_2nmb


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              2591
    _Distance_constraint_stats_list.Viol_count                    1733
    _Distance_constraint_stats_list.Viol_total                    1673.952
    _Distance_constraint_stats_list.Viol_max                      1.024
    _Distance_constraint_stats_list.Viol_rms                      0.0304
    _Distance_constraint_stats_list.Viol_average_all_restraints   0.0033
    _Distance_constraint_stats_list.Viol_average_violations_only  0.0690
    _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  13 SER 0.000 0.000  . 0 "[    .    1    ]" 
       1  14 LYS 0.305 0.097 13 0 "[    .    1    ]" 
       1  15 PRO 0.000 0.000  . 0 "[    .    1    ]" 
       1  16 HIS 0.221 0.046 13 0 "[    .    1    ]" 
       1  17 GLN 0.430 0.319  9 0 "[    .    1    ]" 
       1  18 TRP 0.334 0.081  1 0 "[    .    1    ]" 
       1  19 GLN 0.786 0.056  3 0 "[    .    1    ]" 
       1  20 ALA 0.511 0.056  3 0 "[    .    1    ]" 
       1  21 ASP 0.059 0.015  9 0 "[    .    1    ]" 
       1  22 GLU 0.131 0.028 13 0 "[    .    1    ]" 
       1  23 GLU 0.712 0.415  9 0 "[    .    1    ]" 
       1  24 ALA 0.372 0.049  4 0 "[    .    1    ]" 
       1  25 VAL 4.413 0.233  7 0 "[    .    1    ]" 
       1  26 ARG 1.994 0.240 11 0 "[    .    1    ]" 
       1  27 SER 1.934 0.343 10 0 "[    .    1    ]" 
       1  28 ALA 1.386 0.259  3 0 "[    .    1    ]" 
       1  29 THR 1.844 0.343 10 0 "[    .    1    ]" 
       1  30 CYS 0.418 0.204 13 0 "[    .    1    ]" 
       1  31 SER 2.501 0.838  6 1 "[    .+   1    ]" 
       1  32 PHE 3.860 0.838  6 2 "[    .+*  1    ]" 
       1  33 SER 0.413 0.255  7 0 "[    .    1    ]" 
       1  34 VAL 2.439 0.657  1 2 "[+   .-   1    ]" 
       1  35 LYS 5.672 0.904  1 5 "[+  *.   *1 * -]" 
       1  36 TYR 1.262 0.721  6 1 "[    .+   1    ]" 
       1  37 LEU 1.061 0.263 12 0 "[    .    1    ]" 
       1  38 GLY 0.194 0.072  6 0 "[    .    1    ]" 
       1  39 CYS 5.098 0.587  1 2 "[+   .    1-   ]" 
       1  40 VAL 2.779 0.425 13 0 "[    .    1    ]" 
       1  41 GLU 0.190 0.101 13 0 "[    .    1    ]" 
       1  42 VAL 1.081 0.101 13 0 "[    .    1    ]" 
       1  43 PHE 0.035 0.024  9 0 "[    .    1    ]" 
       1  44 GLU 1.261 0.071  4 0 "[    .    1    ]" 
       1  45 SER 0.079 0.054  2 0 "[    .    1    ]" 
       1  46 ARG 4.600 0.608  5 1 "[    +    1    ]" 
       1  47 GLY 2.778 0.455 12 0 "[    .    1    ]" 
       1  48 MET 3.923 0.523 14 1 "[    .    1   +]" 
       1  49 GLN 3.188 0.612 12 3 "[    . *  1 + -]" 
       1  50 VAL 3.145 0.612 12 3 "[    . *  1 + -]" 
       1  51 CYS 2.974 0.409 10 0 "[    .    1    ]" 
       1  52 GLU 0.720 0.180  5 0 "[    .    1    ]" 
       1  53 GLU 1.481 0.409 10 0 "[    .    1    ]" 
       1  54 ALA 0.650 0.051  1 0 "[    .    1    ]" 
       1  55 LEU 0.688 0.181 12 0 "[    .    1    ]" 
       1  56 LYS 1.375 0.180  5 0 "[    .    1    ]" 
       1  57 VAL 1.008 0.059 12 0 "[    .    1    ]" 
       1  58 LEU 1.009 0.150  2 0 "[    .    1    ]" 
       1  59 ARG 0.328 0.328  6 0 "[    .    1    ]" 
       1  60 GLN 0.104 0.052 12 0 "[    .    1    ]" 
       1  61 SER 6.232 0.453  4 0 "[    .    1    ]" 
       1  62 ARG 7.766 0.453  4 0 "[    .    1    ]" 
       1  63 ARG 9.454 0.587  1 1 "[+   .    1    ]" 
       1  64 ARG 0.324 0.106  2 0 "[    .    1    ]" 
       1  65 PRO 4.940 0.904  1 5 "[+  *.   *1 * -]" 
       1  66 VAL 2.969 0.381  3 0 "[    .    1    ]" 
       1  67 ARG 7.323 0.904  1 5 "[+  *.   *1 * -]" 
       1  68 GLY 0.563 0.131  3 0 "[    .    1    ]" 
       1  69 LEU 0.357 0.056 14 0 "[    .    1    ]" 
       1  70 LEU 1.879 0.200  8 0 "[    .    1    ]" 
       1  71 HIS 0.394 0.051  7 0 "[    .    1    ]" 
       1  72 VAL 4.853 0.204 13 0 "[    .    1    ]" 
       1  73 SER 0.440 0.103 12 0 "[    .    1    ]" 
       1  74 GLY 0.167 0.054 11 0 "[    .    1    ]" 
       1  75 ASP 0.807 0.312 12 0 "[    .    1    ]" 
       1  76 GLY 1.142 0.312 12 0 "[    .    1    ]" 
       1  77 LEU 1.810 0.326  1 0 "[    .    1    ]" 
       1  78 ARG 1.266 0.076  6 0 "[    .    1    ]" 
       1  79 VAL 1.370 0.073  1 0 "[    .    1    ]" 
       1  80 VAL 2.339 0.718  5 1 "[    +    1    ]" 
       1  81 ASP 0.119 0.086 14 0 "[    .    1    ]" 
       1  82 ASP 1.920 1.024 14 1 "[    .    1   +]" 
       1  83 GLU 1.922 1.024 14 1 "[    .    1   +]" 
       1  84 THR 0.921 0.236  9 0 "[    .    1    ]" 
       1  85 LYS 0.338 0.109  8 0 "[    .    1    ]" 
       1  86 GLY 1.441 0.236  9 0 "[    .    1    ]" 
       1  87 LEU 1.977 0.175  6 0 "[    .    1    ]" 
       1  88 ILE 3.973 0.718  5 1 "[    +    1    ]" 
       1  89 VAL 1.355 0.259  3 0 "[    .    1    ]" 
       1  90 ASP 0.288 0.099  5 0 "[    .    1    ]" 
       1  91 GLN 0.148 0.049 13 0 "[    .    1    ]" 
       1  92 THR 3.469 0.522 11 1 "[    .    1+   ]" 
       1  93 ILE 4.554 0.259  3 0 "[    .    1    ]" 
       1  94 GLU 1.457 0.522 11 1 "[    .    1+   ]" 
       1  95 LYS 0.174 0.062 12 0 "[    .    1    ]" 
       1  96 VAL 0.865 0.115 10 0 "[    .    1    ]" 
       1  97 SER 0.457 0.097 10 0 "[    .    1    ]" 
       1  98 PHE 1.737 0.128 13 0 "[    .    1    ]" 
       1  99 CYS 1.299 0.448  1 0 "[    .    1    ]" 
       1 100 ALA 1.767 0.190 12 0 "[    .    1    ]" 
       1 101 PRO 0.149 0.069 13 0 "[    .    1    ]" 
       1 102 ASP 0.957 0.105  7 0 "[    .    1    ]" 
       1 103 ARG 3.237 0.523 14 1 "[    .    1   +]" 
       1 104 ASN 2.946 0.448  1 0 "[    .    1    ]" 
       1 105 HIS 4.890 0.448  1 0 "[    .    1    ]" 
       1 106 GLU 4.386 0.400  5 0 "[    .    1    ]" 
       1 107 ARG 3.751 0.538  4 2 "[   +.  - 1    ]" 
       1 108 GLY 0.395 0.079  4 0 "[    .    1    ]" 
       1 109 PHE 4.497 0.717  6 3 "[*  *.+   1    ]" 
       1 110 SER 1.447 0.448  1 0 "[    .    1    ]" 
       1 111 TYR 1.188 0.204 10 0 "[    .    1    ]" 
       1 112 ILE 1.930 0.229  8 0 "[    .    1    ]" 
       1 113 CYS 1.437 0.204 13 0 "[    .    1    ]" 
       1 114 ARG 0.484 0.087  2 0 "[    .    1    ]" 
       1 115 ASP 0.822 0.208 13 0 "[    .    1    ]" 
       1 116 GLY 0.222 0.115 12 0 "[    .    1    ]" 
       1 117 THR 0.446 0.115 12 0 "[    .    1    ]" 
       1 118 THR 1.307 0.204 13 0 "[    .    1    ]" 
       1 119 ARG 1.444 0.133  1 0 "[    .    1    ]" 
       1 120 ARG 0.973 0.208 13 0 "[    .    1    ]" 
       1 121 TRP 1.073 0.101 10 0 "[    .    1    ]" 
       1 122 MET 3.370 0.565 11 1 "[    .    1+   ]" 
       1 123 CYS 0.864 0.103 14 0 "[    .    1    ]" 
       1 124 HIS 1.101 0.097 13 0 "[    .    1    ]" 
       1 125 GLY 3.794 0.587  1 1 "[+   .    1    ]" 
       1 126 PHE 6.513 0.721  6 3 "[   *.+ - 1    ]" 
       1 127 LEU 7.457 0.657  1 2 "[+   .*   1    ]" 
       1 128 ALA 7.112 0.734  8 4 "[*  *.  + *    ]" 
       1 129 CYS 7.010 0.734  8 4 "[*  *.  + *    ]" 
       1 130 LYS 1.229 0.285  1 0 "[    .    1    ]" 
       1 131 ASP 1.946 0.691  5 1 "[    +    1    ]" 
       1 132 SER 3.551 0.691  5 1 "[    +    1    ]" 
       1 133 GLY 0.106 0.046  8 0 "[    .    1    ]" 
       1 134 GLU 0.532 0.133 13 0 "[    .    1    ]" 
       1 135 ARG 0.448 0.080  7 0 "[    .    1    ]" 
       1 136 LEU 2.495 0.793  7 1 "[    . +  1    ]" 
       1 137 SER 0.096 0.062 14 0 "[    .    1    ]" 
       1 138 HIS 0.151 0.081  1 0 "[    .    1    ]" 
       1 139 ALA 0.585 0.080  7 0 "[    .    1    ]" 
       1 140 VAL 3.412 0.200  8 0 "[    .    1    ]" 
       1 141 GLY 0.302 0.068  7 0 "[    .    1    ]" 
       1 142 CYS 0.101 0.027  1 0 "[    .    1    ]" 
       1 143 ALA 3.519 0.186  3 0 "[    .    1    ]" 
       1 144 PHE 0.331 0.046  8 0 "[    .    1    ]" 
       1 145 ALA 0.890 0.259  3 0 "[    .    1    ]" 
       1 146 VAL 1.574 0.208  7 0 "[    .    1    ]" 
       1 147 CYS 0.345 0.050 11 0 "[    .    1    ]" 
       1 148 LEU 3.203 0.977  9 2 "[-   .   +1    ]" 
       1 149 GLU 0.656 0.090 10 0 "[    .    1    ]" 
       1 150 ARG 1.404 0.376 11 0 "[    .    1    ]" 
       1 151 LYS 1.812 0.376 11 0 "[    .    1    ]" 
       1 152 GLN 4.126 0.593 12 1 "[    .    1 +  ]" 
       1 153 ARG 2.989 0.593 12 1 "[    .    1 +  ]" 
       1 154 ARG 2.130 0.593 12 1 "[    .    1 +  ]" 
       1 155 THR 0.248 0.088  8 0 "[    .    1    ]" 
       1 156 ARG 0.242 0.092  8 0 "[    .    1    ]" 
       1 157 ALA 0.148 0.038  2 0 "[    .    1    ]" 
       1 158 ALA 0.148 0.038  2 0 "[    .    1    ]" 
       1 159 ALA 0.000 0.000  . 0 "[    .    1    ]" 
       2   1 ALA 0.783 0.190 12 0 "[    .    1    ]" 
       2   2 TYR 2.077 0.529 13 1 "[    .    1  + ]" 
       2   3 ILE 4.598 0.977  9 3 "[*   . - +1    ]" 
       2   4 GLY 1.853 0.787  7 1 "[    . +  1    ]" 
       2   5 PRO 4.238 0.529 13 2 "[    .    1  +-]" 
       2   6 PTR 0.206 0.044 11 0 "[    .    1    ]" 
       2   7 LEU 2.610 0.529 13 1 "[    .    1  + ]" 
    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  13 SER HA   1  13 SER QB   1.800     . 2.400 2.211 2.058 2.398     .  0 0 "[    .    1    ]" 1 
          2 1  13 SER HA   1  13 SER QB   2.100     . 2.800 2.177 2.115 2.321     .  0 0 "[    .    1    ]" 1 
          3 1  13 SER HA   1  14 LYS H    2.100     . 2.800 2.187 1.960 2.456     .  0 0 "[    .    1    ]" 1 
          4 1  13 SER HA   1  14 LYS QB   3.000     . 4.800 4.298 3.746 4.776     .  0 0 "[    .    1    ]" 1 
          5 1  13 SER HA   1  14 LYS QG   3.200     . 5.200 4.377 3.282 5.006     .  0 0 "[    .    1    ]" 1 
          6 1  13 SER QB   1  14 LYS H    2.800     . 3.800 3.210 2.642 3.706     .  0 0 "[    .    1    ]" 1 
          7 1  14 LYS H    1  14 LYS QB   2.200     . 3.000 2.879 2.147 3.053 0.053 12 0 "[    .    1    ]" 1 
          8 1  14 LYS H    1  14 LYS QG   3.000     . 4.000 2.894 1.903 3.401 0.097 13 0 "[    .    1    ]" 1 
          9 1  14 LYS H    1  15 PRO QD   2.800     . 4.400 3.198 2.294 4.031     .  0 0 "[    .    1    ]" 1 
         10 1  14 LYS H    1  18 TRP QB   3.200 2.100 4.300 3.420 2.129 4.120     .  0 0 "[    .    1    ]" 1 
         11 1  14 LYS HA   1  14 LYS QB   2.300     . 3.100 2.387 2.168 2.538     .  0 0 "[    .    1    ]" 1 
         12 1  14 LYS HA   1  14 LYS QD   2.900     . 4.600 3.682 1.960 4.321     .  0 0 "[    .    1    ]" 1 
         13 1  14 LYS HA   1  14 LYS QG   2.700     . 3.600 2.572 2.101 3.333     .  0 0 "[    .    1    ]" 1 
         14 1  14 LYS HA   1  15 PRO HA   2.400     . 4.500 4.062 3.878 4.258     .  0 0 "[    .    1    ]" 1 
         15 1  14 LYS HA   1  15 PRO QD   2.400     . 3.200 2.161 1.988 2.368     .  0 0 "[    .    1    ]" 1 
         16 1  14 LYS HA   1  15 PRO QG   2.600     . 4.500 4.004 3.811 4.309     .  0 0 "[    .    1    ]" 1 
         17 1  14 LYS HA   1  18 TRP QB   2.900     . 4.600 3.351 1.770 4.500     .  0 0 "[    .    1    ]" 1 
         18 1  14 LYS QB   1  14 LYS QG   1.800     . 2.400 1.775 1.727 1.808     .  0 0 "[    .    1    ]" 1 
         19 1  14 LYS HB3  1  17 GLN H    3.600     . 5.500 4.821 3.610 5.248     .  0 0 "[    .    1    ]" 1 
         20 1  14 LYS QD   1  14 LYS QE   2.300     . 3.100 2.049 2.026 2.090     .  0 0 "[    .    1    ]" 1 
         21 1  14 LYS QD   1  14 LYS QG   1.900     . 2.600 2.050 1.998 2.088     .  0 0 "[    .    1    ]" 1 
         22 1  14 LYS QE   1  14 LYS QG   2.600     . 3.500 2.090 1.934 2.373     .  0 0 "[    .    1    ]" 1 
         23 1  15 PRO HA   1  15 PRO HB3  2.400     . 3.200 2.292 2.259 2.326     .  0 0 "[    .    1    ]" 1 
         24 1  15 PRO HA   1  15 PRO QD   2.700     . 4.200 2.955 2.466 3.172     .  0 0 "[    .    1    ]" 1 
         25 1  15 PRO HA   1  15 PRO QG   2.700     . 3.600 3.320 2.808 3.516     .  0 0 "[    .    1    ]" 1 
         26 1  15 PRO HA   1  15 PRO QG   2.600     . 4.000 2.403 2.001 3.055     .  0 0 "[    .    1    ]" 1 
         27 1  15 PRO HA   1  16 HIS H    2.800     . 3.800 2.939 2.192 3.569     .  0 0 "[    .    1    ]" 1 
         28 1  15 PRO HA   1  18 TRP H    2.900     . 4.600 3.638 3.227 4.110     .  0 0 "[    .    1    ]" 1 
         29 1  15 PRO HA   1  18 TRP QB   3.100     . 5.000 4.441 3.577 4.836     .  0 0 "[    .    1    ]" 1 
         30 1  15 PRO HB2  1  15 PRO QG   2.300     . 3.100 2.202 2.180 2.257     .  0 0 "[    .    1    ]" 1 
         31 1  15 PRO HB2  1  16 HIS HA   2.900     . 4.600 4.034 3.181 4.567     .  0 0 "[    .    1    ]" 1 
         32 1  16 HIS H    1  16 HIS QB   3.000     . 4.000 2.914 2.432 3.462     .  0 0 "[    .    1    ]" 1 
         33 1  16 HIS H    1  16 HIS HB3  3.400     . 5.500 3.530 2.891 4.077     .  0 0 "[    .    1    ]" 1 
         34 1  16 HIS H    1  19 GLN H    3.000     . 4.000 3.372 2.498 4.008 0.008  5 0 "[    .    1    ]" 1 
         35 1  16 HIS H    1  19 GLN H    2.600     . 3.500 2.535 2.232 2.782     .  0 0 "[    .    1    ]" 1 
         36 1  16 HIS HA   1  16 HIS HB2  2.200     . 3.200 2.798 2.446 3.026     .  0 0 "[    .    1    ]" 1 
         37 1  16 HIS HA   1  16 HIS QB   2.400     . 3.200 2.431 2.284 2.542     .  0 0 "[    .    1    ]" 1 
         38 1  16 HIS HA   1  16 HIS HB3  2.300     . 3.100 2.775 2.365 3.026     .  0 0 "[    .    1    ]" 1 
         39 1  16 HIS HA   1  19 GLN H    3.200     . 5.200 4.128 3.156 4.816     .  0 0 "[    .    1    ]" 1 
         40 1  16 HIS HA   1  19 GLN HB3  2.900     . 4.600 3.702 2.058 4.616 0.016  1 0 "[    .    1    ]" 1 
         41 1  16 HIS QB   1  19 GLN QG   3.200     . 5.200 4.949 4.468 5.246 0.046 13 0 "[    .    1    ]" 1 
         42 1  16 HIS HB2  1  17 GLN H    3.600     . 5.500 3.058 1.945 4.289     .  0 0 "[    .    1    ]" 1 
         43 1  16 HIS HB3  1  17 GLN H    3.600     . 5.500 2.554 1.933 3.683     .  0 0 "[    .    1    ]" 1 
         44 1  17 GLN C    1  21 ASP N    4.100 3.800 4.400 4.238 3.979 4.403 0.003  1 0 "[    .    1    ]" 1 
         45 1  17 GLN H    1  17 GLN HB2  3.400     . 5.500 2.414 2.071 3.226     .  0 0 "[    .    1    ]" 1 
         46 1  17 GLN H    1  17 GLN QB   3.000     . 4.000 2.367 2.050 3.111     .  0 0 "[    .    1    ]" 1 
         47 1  17 GLN H    1  18 TRP H    2.900     . 3.900 2.662 2.089 3.617     .  0 0 "[    .    1    ]" 1 
         48 1  17 GLN H    1  20 ALA MB   3.600     . 5.500 4.174 3.677 4.394     .  0 0 "[    .    1    ]" 1 
         49 1  17 GLN HA   1  17 GLN QB   2.300     . 3.100 2.479 2.380 2.543     .  0 0 "[    .    1    ]" 1 
         50 1  17 GLN HA   1  17 GLN HB3  2.500     . 3.400 2.707 2.490 2.987     .  0 0 "[    .    1    ]" 1 
         51 1  17 GLN HA   1  17 GLN HG2  2.400     . 3.200 2.810 2.099 3.519 0.319  9 0 "[    .    1    ]" 1 
         52 1  17 GLN HA   1  17 GLN HG3  2.600     . 3.500 2.613 2.055 3.499     .  0 0 "[    .    1    ]" 1 
         53 1  17 GLN HA   1  18 TRP H    2.800     . 3.800 3.514 3.450 3.570     .  0 0 "[    .    1    ]" 1 
         54 1  17 GLN HA   1  20 ALA MB   2.400     . 3.200 3.089 2.600 3.232 0.032  9 0 "[    .    1    ]" 1 
         55 1  17 GLN QB   1  21 ASP H    3.500     . 5.500 4.058 3.772 4.244     .  0 0 "[    .    1    ]" 1 
         56 1  17 GLN HB2  1  17 GLN HE21 3.300     . 5.500 2.492 1.997 2.922     .  0 0 "[    .    1    ]" 1 
         57 1  17 GLN HB2  1  18 TRP H    3.100     . 5.000 2.926 2.278 3.774     .  0 0 "[    .    1    ]" 1 
         58 1  17 GLN HE21 1  17 GLN QG   2.900     . 4.600 2.310 2.146 2.653     .  0 0 "[    .    1    ]" 1 
         59 1  17 GLN HE21 1  17 GLN HG3  3.100     . 4.200 2.814 2.299 3.550     .  0 0 "[    .    1    ]" 1 
         60 1  17 GLN HG3  1  20 ALA MB   2.600     . 4.500 3.779 3.016 4.150     .  0 0 "[    .    1    ]" 1 
         61 1  17 GLN O    1  21 ASP N    3.000 2.800 3.200 3.081 2.785 3.211 0.015  9 0 "[    .    1    ]" 1 
         62 1  18 TRP C    1  22 GLU N    4.100 3.800 4.400 4.024 3.832 4.326     .  0 0 "[    .    1    ]" 1 
         63 1  18 TRP H    1  18 TRP HA   2.600     . 3.500 2.799 2.727 2.889     .  0 0 "[    .    1    ]" 1 
         64 1  18 TRP H    1  18 TRP QB   3.100     . 3.600 2.110 2.043 2.204     .  0 0 "[    .    1    ]" 1 
         65 1  18 TRP H    1  18 TRP HD1  3.000     . 4.000 3.567 3.022 4.033 0.033  5 0 "[    .    1    ]" 1 
         66 1  18 TRP H    1  19 GLN H    2.700     . 3.600 2.657 2.307 2.858     .  0 0 "[    .    1    ]" 1 
         67 1  18 TRP H    1  19 GLN HB3  3.600     . 5.500 4.742 4.329 5.053     .  0 0 "[    .    1    ]" 1 
         68 1  18 TRP HA   1  18 TRP HD1  2.400     . 3.200 2.129 1.932 2.362     .  0 0 "[    .    1    ]" 1 
         69 1  18 TRP HA   1  18 TRP HE1  2.700     . 4.500 4.434 4.366 4.509 0.009 14 0 "[    .    1    ]" 1 
         70 1  18 TRP HA   1  19 GLN H    2.800     . 3.800 3.508 3.481 3.551     .  0 0 "[    .    1    ]" 1 
         71 1  18 TRP HA   1  20 ALA H    2.600     . 4.500 3.960 3.627 4.368     .  0 0 "[    .    1    ]" 1 
         72 1  18 TRP HA   1  21 ASP H    2.800     . 3.800 3.485 3.082 3.805 0.005  7 0 "[    .    1    ]" 1 
         73 1  18 TRP HA   1  22 GLU H    2.600     . 4.000 3.588 3.048 4.028 0.028 13 0 "[    .    1    ]" 1 
         74 1  18 TRP QB   1  18 TRP HE3  3.100     . 5.000 2.509 2.386 2.611     .  0 0 "[    .    1    ]" 1 
         75 1  18 TRP QB   1  19 GLN H    3.000 2.100 4.300 2.760 2.545 2.936     .  0 0 "[    .    1    ]" 1 
         76 1  18 TRP QB   1  19 GLN HA   2.900     . 4.600 3.802 3.697 3.862     .  0 0 "[    .    1    ]" 1 
         77 1  18 TRP HD1  1  19 GLN H    3.300     . 5.500 4.742 4.629 4.860     .  0 0 "[    .    1    ]" 1 
         78 1  18 TRP HD1  1  21 ASP H    3.600     . 5.500 5.170 4.857 5.486     .  0 0 "[    .    1    ]" 1 
         79 1  18 TRP HD1  1 138 HIS H    3.800     . 5.500 5.369 5.120 5.581 0.081  1 0 "[    .    1    ]" 1 
         80 1  18 TRP HE1  1  21 ASP QB   3.100     . 5.000 4.128 2.799 4.869     .  0 0 "[    .    1    ]" 1 
         81 1  18 TRP HE1  1 139 ALA MB   3.300     . 5.500 5.366 4.871 5.521 0.021 14 0 "[    .    1    ]" 1 
         82 1  18 TRP O    1  22 GLU N    3.000 2.800 3.200 2.910 2.781 3.208 0.019 14 0 "[    .    1    ]" 1 
         83 1  19 GLN H    1  19 GLN HA   2.600     . 3.500 2.793 2.725 2.841     .  0 0 "[    .    1    ]" 1 
         84 1  19 GLN H    1  19 GLN QB   2.400     . 3.200 2.265 2.005 2.391     .  0 0 "[    .    1    ]" 1 
         85 1  19 GLN H    1  19 GLN HB3  2.300     . 3.400 2.326 2.028 2.429     .  0 0 "[    .    1    ]" 1 
         86 1  19 GLN H    1  19 GLN QG   2.900     . 3.900 2.978 2.306 3.945 0.045 14 0 "[    .    1    ]" 1 
         87 1  19 GLN H    1  20 ALA H    2.700     . 3.600 2.661 2.512 2.837     .  0 0 "[    .    1    ]" 1 
         88 1  19 GLN H    1  20 ALA H    2.600     . 3.500 2.512 2.407 2.640     .  0 0 "[    .    1    ]" 1 
         89 1  19 GLN H    1  20 ALA MB   3.000     . 4.800 4.336 4.092 4.549     .  0 0 "[    .    1    ]" 1 
         90 1  19 GLN HA   1  19 GLN HB2  2.100     . 2.800 2.363 2.242 2.394     .  0 0 "[    .    1    ]" 1 
         91 1  19 GLN HA   1  19 GLN HB3  2.500     . 3.800 2.700 2.524 3.019     .  0 0 "[    .    1    ]" 1 
         92 1  19 GLN HA   1  19 GLN HB3  2.000     . 2.700 2.495 2.377 2.691     .  0 0 "[    .    1    ]" 1 
         93 1  19 GLN HA   1  21 ASP H    3.500     . 5.500 3.777 3.448 4.064     .  0 0 "[    .    1    ]" 1 
         94 1  19 GLN HA   1  22 GLU H    3.200 2.100 4.300 4.117 3.662 4.319 0.019 14 0 "[    .    1    ]" 1 
         95 1  19 GLN HA   1  23 GLU QB   2.700     . 4.500 3.431 3.172 3.585     .  0 0 "[    .    1    ]" 1 
         96 1  19 GLN HB3  1  19 GLN QG   2.100     . 3.000 2.272 2.129 2.495     .  0 0 "[    .    1    ]" 1 
         97 1  19 GLN HB3  1  20 ALA H    2.800     . 3.800 3.591 2.930 3.856 0.056  3 0 "[    .    1    ]" 1 
         98 1  19 GLN HB3  1  20 ALA MB   2.700     . 4.200 4.044 3.724 4.244 0.044  9 0 "[    .    1    ]" 1 
         99 1  19 GLN QG   1  20 ALA H    3.100     . 5.000 2.634 1.931 3.791     .  0 0 "[    .    1    ]" 1 
        100 1  19 GLN QG   1  20 ALA MB   3.000     . 4.000 3.155 2.672 4.010 0.010 10 0 "[    .    1    ]" 1 
        101 1  20 ALA H    1  20 ALA HA   2.600     . 3.500 2.889 2.837 2.945     .  0 0 "[    .    1    ]" 1 
        102 1  20 ALA H    1  20 ALA MB   2.300     . 3.100 2.230 2.048 2.407     .  0 0 "[    .    1    ]" 1 
        103 1  20 ALA H    1  21 ASP H    2.800     . 3.800 2.570 1.988 2.855     .  0 0 "[    .    1    ]" 1 
        104 1  20 ALA H    1  21 ASP HA   3.700     . 5.500 5.135 4.716 5.347     .  0 0 "[    .    1    ]" 1 
        105 1  20 ALA HA   1  20 ALA MB   1.800     . 2.400 2.111 2.084 2.127     .  0 0 "[    .    1    ]" 1 
        106 1  20 ALA HA   1  21 ASP H    2.800     . 4.400 3.077 2.849 3.207     .  0 0 "[    .    1    ]" 1 
        107 1  20 ALA HA   1  21 ASP H    2.900     . 3.900 2.704 2.567 2.736     .  0 0 "[    .    1    ]" 1 
        108 1  20 ALA HA   1  23 GLU H    3.300 2.100 4.500 3.716 3.414 4.385     .  0 0 "[    .    1    ]" 1 
        109 1  20 ALA HA   1  24 ALA H    3.300     . 5.500 4.213 3.764 4.698     .  0 0 "[    .    1    ]" 1 
        110 1  20 ALA MB   1  21 ASP H    2.700     . 3.600 2.433 2.101 3.577     .  0 0 "[    .    1    ]" 1 
        111 1  20 ALA MB   1  21 ASP HA   3.000     . 4.800 3.746 3.617 4.220     .  0 0 "[    .    1    ]" 1 
        112 1  20 ALA MB   1  21 ASP QB   2.600     . 4.500 4.026 3.720 4.253     .  0 0 "[    .    1    ]" 1 
        113 1  20 ALA MB   1  22 GLU H    3.300     . 5.500 4.353 4.060 5.099     .  0 0 "[    .    1    ]" 1 
        114 1  20 ALA MB   1  23 GLU H    3.400     . 5.500 4.484 3.978 5.167     .  0 0 "[    .    1    ]" 1 
        115 1  20 ALA MB   1  23 GLU HA   2.800     . 4.400 3.422 1.900 4.383     .  0 0 "[    .    1    ]" 1 
        116 1  21 ASP H    1  21 ASP HA   2.700     . 3.600 2.788 2.725 2.941     .  0 0 "[    .    1    ]" 1 
        117 1  21 ASP H    1  21 ASP QB   2.700     . 3.600 2.482 2.182 2.694     .  0 0 "[    .    1    ]" 1 
        118 1  21 ASP H    1  21 ASP QB   2.700     . 4.200 2.479 2.181 2.689     .  0 0 "[    .    1    ]" 1 
        119 1  21 ASP H    1  21 ASP QB   2.900     . 3.900 2.132 1.921 2.373     .  0 0 "[    .    1    ]" 1 
        120 1  21 ASP H    1  22 GLU H    2.600     . 3.500 2.716 2.039 2.945     .  0 0 "[    .    1    ]" 1 
        121 1  21 ASP H    1  22 GLU QB   3.400     . 5.500 4.450 3.684 4.935     .  0 0 "[    .    1    ]" 1 
        122 1  21 ASP H    1  24 ALA H    2.900     . 4.600 4.481 4.055 4.609 0.009 12 0 "[    .    1    ]" 1 
        123 1  21 ASP HA   1  22 GLU H    3.100     . 5.000 3.527 3.468 3.564     .  0 0 "[    .    1    ]" 1 
        124 1  21 ASP HA   1  23 GLU H    3.700     . 5.500 4.069 3.779 4.796     .  0 0 "[    .    1    ]" 1 
        125 1  21 ASP HA   1  24 ALA H    3.000     . 4.000 3.019 2.759 3.449     .  0 0 "[    .    1    ]" 1 
        126 1  21 ASP HA   1  24 ALA MB   2.200     . 3.000 1.925 1.806 2.078     .  0 0 "[    .    1    ]" 1 
        127 1  21 ASP HA   1  25 VAL H    3.500     . 5.500 3.941 3.071 4.508     .  0 0 "[    .    1    ]" 1 
        128 1  21 ASP HA   1  26 ARG H    3.700     . 5.500 5.056 4.818 5.217     .  0 0 "[    .    1    ]" 1 
        129 1  21 ASP QB   1  22 GLU H    3.200     . 4.000 2.847 2.449 3.601     .  0 0 "[    .    1    ]" 1 
        130 1  21 ASP QB   1  22 GLU HA   3.000     . 4.800 3.762 3.230 4.021     .  0 0 "[    .    1    ]" 1 
        131 1  21 ASP QB   1  30 CYS QB   2.700     . 4.200 3.836 3.520 4.199     .  0 0 "[    .    1    ]" 1 
        132 1  21 ASP QB   1 139 ALA HA   2.900     . 4.600 2.995 2.288 3.508     .  0 0 "[    .    1    ]" 1 
        133 1  22 GLU H    1  22 GLU HA   2.700     . 3.600 2.778 2.733 2.845     .  0 0 "[    .    1    ]" 1 
        134 1  22 GLU H    1  22 GLU QB   2.300     . 3.100 2.193 2.042 2.409     .  0 0 "[    .    1    ]" 1 
        135 1  22 GLU H    1  22 GLU QG   3.100     . 4.200 3.593 2.481 4.019     .  0 0 "[    .    1    ]" 1 
        136 1  22 GLU H    1  23 GLU H    2.600     . 3.500 2.743 2.528 3.065     .  0 0 "[    .    1    ]" 1 
        137 1  22 GLU H    1  23 GLU H    2.500     . 3.400 2.152 2.017 2.352     .  0 0 "[    .    1    ]" 1 
        138 1  22 GLU HA   1  23 GLU QB   2.500     . 4.500 4.052 3.827 4.146     .  0 0 "[    .    1    ]" 1 
        139 1  22 GLU HA   1  23 GLU HB3  2.600     . 4.000 3.778 3.599 3.970     .  0 0 "[    .    1    ]" 1 
        140 1  22 GLU HA   1  22 GLU QB   2.300     . 3.100 2.428 2.178 2.540     .  0 0 "[    .    1    ]" 1 
        141 1  22 GLU HA   1  22 GLU QG   2.500     . 3.400 2.380 2.039 3.346     .  0 0 "[    .    1    ]" 1 
        142 1  22 GLU HA   1  23 GLU H    3.100     . 5.000 3.506 3.460 3.576     .  0 0 "[    .    1    ]" 1 
        143 1  22 GLU HA   1  23 GLU QB   2.500     . 4.500 3.912 3.685 4.141     .  0 0 "[    .    1    ]" 1 
        144 1  22 GLU HA   1  23 GLU QB   2.900     . 4.600 4.166 3.926 4.387     .  0 0 "[    .    1    ]" 1 
        145 1  22 GLU HA   1  25 VAL H    3.300     . 5.500 4.179 3.961 4.392     .  0 0 "[    .    1    ]" 1 
        146 1  22 GLU HA   1  25 VAL QG   2.400     . 3.600 2.880 2.586 3.222     .  0 0 "[    .    1    ]" 1 
        147 1  22 GLU HA   1 142 CYS QB   2.700     . 4.200 3.111 2.183 3.541     .  0 0 "[    .    1    ]" 1 
        148 1  22 GLU HA   1 142 CYS QB   3.300     . 5.500 4.212 3.255 5.110     .  0 0 "[    .    1    ]" 1 
        149 1  22 GLU QB   1  23 GLU H    2.500     . 3.400 2.679 2.203 3.417 0.017  7 0 "[    .    1    ]" 1 
        150 1  22 GLU QB   1  24 ALA H    3.200     . 5.200 4.161 3.671 4.592     .  0 0 "[    .    1    ]" 1 
        151 1  23 GLU C    1  27 SER N    4.100 3.800 4.400 4.218 3.929 4.380     .  0 0 "[    .    1    ]" 1 
        152 1  23 GLU H    1  23 GLU HA   2.600     . 3.500 2.908 2.870 2.936     .  0 0 "[    .    1    ]" 1 
        153 1  23 GLU H    1  23 GLU QB   2.400     . 3.200 2.326 2.108 2.970     .  0 0 "[    .    1    ]" 1 
        154 1  23 GLU H    1  24 ALA H    3.000     . 4.000 2.251 2.091 2.443     .  0 0 "[    .    1    ]" 1 
        155 1  23 GLU H    1  24 ALA MB   3.200     . 5.200 3.887 3.735 4.098     .  0 0 "[    .    1    ]" 1 
        156 1  23 GLU HA   1  23 GLU QB   2.300     . 3.100 2.030 1.932 2.061     .  0 0 "[    .    1    ]" 1 
        157 1  23 GLU HA   1  23 GLU HB2  2.000     . 2.700 2.096 2.005 2.136     .  0 0 "[    .    1    ]" 1 
        158 1  23 GLU HA   1  23 GLU HG2  2.300     . 3.400 2.900 2.201 3.815 0.415  9 0 "[    .    1    ]" 1 
        159 1  23 GLU HA   1  23 GLU HG2  2.300     . 3.100 2.558 2.188 2.993     .  0 0 "[    .    1    ]" 1 
        160 1  23 GLU HA   1  23 GLU HG3  2.400     . 3.200 2.595 2.064 3.252 0.052  4 0 "[    .    1    ]" 1 
        161 1  23 GLU HA   1  24 ALA MB   2.900     . 4.600 3.451 1.909 4.047     .  0 0 "[    .    1    ]" 1 
        162 1  23 GLU HA   1  25 VAL QG   2.600     . 3.500 3.201 2.772 3.467     .  0 0 "[    .    1    ]" 1 
        163 1  23 GLU HA   1  25 VAL QG   2.600     . 4.000 3.013 2.693 3.282     .  0 0 "[    .    1    ]" 1 
        164 1  23 GLU HA   1  26 ARG H    3.300 2.100 4.500 3.345 2.998 3.774     .  0 0 "[    .    1    ]" 1 
        165 1  23 GLU HA   1  26 ARG QB   2.600     . 3.500 2.560 2.143 3.407     .  0 0 "[    .    1    ]" 1 
        166 1  23 GLU HA   1  26 ARG QB   2.200     . 3.200 2.184 2.023 2.446     .  0 0 "[    .    1    ]" 1 
        167 1  23 GLU HA   1  26 ARG QD   2.900     . 4.600 3.132 2.104 3.820     .  0 0 "[    .    1    ]" 1 
        168 1  23 GLU HA   1  26 ARG QD   2.700     . 4.200 3.338 2.307 4.090     .  0 0 "[    .    1    ]" 1 
        169 1  23 GLU HA   1 145 ALA MB   2.700     . 4.200 3.962 3.325 4.192     .  0 0 "[    .    1    ]" 1 
        170 1  23 GLU QB   1  24 ALA H    2.600     . 3.500 2.960 2.774 3.532 0.032  9 0 "[    .    1    ]" 1 
        171 1  23 GLU QB   1  26 ARG QB   2.600     . 4.500 3.762 3.306 4.193     .  0 0 "[    .    1    ]" 1 
        172 1  23 GLU QB   1  27 SER H    3.300     . 5.500 4.488 3.978 4.758     .  0 0 "[    .    1    ]" 1 
        173 1  23 GLU HG2  1  26 ARG H    3.300 2.100 4.500 3.341 2.067 3.856 0.033 13 0 "[    .    1    ]" 1 
        174 1  23 GLU O    1  27 SER N    3.000 2.800 3.200 3.068 2.758 3.206 0.042  4 0 "[    .    1    ]" 1 
        175 1  24 ALA C    1  28 ALA N    4.100 3.800 4.400 3.949 3.848 4.009     .  0 0 "[    .    1    ]" 1 
        176 1  24 ALA H    1  24 ALA HA   2.600     . 3.500 2.780 2.730 2.857     .  0 0 "[    .    1    ]" 1 
        177 1  24 ALA H    1  24 ALA MB   2.300     . 3.100 2.130 2.033 2.235     .  0 0 "[    .    1    ]" 1 
        178 1  24 ALA H    1  25 VAL H    2.700     . 3.600 2.893 2.656 3.132     .  0 0 "[    .    1    ]" 1 
        179 1  24 ALA H    1  25 VAL QG   3.400     . 5.500 4.104 3.585 4.809     .  0 0 "[    .    1    ]" 1 
        180 1  24 ALA HA   1  24 ALA MB   2.000     . 2.700 2.102 2.085 2.129     .  0 0 "[    .    1    ]" 1 
        181 1  24 ALA HA   1  25 VAL H    3.200     . 5.200 3.557 3.516 3.576     .  0 0 "[    .    1    ]" 1 
        182 1  24 ALA HA   1  27 SER H    2.400     . 3.600 3.558 3.423 3.649 0.049  4 0 "[    .    1    ]" 1 
        183 1  24 ALA HA   1  29 THR MG   2.600     . 3.500 2.178 1.876 2.929     .  0 0 "[    .    1    ]" 1 
        184 1  24 ALA MB   1  25 VAL H    2.800     . 3.800 2.395 2.087 2.791     .  0 0 "[    .    1    ]" 1 
        185 1  24 ALA MB   1  25 VAL HA   2.800     . 4.400 3.698 3.511 3.895     .  0 0 "[    .    1    ]" 1 
        186 1  24 ALA MB   1  25 VAL QG   2.500     . 3.800 3.272 2.917 3.737     .  0 0 "[    .    1    ]" 1 
        187 1  24 ALA MB   1  27 SER H    3.400     . 5.500 4.629 4.485 4.779     .  0 0 "[    .    1    ]" 1 
        188 1  24 ALA MB   1  29 THR H    3.300     . 5.500 3.467 3.186 3.966     .  0 0 "[    .    1    ]" 1 
        189 1  24 ALA MB   1  29 THR MG   2.900     . 4.600 2.417 1.879 2.964     .  0 0 "[    .    1    ]" 1 
        190 1  24 ALA MB   1  29 THR MG   2.500     . 3.400 2.370 1.874 2.819     .  0 0 "[    .    1    ]" 1 
        191 1  24 ALA MB   1  30 CYS H    3.200 2.100 4.300 3.440 2.497 3.908     .  0 0 "[    .    1    ]" 1 
        192 1  24 ALA MB   1  30 CYS HA   2.300     . 3.100 2.490 2.120 2.804     .  0 0 "[    .    1    ]" 1 
        193 1  24 ALA MB   1  30 CYS QB   2.300     . 3.100 2.429 1.778 2.968     .  0 0 "[    .    1    ]" 1 
        194 1  24 ALA MB   1  30 CYS QB   2.800     . 4.400 2.412 1.777 2.940     .  0 0 "[    .    1    ]" 1 
        195 1  24 ALA MB   1  31 SER H    2.800     . 4.400 4.270 3.939 4.442 0.042  7 0 "[    .    1    ]" 1 
        196 1  24 ALA O    1  28 ALA N    3.000 2.800 3.200 2.798 2.777 2.818 0.023  5 0 "[    .    1    ]" 1 
        197 1  25 VAL H    1  25 VAL HA   2.800     . 3.800 2.772 2.733 2.843     .  0 0 "[    .    1    ]" 1 
        198 1  25 VAL H    1  25 VAL HB   2.500     . 3.400 2.890 2.049 3.576 0.176  7 0 "[    .    1    ]" 1 
        199 1  25 VAL H    1  25 VAL QG   3.200 2.100 3.400 2.287 1.867 2.906 0.233  7 0 "[    .    1    ]" 1 
        200 1  25 VAL H    1  26 ARG H    2.700     . 3.600 2.747 2.594 2.881     .  0 0 "[    .    1    ]" 1 
        201 1  25 VAL H    1  27 SER H    3.100     . 5.000 4.030 3.865 4.185     .  0 0 "[    .    1    ]" 1 
        202 1  25 VAL H    1  30 CYS QB   3.500     . 5.500 2.967 2.225 3.523     .  0 0 "[    .    1    ]" 1 
        203 1  25 VAL HA   1  25 VAL HB   2.500     . 3.400 2.725 2.458 3.021     .  0 0 "[    .    1    ]" 1 
        204 1  25 VAL HA   1  25 VAL QG   2.300     . 3.100 2.143 2.063 2.286     .  0 0 "[    .    1    ]" 1 
        205 1  25 VAL HA   1  25 VAL QG   2.400     . 3.200 2.131 2.055 2.260     .  0 0 "[    .    1    ]" 1 
        206 1  25 VAL HA   1  26 ARG H    3.500     . 5.500 3.525 3.474 3.565     .  0 0 "[    .    1    ]" 1 
        207 1  25 VAL HA   1  26 ARG HA   3.000     . 4.800 4.698 4.622 4.779     .  0 0 "[    .    1    ]" 1 
        208 1  25 VAL HA   1  28 ALA H    3.300     . 5.500 3.354 3.039 3.699     .  0 0 "[    .    1    ]" 1 
        209 1  25 VAL HA   1  30 CYS H    3.200 2.100 4.300 3.583 2.754 3.986     .  0 0 "[    .    1    ]" 1 
        210 1  25 VAL HA   1  73 SER HA   2.700     . 4.200 3.204 2.708 3.575     .  0 0 "[    .    1    ]" 1 
        211 1  25 VAL HB   1 142 CYS H    3.200     . 5.200 4.162 3.979 4.419     .  0 0 "[    .    1    ]" 1 
        212 1  25 VAL HB   1  26 ARG H    2.700     . 4.200 3.297 2.449 3.749     .  0 0 "[    .    1    ]" 1 
        213 1  25 VAL HB   1  26 ARG H    2.600     . 3.500 2.892 2.058 3.382     .  0 0 "[    .    1    ]" 1 
        214 1  25 VAL HB   1  30 CYS QB   2.600     . 4.500 3.901 2.818 4.354     .  0 0 "[    .    1    ]" 1 
        215 1  25 VAL HB   1  72 VAL QG   2.900     . 4.600 3.300 2.499 3.649     .  0 0 "[    .    1    ]" 1 
        216 1  25 VAL HB   1  74 GLY H    3.500     . 5.500 4.840 3.516 5.554 0.054 11 0 "[    .    1    ]" 1 
        217 1  25 VAL HB   1 143 ALA H    3.600     . 5.500 4.021 3.591 4.376     .  0 0 "[    .    1    ]" 1 
        218 1  25 VAL HB   1 143 ALA MB   2.700     . 3.600 3.487 3.046 3.735 0.135 11 0 "[    .    1    ]" 1 
        219 1  25 VAL QG   1 142 CYS H    3.300     . 5.500 3.325 3.091 3.774     .  0 0 "[    .    1    ]" 1 
        220 1  25 VAL QG   1 142 CYS H    3.300 2.100 4.500 3.250 2.979 3.665     .  0 0 "[    .    1    ]" 1 
        221 1  25 VAL QG   1  26 ARG H    3.000     . 4.800 2.322 1.895 3.223     .  0 0 "[    .    1    ]" 1 
        222 1  25 VAL QG   1  26 ARG H    3.200 2.100 4.300 2.287 1.892 3.065 0.208  7 0 "[    .    1    ]" 1 
        223 1  25 VAL QG   1  26 ARG QG   2.300     . 4.500 3.035 2.443 3.660     .  0 0 "[    .    1    ]" 1 
        224 1  25 VAL QG   1  27 SER H    3.300     . 5.500 3.811 3.577 3.963     .  0 0 "[    .    1    ]" 1 
        225 1  25 VAL QG   1  72 VAL H    3.700     . 5.500 5.163 4.838 5.468     .  0 0 "[    .    1    ]" 1 
        226 1  25 VAL QG   1  30 CYS HA   3.000     . 4.800 4.272 4.062 4.619     .  0 0 "[    .    1    ]" 1 
        227 1  25 VAL QG   1  30 CYS QB   2.100     . 2.800 1.958 1.756 2.153     .  0 0 "[    .    1    ]" 1 
        228 1  25 VAL QG   1  30 CYS QB   2.400     . 3.200 1.767 1.577 2.050 0.023 13 0 "[    .    1    ]" 1 
        229 1  25 VAL QG   1  72 VAL QG   2.700     . 4.500 2.120 1.810 2.627     .  0 0 "[    .    1    ]" 1 
        230 1  25 VAL MG1  1  25 VAL MG2  1.900     . 2.600 1.949 1.751 2.075     .  0 0 "[    .    1    ]" 1 
        231 1  25 VAL QG   1  72 VAL QG   2.500     . 4.500 2.116 1.810 2.623     .  0 0 "[    .    1    ]" 1 
        232 1  25 VAL QG   1 143 ALA H    2.700     . 3.600 2.527 2.158 3.043     .  0 0 "[    .    1    ]" 1 
        233 1  25 VAL QG   1 143 ALA HA   2.300     . 3.100 2.069 1.655 2.791     .  0 0 "[    .    1    ]" 1 
        234 1  25 VAL QG   1 144 PHE H    3.300     . 5.500 3.934 3.574 4.518     .  0 0 "[    .    1    ]" 1 
        235 1  25 VAL QG   1  73 SER HA   3.000     . 4.800 3.662 3.219 4.104     .  0 0 "[    .    1    ]" 1 
        236 1  25 VAL QG   1  74 GLY H    3.100     . 4.200 2.968 2.195 3.718     .  0 0 "[    .    1    ]" 1 
        237 1  25 VAL QG   1  74 GLY HA3  2.100     . 4.500 3.402 2.341 4.228     .  0 0 "[    .    1    ]" 1 
        238 1  25 VAL QG   1  75 ASP H    3.200     . 5.200 4.291 3.843 4.603     .  0 0 "[    .    1    ]" 1 
        239 1  25 VAL QG   1 139 ALA HA   2.300     . 3.400 2.045 1.653 2.644     .  0 0 "[    .    1    ]" 1 
        240 1  25 VAL QG   1 139 ALA MB   2.300     . 3.400 3.211 2.833 3.355     .  0 0 "[    .    1    ]" 1 
        241 1  25 VAL QG   1 142 CYS H    2.900     . 4.600 3.390 3.151 3.804     .  0 0 "[    .    1    ]" 1 
        242 1  25 VAL QG   1 142 CYS HA   3.100     . 5.000 3.700 3.386 4.097     .  0 0 "[    .    1    ]" 1 
        243 1  25 VAL QG   1 142 CYS QB   2.900     . 4.400 2.069 1.785 2.874     .  0 0 "[    .    1    ]" 1 
        244 1  25 VAL QG   1 143 ALA H    3.500 2.300 4.700 2.615 2.179 3.121 0.121 11 0 "[    .    1    ]" 1 
        245 1  25 VAL QG   1 143 ALA HA   2.400     . 3.200 2.105 1.658 2.841     .  0 0 "[    .    1    ]" 1 
        246 1  25 VAL QG   1 143 ALA MB   2.400     . 3.200 2.291 1.710 2.971     .  0 0 "[    .    1    ]" 1 
        247 1  25 VAL QG   1 146 VAL H    3.400     . 5.500 4.212 3.375 5.073     .  0 0 "[    .    1    ]" 1 
        248 1  26 ARG H    1  26 ARG HA   2.700     . 3.600 2.792 2.757 2.830     .  0 0 "[    .    1    ]" 1 
        249 1  26 ARG H    1  26 ARG QB   2.400     . 3.200 2.178 2.041 2.684     .  0 0 "[    .    1    ]" 1 
        250 1  26 ARG H    1  26 ARG QD   3.400     . 5.500 4.064 3.443 4.511     .  0 0 "[    .    1    ]" 1 
        251 1  26 ARG H    1  26 ARG QG   3.000     . 4.800 3.310 1.942 3.997     .  0 0 "[    .    1    ]" 1 
        252 1  26 ARG HA   1  26 ARG QB   2.500     . 3.400 2.482 2.296 2.538     .  0 0 "[    .    1    ]" 1 
        253 1  26 ARG HA   1  26 ARG QG   2.500     . 3.400 2.231 2.020 2.608     .  0 0 "[    .    1    ]" 1 
        254 1  26 ARG HA   1  29 THR H    3.800     . 5.500 5.133 4.380 5.740 0.240 11 0 "[    .    1    ]" 1 
        255 1  26 ARG HA   1 145 ALA MB   2.500     . 4.500 3.465 2.968 3.930     .  0 0 "[    .    1    ]" 1 
        256 1  26 ARG HA   1 146 VAL HA   3.100     . 5.000 3.972 3.770 4.059     .  0 0 "[    .    1    ]" 1 
        257 1  26 ARG HA   1  74 GLY HA3  3.100     . 5.000 3.992 3.784 4.206     .  0 0 "[    .    1    ]" 1 
        258 1  26 ARG HA   1 146 VAL QG   3.000     . 4.800 2.060 1.855 2.204     .  0 0 "[    .    1    ]" 1 
        259 1  26 ARG HA   1 146 VAL QG   2.300     . 3.100 2.062 1.857 2.207     .  0 0 "[    .    1    ]" 1 
        260 1  26 ARG QB   1  26 ARG QD   2.900     . 4.600 2.175 1.910 2.397     .  0 0 "[    .    1    ]" 1 
        261 1  26 ARG QB   1  27 SER H    3.300     . 3.800 2.469 2.142 2.786     .  0 0 "[    .    1    ]" 1 
        262 1  26 ARG QB   1  27 SER HA   2.600     . 4.000 3.896 3.774 3.949     .  0 0 "[    .    1    ]" 1 
        263 1  26 ARG QB   1  27 SER QB   3.000     . 4.800 3.636 3.271 4.181     .  0 0 "[    .    1    ]" 1 
        264 1  26 ARG QB   1  74 GLY HA3  2.900     . 4.600 4.435 3.760 4.560     .  0 0 "[    .    1    ]" 1 
        265 1  26 ARG QB   1 146 VAL QG   2.800     . 4.400 3.670 3.306 3.872     .  0 0 "[    .    1    ]" 1 
        266 1  26 ARG QD   1 146 VAL QG   2.800     . 4.400 3.812 1.991 4.290     .  0 0 "[    .    1    ]" 1 
        267 1  26 ARG QG   1 146 VAL MG1  3.000     . 4.800 3.277 2.566 4.122     .  0 0 "[    .    1    ]" 1 
        268 1  26 ARG QG   1  27 SER H    3.000     . 4.800 3.925 3.556 4.141     .  0 0 "[    .    1    ]" 1 
        269 1  26 ARG QG   1 146 VAL QG   2.600     . 3.500 3.103 2.559 3.505 0.005  9 0 "[    .    1    ]" 1 
        270 1  27 SER H    1  27 SER HA   2.600     . 3.500 2.905 2.824 2.926     .  0 0 "[    .    1    ]" 1 
        271 1  27 SER H    1  27 SER QB   2.700     . 3.600 2.353 2.092 2.879     .  0 0 "[    .    1    ]" 1 
        272 1  27 SER HA   1  28 ALA MB   2.900     . 4.600 3.818 3.702 3.887     .  0 0 "[    .    1    ]" 1 
        273 1  27 SER HA   1  28 ALA MB   2.800     . 4.400 3.556 3.443 3.620     .  0 0 "[    .    1    ]" 1 
        274 1  27 SER HA   1 146 VAL QG   2.500     . 4.500 4.044 3.615 4.274     .  0 0 "[    .    1    ]" 1 
        275 1  27 SER QB   1  29 THR MG   2.700     . 3.600 2.436 2.225 3.098     .  0 0 "[    .    1    ]" 1 
        276 1  27 SER HB3  1  29 THR MG   2.600     . 3.500 2.833 2.269 3.843 0.343 10 0 "[    .    1    ]" 1 
        277 1  28 ALA H    1  28 ALA HA   2.200     . 3.000 2.275 2.265 2.284     .  0 0 "[    .    1    ]" 1 
        278 1  28 ALA H    1  29 THR H    2.600     . 3.500 3.297 2.914 3.521 0.021 11 0 "[    .    1    ]" 1 
        279 1  28 ALA H    1  29 THR MG   3.400     . 5.500 3.038 2.778 3.194     .  0 0 "[    .    1    ]" 1 
        280 1  28 ALA H    1  30 CYS H    3.500     . 5.500 5.302 4.595 5.527 0.027  6 0 "[    .    1    ]" 1 
        281 1  28 ALA H    1  73 SER HA   3.400     . 5.500 4.449 4.022 4.685     .  0 0 "[    .    1    ]" 1 
        282 1  28 ALA HA   1  28 ALA MB   2.000     . 2.700 2.118 2.091 2.128     .  0 0 "[    .    1    ]" 1 
        283 1  28 ALA HA   1  29 THR H    2.800     . 3.800 2.313 2.202 2.411     .  0 0 "[    .    1    ]" 1 
        284 1  28 ALA HA   1  73 SER HA   2.700     . 3.600 2.486 1.960 2.847     .  0 0 "[    .    1    ]" 1 
        285 1  28 ALA HA   1  73 SER QB   2.800     . 4.400 2.774 2.351 3.314     .  0 0 "[    .    1    ]" 1 
        286 1  28 ALA MB   1  29 THR H    2.800     . 3.800 3.626 3.519 3.692     .  0 0 "[    .    1    ]" 1 
        287 1  28 ALA MB   1  29 THR HA   2.800     . 4.400 4.244 4.097 4.343     .  0 0 "[    .    1    ]" 1 
        288 1  28 ALA MB   1  29 THR HB   2.500     . 4.500 4.258 4.147 4.382     .  0 0 "[    .    1    ]" 1 
        289 1  28 ALA MB   1  29 THR MG   2.600     . 4.000 3.964 3.813 4.025 0.025  9 0 "[    .    1    ]" 1 
        290 1  28 ALA MB   1  29 THR MG   2.700     . 4.200 3.073 2.871 3.348     .  0 0 "[    .    1    ]" 1 
        291 1  28 ALA MB   1  30 CYS H    3.300     . 5.500 4.883 4.710 5.107     .  0 0 "[    .    1    ]" 1 
        292 1  28 ALA MB   1  72 VAL H    3.800     . 5.500 5.243 4.889 5.476     .  0 0 "[    .    1    ]" 1 
        293 1  28 ALA MB   1  73 SER HA   2.700     . 4.200 3.572 3.128 4.017     .  0 0 "[    .    1    ]" 1 
        294 1  28 ALA MB   1  73 SER QB   2.600     . 3.500 2.218 1.781 3.030     .  0 0 "[    .    1    ]" 1 
        295 1  28 ALA MB   1  74 GLY H    3.300     . 5.500 4.448 4.321 4.610     .  0 0 "[    .    1    ]" 1 
        296 1  28 ALA MB   1  93 ILE MD   2.600     . 3.500 3.074 2.104 3.759 0.259  3 0 "[    .    1    ]" 1 
        297 1  28 ALA MB   1 143 ALA MB   2.600     . 4.500 4.368 4.007 4.625 0.125  3 0 "[    .    1    ]" 1 
        298 1  28 ALA MB   1  93 ILE MG   3.100     . 5.000 4.964 4.741 5.045 0.045  1 0 "[    .    1    ]" 1 
        299 1  28 ALA MB   1 146 VAL QG   2.500     . 3.400 2.757 2.614 2.910     .  0 0 "[    .    1    ]" 1 
        300 1  29 THR H    1  29 THR HA   2.800     . 3.800 2.789 2.759 2.828     .  0 0 "[    .    1    ]" 1 
        301 1  29 THR H    1  29 THR HB   3.400 2.200 4.600 3.675 3.632 3.715     .  0 0 "[    .    1    ]" 1 
        302 1  29 THR H    1  29 THR MG   2.900     . 3.900 2.666 2.477 2.801     .  0 0 "[    .    1    ]" 1 
        303 1  29 THR H    1  30 CYS H    2.500     . 3.400 2.175 1.891 2.487     .  0 0 "[    .    1    ]" 1 
        304 1  29 THR H    1  31 SER H    3.300     . 5.500 4.189 3.848 4.350     .  0 0 "[    .    1    ]" 1 
        305 1  29 THR H    1  73 SER H    3.500     . 5.500 4.374 4.226 4.536     .  0 0 "[    .    1    ]" 1 
        306 1  29 THR HA   1  29 THR HB   2.200     . 3.000 2.371 2.341 2.391     .  0 0 "[    .    1    ]" 1 
        307 1  29 THR HA   1  29 THR MG   2.000     . 4.500 3.208 3.198 3.220     .  0 0 "[    .    1    ]" 1 
        308 1  29 THR HA   1  29 THR MG   2.300     . 3.100 2.385 2.101 2.934     .  0 0 "[    .    1    ]" 1 
        309 1  29 THR HA   1  30 CYS H    2.700     . 3.600 2.785 2.558 3.517     .  0 0 "[    .    1    ]" 1 
        310 1  29 THR HB   1  29 THR MG   2.000     . 2.700 2.096 2.069 2.116     .  0 0 "[    .    1    ]" 1 
        311 1  29 THR HB   1  29 THR MG   2.100     . 3.000 1.873 1.822 1.938     .  0 0 "[    .    1    ]" 1 
        312 1  29 THR HB   1  30 CYS H    3.400     . 5.500 4.306 4.151 4.421     .  0 0 "[    .    1    ]" 1 
        313 1  29 THR HB   1  73 SER QB   2.200     . 4.500 4.273 3.804 4.512 0.012  3 0 "[    .    1    ]" 1 
        314 1  29 THR MG   1  30 CYS H    3.000     . 4.800 3.770 2.312 4.028     .  0 0 "[    .    1    ]" 1 
        315 1  30 CYS H    1  30 CYS HA   2.800     . 3.800 2.927 2.690 2.950     .  0 0 "[    .    1    ]" 1 
        316 1  30 CYS H    1  30 CYS QB   2.800     . 3.600 2.375 2.232 2.483     .  0 0 "[    .    1    ]" 1 
        317 1  30 CYS H    1  31 SER H    3.200     . 5.200 4.410 3.452 4.645     .  0 0 "[    .    1    ]" 1 
        318 1  30 CYS H    1  72 VAL H    3.500     . 5.500 4.033 3.704 5.061     .  0 0 "[    .    1    ]" 1 
        319 1  30 CYS H    1  72 VAL HB   3.400     . 5.500 4.456 3.359 5.490     .  0 0 "[    .    1    ]" 1 
        320 1  30 CYS HA   1  31 SER H    2.000     . 2.700 2.418 2.156 2.679     .  0 0 "[    .    1    ]" 1 
        321 1  30 CYS QB   1  31 SER H    3.000     . 4.800 3.005 2.276 4.068     .  0 0 "[    .    1    ]" 1 
        322 1  30 CYS QB   1  72 VAL H    3.000     . 4.000 3.547 2.413 4.119 0.119  9 0 "[    .    1    ]" 1 
        323 1  30 CYS QB   1  72 VAL HA   3.100     . 5.000 4.607 4.253 5.204 0.204 13 0 "[    .    1    ]" 1 
        324 1  30 CYS QB   1  72 VAL H    3.700     . 5.500 4.105 3.524 5.041     .  0 0 "[    .    1    ]" 1 
        325 1  30 CYS QB   1  72 VAL HB   3.000     . 4.800 2.790 1.946 4.248     .  0 0 "[    .    1    ]" 1 
        326 1  30 CYS QB   1  73 SER HA   3.200     . 5.200 3.377 3.034 3.982     .  0 0 "[    .    1    ]" 1 
        327 1  30 CYS QB   1 139 ALA MB   2.700     . 3.600 3.437 3.244 3.571     .  0 0 "[    .    1    ]" 1 
        328 1  30 CYS QB   1 143 ALA HA   2.500     . 4.500 4.274 3.974 4.476     .  0 0 "[    .    1    ]" 1 
        329 1  31 SER H    1  31 SER HA   2.700     . 3.600 2.830 2.763 2.947     .  0 0 "[    .    1    ]" 1 
        330 1  31 SER H    1  31 SER HB2  3.000     . 4.000 3.547 2.945 4.081 0.081 14 0 "[    .    1    ]" 1 
        331 1  31 SER H    1  31 SER HB3  3.200 2.100 4.300 3.685 2.961 4.015     .  0 0 "[    .    1    ]" 1 
        332 1  31 SER H    1  32 PHE H    3.400     . 5.500 4.265 3.882 4.575     .  0 0 "[    .    1    ]" 1 
        333 1  31 SER HA   1  31 SER HB2  2.400     . 3.200 2.733 2.323 3.010     .  0 0 "[    .    1    ]" 1 
        334 1  31 SER HA   1  31 SER HB3  2.400     . 3.200 2.490 2.242 3.030     .  0 0 "[    .    1    ]" 1 
        335 1  31 SER HA   1  32 PHE H    2.300     . 3.100 2.267 2.052 2.370     .  0 0 "[    .    1    ]" 1 
        336 1  31 SER HA   1  32 PHE HA   2.900     . 4.600 3.961 3.888 3.994     .  0 0 "[    .    1    ]" 1 
        337 1  31 SER HA   1  32 PHE HB2  3.000     . 4.800 4.340 3.932 5.638 0.838  6 1 "[    .+   1    ]" 1 
        338 1  31 SER HA   1  32 PHE HB2  2.700     . 4.500 3.893 3.521 5.221 0.721  6 1 "[    .+   1    ]" 1 
        339 1  31 SER HA   1  72 VAL H    3.100     . 5.000 1.998 1.830 2.209     .  0 0 "[    .    1    ]" 1 
        340 1  31 SER HA   1  69 LEU QD   2.900     . 4.600 3.280 2.910 3.606     .  0 0 "[    .    1    ]" 1 
        341 1  31 SER HA   1  70 LEU H    3.800     . 5.500 4.197 3.902 4.506     .  0 0 "[    .    1    ]" 1 
        342 1  31 SER HA   1  71 HIS HA   2.300     . 3.100 2.919 2.294 3.134 0.034  9 0 "[    .    1    ]" 1 
        343 1  31 SER HA   1  72 VAL H    3.200 2.100 4.300 2.207 2.036 2.399 0.064  7 0 "[    .    1    ]" 1 
        344 1  31 SER HA   1  72 VAL HA   3.100     . 5.000 4.868 4.696 5.071 0.071 12 0 "[    .    1    ]" 1 
        345 1  31 SER HB2  1  32 PHE H    3.000     . 4.000 3.415 2.643 4.036 0.036  1 0 "[    .    1    ]" 1 
        346 1  31 SER HB2  1  69 LEU QD   2.600     . 3.500 2.552 1.909 3.254     .  0 0 "[    .    1    ]" 1 
        347 1  31 SER HB2  1  69 LEU QD   2.500     . 3.800 2.600 1.938 3.322     .  0 0 "[    .    1    ]" 1 
        348 1  31 SER HB2  1  71 HIS HA   2.900     . 4.600 3.435 1.944 4.434     .  0 0 "[    .    1    ]" 1 
        349 1  31 SER HB2  1  72 VAL H    2.800     . 4.400 3.401 2.383 3.806     .  0 0 "[    .    1    ]" 1 
        350 1  31 SER HB3  1  32 PHE H    3.100     . 4.200 3.437 2.601 4.054     .  0 0 "[    .    1    ]" 1 
        351 1  31 SER HB3  1  69 LEU QD   2.700     . 3.600 2.793 1.777 3.317 0.023  1 0 "[    .    1    ]" 1 
        352 1  31 SER HB3  1  71 HIS HA   2.700     . 4.200 2.803 1.937 3.995     .  0 0 "[    .    1    ]" 1 
        353 1  31 SER HB3  1  72 VAL H    3.600     . 5.500 3.569 2.443 4.546     .  0 0 "[    .    1    ]" 1 
        354 1  32 PHE C    1  70 LEU N    4.100 3.800 4.400 3.876 3.784 4.026 0.016 10 0 "[    .    1    ]" 1 
        355 1  32 PHE H    1  32 PHE HA   2.900     . 3.900 2.822 2.780 2.857     .  0 0 "[    .    1    ]" 1 
        356 1  32 PHE H    1  32 PHE HB3  3.300     . 5.500 3.819 3.132 3.969     .  0 0 "[    .    1    ]" 1 
        357 1  32 PHE H    1  32 PHE QD   3.100     . 4.200 3.731 3.211 4.161     .  0 0 "[    .    1    ]" 1 
        358 1  32 PHE H    1  33 SER H    3.600     . 5.500 4.264 4.130 4.414     .  0 0 "[    .    1    ]" 1 
        359 1  32 PHE H    1  34 VAL QG   3.200     . 5.200 3.364 3.029 3.722     .  0 0 "[    .    1    ]" 1 
        360 1  32 PHE H    1  69 LEU HA   3.600     . 5.500 4.516 4.077 5.371     .  0 0 "[    .    1    ]" 1 
        361 1  32 PHE H    1  69 LEU QD   3.300     . 5.500 2.493 2.138 2.933     .  0 0 "[    .    1    ]" 1 
        362 1  32 PHE H    1  70 LEU H    3.000     . 4.000 3.092 2.612 4.016 0.016  7 0 "[    .    1    ]" 1 
        363 1  32 PHE H    1  70 LEU QD   2.800     . 4.400 3.042 2.608 3.520     .  0 0 "[    .    1    ]" 1 
        364 1  32 PHE H    1  70 LEU QD   3.300     . 5.500 3.720 3.395 4.284     .  0 0 "[    .    1    ]" 1 
        365 1  32 PHE H    1  72 VAL H    3.500     . 5.500 3.774 2.830 4.163     .  0 0 "[    .    1    ]" 1 
        366 1  32 PHE H    1  72 VAL HB   3.300     . 5.500 4.959 4.445 5.613 0.113  7 0 "[    .    1    ]" 1 
        367 1  32 PHE HA   1  32 PHE HB2  2.500     . 3.400 2.960 2.508 3.026     .  0 0 "[    .    1    ]" 1 
        368 1  32 PHE HA   1  32 PHE HB3  2.800     . 4.400 2.572 2.362 2.891     .  0 0 "[    .    1    ]" 1 
        369 1  32 PHE HA   1  32 PHE QD   2.400     . 3.200 2.737 2.339 3.625 0.425  6 0 "[    .    1    ]" 1 
        370 1  32 PHE HA   1  33 SER H    2.200     . 3.000 2.146 2.084 2.357     .  0 0 "[    .    1    ]" 1 
        371 1  32 PHE HA   1  69 LEU QD   2.200     . 3.000 2.040 1.862 2.211     .  0 0 "[    .    1    ]" 1 
        372 1  32 PHE HA   1  69 LEU QD   2.600     . 3.500 1.849 1.649 2.078 0.051  7 0 "[    .    1    ]" 1 
        373 1  32 PHE HA   1  34 VAL QG   2.700     . 4.500 3.450 3.297 3.883     .  0 0 "[    .    1    ]" 1 
        374 1  32 PHE HB2  1  33 SER H    3.100     . 4.200 4.010 2.202 4.455 0.255  7 0 "[    .    1    ]" 1 
        375 1  32 PHE HB2  1  70 LEU H    3.700     . 5.500 4.786 4.421 5.524 0.024  7 0 "[    .    1    ]" 1 
        376 1  32 PHE HB2  1 136 LEU H    3.600     . 5.500 5.122 4.322 6.293 0.793  7 1 "[    . +  1    ]" 1 
        377 1  32 PHE HB3  1  33 SER H    3.400     . 5.500 3.090 2.824 3.677     .  0 0 "[    .    1    ]" 1 
        378 1  32 PHE HB3  1  70 LEU H    3.600     . 5.500 5.199 4.678 5.468     .  0 0 "[    .    1    ]" 1 
        379 1  32 PHE QR   1  69 LEU QD   2.400     . 4.500 3.230 2.686 3.749     .  0 0 "[    .    1    ]" 1 
        380 1  32 PHE QR   1  72 VAL QG   2.600     . 4.000 3.449 1.829 3.896     .  0 0 "[    .    1    ]" 1 
        381 1  32 PHE QR   1 139 ALA H    3.900     . 5.500 4.581 4.148 4.853     .  0 0 "[    .    1    ]" 1 
        382 1  32 PHE QR   1 130 LYS QG   3.000     . 4.800 4.513 3.449 4.822 0.022  6 0 "[    .    1    ]" 1 
        383 1  32 PHE QR   1 139 ALA MB   2.600     . 4.000 2.156 1.731 2.652     .  0 0 "[    .    1    ]" 1 
        384 1  32 PHE QD   1  33 SER H    3.200 2.100 4.300 3.443 2.662 4.018     .  0 0 "[    .    1    ]" 1 
        385 1  32 PHE QD   1 130 LYS QG   2.900     . 4.600 3.508 3.112 3.912     .  0 0 "[    .    1    ]" 1 
        386 1  32 PHE QD   1 140 VAL H    3.400     . 5.500 5.080 4.659 5.473     .  0 0 "[    .    1    ]" 1 
        387 1  32 PHE N    1  70 LEU C    4.100 3.800 4.400 4.176 3.984 4.313     .  0 0 "[    .    1    ]" 1 
        388 1  32 PHE N    1  70 LEU O    3.000 2.800 3.200 3.206 3.113 3.257 0.057  6 0 "[    .    1    ]" 1 
        389 1  32 PHE O    1  70 LEU N    3.000 2.800 3.200 2.870 2.775 3.107 0.025 11 0 "[    .    1    ]" 1 
        390 1  33 SER H    1  33 SER QB   2.400     . 3.200 2.355 2.114 2.896     .  0 0 "[    .    1    ]" 1 
        391 1  33 SER H    1  34 VAL H    3.400     . 5.500 4.647 4.610 4.660     .  0 0 "[    .    1    ]" 1 
        392 1  33 SER H    1  34 VAL QG   3.400     . 5.500 4.745 4.120 5.191     .  0 0 "[    .    1    ]" 1 
        393 1  33 SER H    1  69 LEU QD   3.200     . 5.200 2.488 2.295 2.953     .  0 0 "[    .    1    ]" 1 
        394 1  33 SER H    1 136 LEU QD   3.600     . 5.500 4.035 3.614 4.851     .  0 0 "[    .    1    ]" 1 
        395 1  33 SER HA   1  33 SER QB   2.200     . 3.000 2.371 2.163 2.504     .  0 0 "[    .    1    ]" 1 
        396 1  33 SER HA   1  34 VAL H    2.200     . 3.000 2.364 2.211 2.464     .  0 0 "[    .    1    ]" 1 
        397 1  33 SER HA   1  34 VAL QG   2.700     . 3.600 3.330 2.950 3.537     .  0 0 "[    .    1    ]" 1 
        398 1  33 SER HA   1  34 VAL QG   2.800     . 4.400 3.002 2.887 3.057     .  0 0 "[    .    1    ]" 1 
        399 1  33 SER HA   1  34 VAL QG   2.900     . 4.600 2.926 2.843 2.968     .  0 0 "[    .    1    ]" 1 
        400 1  33 SER HA   1  69 LEU H    3.600     . 5.500 4.607 4.460 4.863     .  0 0 "[    .    1    ]" 1 
        401 1  33 SER HA   1  69 LEU HA   2.600     . 3.500 2.129 1.919 2.501     .  0 0 "[    .    1    ]" 1 
        402 1  33 SER HA   1  69 LEU QD   2.200     . 3.000 2.193 1.910 2.468     .  0 0 "[    .    1    ]" 1 
        403 1  33 SER HA   1  69 LEU HG   2.800     . 4.400 3.590 2.880 4.418 0.018  7 0 "[    .    1    ]" 1 
        404 1  33 SER HA   1  70 LEU H    3.300 2.100 4.500 3.216 2.631 3.831     .  0 0 "[    .    1    ]" 1 
        405 1  33 SER QB   1  34 VAL H    2.600     . 3.500 3.123 2.423 3.464     .  0 0 "[    .    1    ]" 1 
        406 1  33 SER QB   1  34 VAL QG   2.900     . 4.600 4.284 3.946 4.566     .  0 0 "[    .    1    ]" 1 
        407 1  33 SER QB   1 129 CYS HA   3.200     . 5.200 4.701 4.458 5.000     .  0 0 "[    .    1    ]" 1 
        408 1  33 SER QB   1  69 LEU QD   2.400     . 3.600 2.801 2.571 2.976     .  0 0 "[    .    1    ]" 1 
        409 1  33 SER QB   1  69 LEU QD   2.400     . 3.200 3.033 2.704 3.198     .  0 0 "[    .    1    ]" 1 
        410 1  33 SER QB   1  69 LEU QD   2.900     . 4.600 2.967 2.691 3.111     .  0 0 "[    .    1    ]" 1 
        411 1  33 SER QB   1 129 CYS H    3.400     . 5.500 4.387 4.173 4.636     .  0 0 "[    .    1    ]" 1 
        412 1  33 SER QB   1 129 CYS HB2  2.600     . 3.500 2.773 2.414 3.247     .  0 0 "[    .    1    ]" 1 
        413 1  33 SER QB   1 129 CYS HB3  2.700     . 4.200 2.623 2.177 2.932     .  0 0 "[    .    1    ]" 1 
        414 1  33 SER QB   1 130 LYS QD   2.800     . 4.400 4.071 3.417 4.402 0.002  9 0 "[    .    1    ]" 1 
        415 1  33 SER QB   1 130 LYS QG   2.800     . 4.400 3.980 3.158 4.410 0.010  5 0 "[    .    1    ]" 1 
        416 1  34 VAL H    1  34 VAL HA   2.400     . 3.200 2.263 2.202 2.340     .  0 0 "[    .    1    ]" 1 
        417 1  34 VAL H    1  34 VAL HA   2.600     . 4.000 2.182 2.136 2.240     .  0 0 "[    .    1    ]" 1 
        418 1  34 VAL H    1  34 VAL HB   3.500     . 5.500 3.435 3.115 3.636     .  0 0 "[    .    1    ]" 1 
        419 1  34 VAL H    1  34 VAL QG   2.400     . 3.200 2.651 2.368 2.729     .  0 0 "[    .    1    ]" 1 
        420 1  34 VAL H    1 129 CYS H    3.300 2.100 4.500 3.448 3.169 3.708     .  0 0 "[    .    1    ]" 1 
        421 1  34 VAL H    1  36 TYR H    3.600     . 5.500 4.039 3.916 4.158     .  0 0 "[    .    1    ]" 1 
        422 1  34 VAL H    1  69 LEU QD   2.400     . 3.600 2.515 2.149 2.727     .  0 0 "[    .    1    ]" 1 
        423 1  34 VAL H    1  69 LEU HA   3.200 2.100 4.300 3.314 2.398 3.885     .  0 0 "[    .    1    ]" 1 
        424 1  34 VAL H    1  69 LEU QD   2.800     . 4.400 4.150 3.774 4.360     .  0 0 "[    .    1    ]" 1 
        425 1  34 VAL H    1  70 LEU H    3.400     . 5.500 4.171 3.244 4.806     .  0 0 "[    .    1    ]" 1 
        426 1  34 VAL H    1  79 VAL MG2  3.000     . 4.800 3.872 3.758 3.951     .  0 0 "[    .    1    ]" 1 
        427 1  34 VAL HA   1  34 VAL HB   2.600     . 3.500 2.598 2.403 2.980     .  0 0 "[    .    1    ]" 1 
        428 1  34 VAL HA   1  34 VAL QG   2.400     . 3.100 2.175 1.961 2.307     .  0 0 "[    .    1    ]" 1 
        429 1  34 VAL HA   1  35 LYS H    2.400     . 3.200 2.377 2.304 2.474     .  0 0 "[    .    1    ]" 1 
        430 1  34 VAL HA   1  35 LYS HD3  2.700     . 4.200 4.083 3.887 4.241 0.041  4 0 "[    .    1    ]" 1 
        431 1  34 VAL HA   1 128 ALA HA   2.600     . 3.500 3.167 2.801 3.491     .  0 0 "[    .    1    ]" 1 
        432 1  34 VAL HA   1 128 ALA MB   2.900     . 4.600 4.387 4.097 4.610 0.010  4 0 "[    .    1    ]" 1 
        433 1  34 VAL HA   1 129 CYS H    2.600     . 3.500 2.050 1.935 2.222     .  0 0 "[    .    1    ]" 1 
        434 1  34 VAL HB   1  35 LYS H    2.700     . 4.200 3.566 2.754 3.875     .  0 0 "[    .    1    ]" 1 
        435 1  34 VAL HB   1 127 LEU H    3.400     . 5.500 5.566 5.016 6.157 0.657  1 2 "[+   .-   1    ]" 1 
        436 1  34 VAL HB   1 128 ALA MB   2.800     . 4.400 4.163 3.701 4.418 0.018  9 0 "[    .    1    ]" 1 
        437 1  34 VAL HB   1 129 CYS H    3.400     . 5.500 3.797 2.952 5.051     .  0 0 "[    .    1    ]" 1 
        438 1  34 VAL HB   1 136 LEU QD   2.600     . 3.500 2.295 1.752 3.508 0.008  9 0 "[    .    1    ]" 1 
        439 1  34 VAL QG   1  35 LYS H    2.700     . 3.600 1.877 1.824 1.962     .  0 0 "[    .    1    ]" 1 
        440 1  34 VAL QG   1  35 LYS HA   2.900     . 4.600 3.524 3.318 4.100     .  0 0 "[    .    1    ]" 1 
        441 1  34 VAL QG   1  35 LYS HB2  2.900     . 4.600 1.853 1.690 2.219     .  0 0 "[    .    1    ]" 1 
        442 1  34 VAL QG   1  35 LYS QG   2.700     . 4.500 4.049 3.422 4.378     .  0 0 "[    .    1    ]" 1 
        443 1  34 VAL QG   1  36 TYR H    3.400     . 5.500 2.448 2.037 2.885     .  0 0 "[    .    1    ]" 1 
        444 1  34 VAL QG   1  36 TYR HA   2.900     . 4.600 3.166 2.964 3.540     .  0 0 "[    .    1    ]" 1 
        445 1  34 VAL QG   1  36 TYR HB2  2.900     . 4.600 2.822 2.500 3.376     .  0 0 "[    .    1    ]" 1 
        446 1  34 VAL QG   1 127 LEU HB3  2.700     . 4.200 3.063 1.821 3.631     .  0 0 "[    .    1    ]" 1 
        447 1  34 VAL QG   1  66 VAL QG   2.700     . 4.200 3.432 3.046 3.882     .  0 0 "[    .    1    ]" 1 
        448 1  34 VAL QG   1  68 GLY H    3.000     . 4.000 3.794 3.150 4.131 0.131  3 0 "[    .    1    ]" 1 
        449 1  34 VAL QG   1  68 GLY H    2.900     . 4.600 2.374 2.069 2.743     .  0 0 "[    .    1    ]" 1 
        450 1  34 VAL QG   1  69 LEU HA   2.900     . 4.600 3.080 2.250 3.377     .  0 0 "[    .    1    ]" 1 
        451 1  34 VAL QG   1  70 LEU H    2.800     . 3.800 2.420 2.078 3.010     .  0 0 "[    .    1    ]" 1 
        452 1  34 VAL QG   1  70 LEU HA   2.800     . 4.400 3.332 2.554 3.626     .  0 0 "[    .    1    ]" 1 
        453 1  34 VAL QG   1  70 LEU HA   2.800     . 4.400 3.243 2.540 3.499     .  0 0 "[    .    1    ]" 1 
        454 1  34 VAL QG   1  70 LEU QB   2.600     . 3.500 1.859 1.692 2.236 0.008  2 0 "[    .    1    ]" 1 
        455 1  34 VAL QG   1  70 LEU QD   2.200     . 3.200 2.340 1.920 2.618     .  0 0 "[    .    1    ]" 1 
        456 1  34 VAL QG   1  70 LEU QD   2.400     . 3.600 2.161 1.841 2.349     .  0 0 "[    .    1    ]" 1 
        457 1  34 VAL QG   1  70 LEU QD   2.700     . 4.200 1.725 1.483 2.068     .  0 0 "[    .    1    ]" 1 
        458 1  34 VAL QG   1 140 VAL QG   2.700     . 4.200 2.606 2.220 2.908     .  0 0 "[    .    1    ]" 1 
        459 1  34 VAL QG   1 126 PHE QD   2.400     . 3.600 1.899 1.783 2.222     .  0 0 "[    .    1    ]" 1 
        460 1  34 VAL QG   1 127 LEU H    3.200     . 5.200 3.039 2.604 3.445     .  0 0 "[    .    1    ]" 1 
        461 1  34 VAL QG   1 127 LEU HB2  2.400     . 4.500 3.378 3.310 3.446     .  0 0 "[    .    1    ]" 1 
        462 1  34 VAL QG   1 128 ALA HA   2.500     . 3.400 2.033 1.935 2.142     .  0 0 "[    .    1    ]" 1 
        463 1  34 VAL QG   1 128 ALA MB   2.600     . 3.500 3.459 3.414 3.502 0.002  5 0 "[    .    1    ]" 1 
        464 1  34 VAL QG   1 129 CYS H    3.000     . 4.800 2.791 2.493 3.064     .  0 0 "[    .    1    ]" 1 
        465 1  34 VAL QG   1 129 CYS HB2  3.000     . 4.800 3.688 3.435 3.946     .  0 0 "[    .    1    ]" 1 
        466 1  34 VAL QG   1 131 ASP H    3.800     . 5.500 5.415 5.222 5.554 0.054  6 0 "[    .    1    ]" 1 
        467 1  34 VAL QG   1 136 LEU QD   2.200     . 2.800 1.789 1.522 2.245     .  0 0 "[    .    1    ]" 1 
        468 1  34 VAL N    1  68 GLY C    4.100 3.800 4.400 4.194 3.969 4.365     .  0 0 "[    .    1    ]" 1 
        469 1  34 VAL N    1  68 GLY O    3.000 2.800 3.200 3.174 2.846 3.217 0.017  9 0 "[    .    1    ]" 1 
        470 1  35 LYS H    1  35 LYS HB2  2.900     . 3.900 2.508 2.352 2.911     .  0 0 "[    .    1    ]" 1 
        471 1  35 LYS H    1  35 LYS HB3  3.200 2.100 4.300 3.654 3.553 3.761     .  0 0 "[    .    1    ]" 1 
        472 1  35 LYS H    1  35 LYS QD   3.400 2.200 4.600 3.934 3.672 4.126     .  0 0 "[    .    1    ]" 1 
        473 1  35 LYS H    1  35 LYS QG   3.400     . 5.500 3.145 2.312 3.483     .  0 0 "[    .    1    ]" 1 
        474 1  35 LYS H    1  36 TYR H    3.400     . 5.500 3.226 2.631 3.702     .  0 0 "[    .    1    ]" 1 
        475 1  35 LYS H    1  36 TYR HB2  3.600     . 5.500 5.087 4.594 5.523 0.023 12 0 "[    .    1    ]" 1 
        476 1  35 LYS H    1 127 LEU H    2.900     . 3.900 3.515 3.363 3.675     .  0 0 "[    .    1    ]" 1 
        477 1  35 LYS H    1 126 PHE QD   3.700     . 5.500 4.573 3.851 5.060     .  0 0 "[    .    1    ]" 1 
        478 1  35 LYS H    1 127 LEU H    3.200 2.100 4.300 3.726 3.487 4.047     .  0 0 "[    .    1    ]" 1 
        479 1  35 LYS H    1 127 LEU QD   3.800     . 5.500 4.574 3.286 5.155     .  0 0 "[    .    1    ]" 1 
        480 1  35 LYS H    1 128 ALA HA   3.100     . 4.200 3.648 3.194 3.885     .  0 0 "[    .    1    ]" 1 
        481 1  35 LYS H    1 129 CYS H    3.500     . 5.500 3.580 3.236 3.939     .  0 0 "[    .    1    ]" 1 
        482 1  35 LYS HA   1  35 LYS HD2  2.700     . 4.200 3.244 2.633 3.621     .  0 0 "[    .    1    ]" 1 
        483 1  35 LYS HA   1  35 LYS HD2  3.000     . 4.800 3.460 2.668 4.027     .  0 0 "[    .    1    ]" 1 
        484 1  35 LYS HA   1  35 LYS HD2  2.600     . 4.000 3.392 2.658 3.855     .  0 0 "[    .    1    ]" 1 
        485 1  35 LYS HA   1  35 LYS HB2  2.400     . 3.200 2.676 2.632 2.694     .  0 0 "[    .    1    ]" 1 
        486 1  35 LYS HA   1  35 LYS HB3  2.500     . 3.400 2.572 2.304 2.674     .  0 0 "[    .    1    ]" 1 
        487 1  35 LYS HA   1  35 LYS QG   2.700     . 3.600 2.293 2.118 2.725     .  0 0 "[    .    1    ]" 1 
        488 1  35 LYS HA   1  36 TYR H    2.300     . 3.100 2.557 2.342 2.793     .  0 0 "[    .    1    ]" 1 
        489 1  35 LYS HA   1  66 VAL H    3.600     . 5.500 3.291 2.456 4.282     .  0 0 "[    .    1    ]" 1 
        490 1  35 LYS HA   1  66 VAL HA   3.000     . 4.800 3.802 3.661 3.923     .  0 0 "[    .    1    ]" 1 
        491 1  35 LYS HB2  1  35 LYS QD   2.800     . 4.400 2.787 2.261 3.166     .  0 0 "[    .    1    ]" 1 
        492 1  35 LYS HB2  1  36 TYR H    3.300     . 5.500 4.289 4.167 4.448     .  0 0 "[    .    1    ]" 1 
        493 1  35 LYS HB2  1  37 LEU QD   2.700     . 4.200 3.056 2.683 3.399     .  0 0 "[    .    1    ]" 1 
        494 1  35 LYS HB2  1 127 LEU QD   2.600     . 4.000 3.084 2.158 3.857     .  0 0 "[    .    1    ]" 1 
        495 1  35 LYS HB2  1  65 PRO QG   2.400     . 4.500 4.153 3.726 4.515 0.015  8 0 "[    .    1    ]" 1 
        496 1  35 LYS HB2  1 127 LEU HG   3.300     . 5.500 4.130 2.775 4.985     .  0 0 "[    .    1    ]" 1 
        497 1  35 LYS HB2  1 128 ALA H    3.400 2.200 4.600 3.925 3.668 4.200     .  0 0 "[    .    1    ]" 1 
        498 1  35 LYS HB2  1 127 LEU H    3.300 2.100 4.500 4.142 3.682 4.507 0.007  7 0 "[    .    1    ]" 1 
        499 1  35 LYS HB2  1 129 CYS HB2  3.100     . 5.000 4.825 4.168 5.249 0.249  1 0 "[    .    1    ]" 1 
        500 1  35 LYS HB3  1  35 LYS QG   2.200     . 3.000 2.462 2.303 2.524     .  0 0 "[    .    1    ]" 1 
        501 1  35 LYS HB3  1  36 TYR H    3.400 2.200 4.600 4.310 4.167 4.367     .  0 0 "[    .    1    ]" 1 
        502 1  35 LYS HB3  1 127 LEU HG   2.100     . 4.500 4.427 4.117 4.681 0.181 12 0 "[    .    1    ]" 1 
        503 1  35 LYS HB3  1  66 VAL QG   2.800     . 4.400 4.153 3.821 4.353     .  0 0 "[    .    1    ]" 1 
        504 1  35 LYS HB3  1  66 VAL QG   2.400     . 3.200 2.800 2.382 3.010     .  0 0 "[    .    1    ]" 1 
        505 1  35 LYS HB3  1  68 GLY H    3.400     . 5.500 5.183 4.718 5.481     .  0 0 "[    .    1    ]" 1 
        506 1  35 LYS HB3  1 136 LEU QD   3.100     . 5.000 3.403 3.024 3.865     .  0 0 "[    .    1    ]" 1 
        507 1  35 LYS HB3  1 127 LEU HG   2.100     . 4.500 4.452 4.144 4.690 0.190 12 0 "[    .    1    ]" 1 
        508 1  35 LYS QD   1  67 ARG HG2  2.000     . 4.500 4.722 4.019 5.404 0.904  1 5 "[+  *.   *1 * -]" 1 
        509 1  35 LYS QD   1  37 LEU MD2  2.900     . 4.600 3.916 2.751 4.798 0.198  6 0 "[    .    1    ]" 1 
        510 1  35 LYS HD2  1  66 VAL HA   3.000     . 4.800 3.843 3.696 3.955     .  0 0 "[    .    1    ]" 1 
        511 1  35 LYS QG   1  67 ARG QG   2.700     . 4.200 3.528 2.551 4.210 0.010  1 0 "[    .    1    ]" 1 
        512 1  35 LYS QG   1 127 LEU QD   2.900     . 4.600 4.252 3.294 4.515     .  0 0 "[    .    1    ]" 1 
        513 1  35 LYS N    1 127 LEU C    4.100 3.800 4.400 4.140 3.903 4.388     .  0 0 "[    .    1    ]" 1 
        514 1  35 LYS N    1 127 LEU O    3.000 2.800 3.200 2.976 2.793 3.212 0.012  1 0 "[    .    1    ]" 1 
        515 1  36 TYR H    1  36 TYR HB2  2.700     . 3.600 2.377 2.072 2.842     .  0 0 "[    .    1    ]" 1 
        516 1  36 TYR H    1  36 TYR HB3  3.000     . 4.000 2.756 2.211 3.247     .  0 0 "[    .    1    ]" 1 
        517 1  36 TYR H    1  36 TYR QD   3.500     . 5.500 3.925 3.363 4.187     .  0 0 "[    .    1    ]" 1 
        518 1  36 TYR H    1  37 LEU QD   3.300     . 5.500 3.394 3.088 3.927     .  0 0 "[    .    1    ]" 1 
        519 1  36 TYR H    1  66 VAL H    3.000     . 4.000 3.469 2.569 3.991     .  0 0 "[    .    1    ]" 1 
        520 1  36 TYR H    1  66 VAL HB   3.100     . 5.000 4.752 4.380 5.020 0.020  7 0 "[    .    1    ]" 1 
        521 1  36 TYR H    1  66 VAL QG   3.300     . 5.500 2.177 1.892 2.392     .  0 0 "[    .    1    ]" 1 
        522 1  36 TYR H    1  68 GLY H    3.600     . 5.500 4.245 3.859 4.772     .  0 0 "[    .    1    ]" 1 
        523 1  36 TYR H    1 126 PHE QD   3.700     . 5.500 4.327 3.329 4.964     .  0 0 "[    .    1    ]" 1 
        524 1  36 TYR H    1 127 LEU H    3.700     . 5.500 3.805 3.492 4.181     .  0 0 "[    .    1    ]" 1 
        525 1  36 TYR HA   1  36 TYR QD   2.700     . 3.600 2.557 2.069 3.029     .  0 0 "[    .    1    ]" 1 
        526 1  36 TYR HA   1  37 LEU H    2.500     . 3.400 2.183 2.127 2.538     .  0 0 "[    .    1    ]" 1 
        527 1  36 TYR HA   1  37 LEU QD   2.800     . 4.400 3.398 2.944 4.159     .  0 0 "[    .    1    ]" 1 
        528 1  36 TYR HA   1 126 PHE HA   2.600     . 3.500 2.358 1.960 3.437     .  0 0 "[    .    1    ]" 1 
        529 1  36 TYR HA   1 127 LEU H    3.500     . 5.500 2.869 2.491 3.612     .  0 0 "[    .    1    ]" 1 
        530 1  36 TYR HB2  1  37 LEU H    3.300 2.100 4.500 3.539 2.130 4.233     .  0 0 "[    .    1    ]" 1 
        531 1  36 TYR HB2  1  66 VAL H    3.200     . 5.200 4.616 3.632 5.062     .  0 0 "[    .    1    ]" 1 
        532 1  36 TYR HB2  1  66 VAL QG   2.800     . 4.400 2.651 1.793 3.137     .  0 0 "[    .    1    ]" 1 
        533 1  36 TYR HB2  1 127 LEU H    2.900     . 3.900 3.558 2.570 4.250 0.350  1 0 "[    .    1    ]" 1 
        534 1  36 TYR HB3  1  37 LEU H    3.600     . 5.500 4.044 2.652 4.579     .  0 0 "[    .    1    ]" 1 
        535 1  36 TYR QD   1  37 LEU H    3.300 2.100 4.500 3.017 2.083 4.026 0.017 10 0 "[    .    1    ]" 1 
        536 1  36 TYR QD   1  66 VAL H    3.400     . 5.500 4.940 3.694 5.505 0.005  4 0 "[    .    1    ]" 1 
        537 1  36 TYR QD   1  66 VAL QG   2.700     . 4.200 2.867 2.024 3.459     .  0 0 "[    .    1    ]" 1 
        538 1  36 TYR QD   1  88 ILE MG   2.700     . 4.200 2.788 2.128 3.736     .  0 0 "[    .    1    ]" 1 
        539 1  36 TYR QE   1  37 LEU H    3.300     . 5.500 4.467 3.795 5.372     .  0 0 "[    .    1    ]" 1 
        540 1  36 TYR QE   1  38 GLY H    3.400     . 5.500 3.295 2.384 3.883     .  0 0 "[    .    1    ]" 1 
        541 1  36 TYR QE   1  39 CYS H    3.600     . 5.500 4.471 3.625 5.513 0.013  9 0 "[    .    1    ]" 1 
        542 1  36 TYR QE   1  79 VAL MG1  2.900     . 4.600 3.138 2.771 3.595     .  0 0 "[    .    1    ]" 1 
        543 1  36 TYR QE   1  88 ILE MD   2.900     . 4.600 3.918 2.792 4.626 0.026 14 0 "[    .    1    ]" 1 
        544 1  36 TYR QE   1  89 VAL QG   2.500     . 3.800 2.537 1.876 3.129     .  0 0 "[    .    1    ]" 1 
        545 1  36 TYR QE   1  89 VAL QG   2.500     . 3.400 2.127 1.811 2.454     .  0 0 "[    .    1    ]" 1 
        546 1  36 TYR QE   1 111 TYR H    3.400     . 5.500 3.839 3.644 4.093     .  0 0 "[    .    1    ]" 1 
        547 1  36 TYR QE   1 125 GLY H    3.100     . 4.200 3.323 2.327 4.204 0.004  6 0 "[    .    1    ]" 1 
        548 1  37 LEU H    1  37 LEU QB   2.800     . 3.800 2.289 2.084 2.778     .  0 0 "[    .    1    ]" 1 
        549 1  37 LEU H    1  37 LEU QD   3.100     . 4.200 2.465 1.995 3.535 0.005  9 0 "[    .    1    ]" 1 
        550 1  37 LEU H    1  37 LEU HG   3.000     . 4.000 3.596 2.096 4.061 0.061  6 0 "[    .    1    ]" 1 
        551 1  37 LEU H    1  38 GLY H    2.700     . 3.600 2.635 1.937 3.279     .  0 0 "[    .    1    ]" 1 
        552 1  37 LEU H    1 125 GLY H    3.300 2.100 4.500 4.175 3.854 4.427     .  0 0 "[    .    1    ]" 1 
        553 1  37 LEU H    1 126 PHE HA   3.000     . 4.000 2.439 1.987 3.211 0.013 12 0 "[    .    1    ]" 1 
        554 1  37 LEU H    1 126 PHE QD   3.600     . 5.500 4.784 4.163 5.284     .  0 0 "[    .    1    ]" 1 
        555 1  37 LEU H    1 127 LEU H    3.500     . 5.500 3.544 2.802 4.962     .  0 0 "[    .    1    ]" 1 
        556 1  37 LEU HA   1  37 LEU QD   2.100     . 2.800 2.309 2.064 2.498     .  0 0 "[    .    1    ]" 1 
        557 1  37 LEU HA   1  37 LEU QD   2.600     . 3.500 2.265 2.041 2.432     .  0 0 "[    .    1    ]" 1 
        558 1  37 LEU HA   1  37 LEU HG   2.500     . 3.400 2.647 2.317 3.012     .  0 0 "[    .    1    ]" 1 
        559 1  37 LEU HA   1  58 LEU QD   2.700     . 4.200 3.479 3.195 3.725     .  0 0 "[    .    1    ]" 1 
        560 1  37 LEU HA   1  64 ARG H    3.600     . 5.500 4.988 3.916 5.421     .  0 0 "[    .    1    ]" 1 
        561 1  37 LEU HA   1  65 PRO HA   2.600     . 3.500 1.928 1.893 1.967     .  0 0 "[    .    1    ]" 1 
        562 1  37 LEU HA   1  65 PRO QG   3.100     . 5.000 3.490 2.638 4.261     .  0 0 "[    .    1    ]" 1 
        563 1  37 LEU HA   1  66 VAL H    3.300     . 5.500 3.700 3.004 4.095     .  0 0 "[    .    1    ]" 1 
        564 1  37 LEU QB   1  37 LEU QD   2.200     . 3.000 1.915 1.818 1.954     .  0 0 "[    .    1    ]" 1 
        565 1  37 LEU QB   1 125 GLY H    3.800     . 5.500 3.648 3.329 3.941     .  0 0 "[    .    1    ]" 1 
        566 1  37 LEU QB   1  58 LEU QD   2.800     . 4.400 2.531 2.079 3.207     .  0 0 "[    .    1    ]" 1 
        567 1  37 LEU HB2  1  55 LEU HA   2.900     . 4.600 3.684 3.612 3.839     .  0 0 "[    .    1    ]" 1 
        568 1  37 LEU HB2  1  58 LEU QD   2.600     . 3.500 2.629 2.410 3.018     .  0 0 "[    .    1    ]" 1 
        569 1  37 LEU HB2  1 111 TYR H    3.300     . 5.500 5.074 4.707 5.374     .  0 0 "[    .    1    ]" 1 
        570 1  37 LEU HB3  1  66 VAL QG   2.400     . 4.500 3.069 2.863 3.205     .  0 0 "[    .    1    ]" 1 
        571 1  37 LEU MD1  1  59 ARG HG2  3.000     . 4.800 3.537 2.074 4.412     .  0 0 "[    .    1    ]" 1 
        572 1  37 LEU QD   1  55 LEU H    3.600     . 5.500 3.953 3.715 4.145     .  0 0 "[    .    1    ]" 1 
        573 1  37 LEU QD   1  55 LEU H    3.800     . 5.500 5.462 5.302 5.511 0.011  5 0 "[    .    1    ]" 1 
        574 1  37 LEU QD   1  55 LEU HB3  2.400     . 3.200 2.304 1.837 2.809     .  0 0 "[    .    1    ]" 1 
        575 1  37 LEU QD   1  55 LEU QD   2.300     . 3.100 2.165 1.816 2.796     .  0 0 "[    .    1    ]" 1 
        576 1  37 LEU QD   1  55 LEU HG   2.500     . 3.400 2.313 1.839 2.846     .  0 0 "[    .    1    ]" 1 
        577 1  37 LEU QD   1  58 LEU QB   2.400     . 3.200 1.982 1.636 2.566     .  0 0 "[    .    1    ]" 1 
        578 1  37 LEU QD   1  58 LEU QD   2.900     . 4.600 3.180 2.889 3.540     .  0 0 "[    .    1    ]" 1 
        579 1  37 LEU QD   1  59 ARG H    3.200     . 5.200 3.502 2.875 3.933     .  0 0 "[    .    1    ]" 1 
        580 1  37 LEU QD   1  59 ARG QB   2.700     . 3.600 3.171 2.716 3.564     .  0 0 "[    .    1    ]" 1 
        581 1  37 LEU QD   1  59 ARG QG   2.200     . 4.500 3.367 2.062 4.127     .  0 0 "[    .    1    ]" 1 
        582 1  37 LEU QD   1  64 ARG H    2.800     . 4.400 3.187 2.078 3.622     .  0 0 "[    .    1    ]" 1 
        583 1  37 LEU QD   1  65 PRO HA   2.600     . 4.000 3.039 1.867 3.519     .  0 0 "[    .    1    ]" 1 
        584 1  37 LEU QD   1  65 PRO HB2  2.200     . 3.000 2.441 1.848 3.263 0.263 12 0 "[    .    1    ]" 1 
        585 1  37 LEU QD   1  65 PRO HB3  2.200     . 3.000 2.317 1.686 2.801     .  0 0 "[    .    1    ]" 1 
        586 1  37 LEU QD   1  65 PRO HG3  2.400     . 3.200 2.754 1.781 3.178     .  0 0 "[    .    1    ]" 1 
        587 1  37 LEU QD   1  66 VAL H    3.200     . 5.200 4.030 3.345 4.448     .  0 0 "[    .    1    ]" 1 
        588 1  37 LEU QD   1 110 SER HA   3.100     . 5.000 4.137 3.569 4.654     .  0 0 "[    .    1    ]" 1 
        589 1  37 LEU QD   1 127 LEU HG   3.200     . 5.200 3.002 1.974 3.590     .  0 0 "[    .    1    ]" 1 
        590 1  37 LEU QD   1 125 GLY HA3  2.900     . 4.600 3.042 2.435 3.558     .  0 0 "[    .    1    ]" 1 
        591 1  37 LEU QD   1 126 PHE H    3.200 2.100 4.300 3.773 3.175 4.240     .  0 0 "[    .    1    ]" 1 
        592 1  37 LEU QD   1 127 LEU H    2.900     . 4.600 3.157 2.479 3.884     .  0 0 "[    .    1    ]" 1 
        593 1  37 LEU QD   1 127 LEU H    2.800     . 4.400 2.919 2.440 3.464     .  0 0 "[    .    1    ]" 1 
        594 1  37 LEU HG   1  64 ARG QB   2.900     . 4.600 4.386 4.127 4.491     .  0 0 "[    .    1    ]" 1 
        595 1  37 LEU HG   1  65 PRO HB3  2.700     . 3.600 2.998 2.329 3.679 0.079 10 0 "[    .    1    ]" 1 
        596 1  37 LEU N    1 125 GLY C    4.100 3.800 4.400 4.079 3.857 4.298     .  0 0 "[    .    1    ]" 1 
        597 1  37 LEU N    1 125 GLY O    3.000 2.800 3.200 2.979 2.784 3.197 0.016  8 0 "[    .    1    ]" 1 
        598 1  38 GLY H    1  38 GLY HA2  2.700     . 3.600 2.611 2.497 2.791     .  0 0 "[    .    1    ]" 1 
        599 1  38 GLY H    1  38 GLY HA3  2.900     . 3.900 2.926 2.826 2.956     .  0 0 "[    .    1    ]" 1 
        600 1  38 GLY H    1  39 CYS H    3.300 2.100 4.500 4.377 4.089 4.495     .  0 0 "[    .    1    ]" 1 
        601 1  38 GLY H    1 125 GLY H    3.800     . 5.500 3.617 2.938 4.445     .  0 0 "[    .    1    ]" 1 
        602 1  38 GLY H    1 125 GLY HA2  3.300     . 5.500 5.362 4.854 5.528 0.028  9 0 "[    .    1    ]" 1 
        603 1  38 GLY HA2  1  39 CYS H    2.300     . 3.100 2.840 2.451 3.172 0.072  6 0 "[    .    1    ]" 1 
        604 1  38 GLY HA2  1  63 ARG HE   3.800     . 5.500 4.667 2.879 5.519 0.019  6 0 "[    .    1    ]" 1 
        605 1  38 GLY HA2  1  88 ILE MG   3.300     . 5.500 3.010 2.233 3.591     .  0 0 "[    .    1    ]" 1 
        606 1  38 GLY HA3  1  39 CYS H    2.400     . 3.200 2.350 2.147 2.697     .  0 0 "[    .    1    ]" 1 
        607 1  38 GLY HA3  1  58 LEU QD   3.100     . 5.000 2.688 2.006 3.383     .  0 0 "[    .    1    ]" 1 
        608 1  38 GLY HA3  1 125 GLY H    3.500     . 5.500 4.719 4.193 5.327     .  0 0 "[    .    1    ]" 1 
        609 1  39 CYS H    1  39 CYS HA   2.700     . 3.600 2.929 2.827 2.947     .  0 0 "[    .    1    ]" 1 
        610 1  39 CYS H    1  39 CYS QB   3.100     . 4.200 2.708 2.085 3.057     .  0 0 "[    .    1    ]" 1 
        611 1  39 CYS H    1  39 CYS HB2  2.800     . 4.400 2.851 2.054 3.594     .  0 0 "[    .    1    ]" 1 
        612 1  39 CYS H    1  40 VAL H    3.500 2.300 4.700 4.421 3.967 4.525     .  0 0 "[    .    1    ]" 1 
        613 1  39 CYS H    1  40 VAL QG   3.400     . 5.500 4.239 3.358 5.192     .  0 0 "[    .    1    ]" 1 
        614 1  39 CYS H    1  58 LEU QD   2.800     . 3.800 3.000 2.205 3.720     .  0 0 "[    .    1    ]" 1 
        615 1  39 CYS H    1  64 ARG H    3.100     . 5.000 4.161 3.674 4.542     .  0 0 "[    .    1    ]" 1 
        616 1  39 CYS H    1  88 ILE HB   3.600     . 5.500 4.920 4.677 5.404     .  0 0 "[    .    1    ]" 1 
        617 1  39 CYS HA   1  40 VAL H    2.300     . 3.100 2.229 2.140 2.326     .  0 0 "[    .    1    ]" 1 
        618 1  39 CYS HA   1  40 VAL QG   3.000     . 4.800 3.476 3.089 4.276     .  0 0 "[    .    1    ]" 1 
        619 1  39 CYS HA   1  58 LEU QD   2.900     . 4.600 2.681 2.267 3.042     .  0 0 "[    .    1    ]" 1 
        620 1  39 CYS HA   1 125 GLY H    3.100     . 4.200 3.428 2.866 3.895     .  0 0 "[    .    1    ]" 1 
        621 1  39 CYS QB   1  40 VAL H    3.000     . 4.800 2.843 2.575 3.244     .  0 0 "[    .    1    ]" 1 
        622 1  39 CYS QB   1  40 VAL QG   2.500     . 3.800 2.164 1.855 2.577     .  0 0 "[    .    1    ]" 1 
        623 1  39 CYS QB   1  58 LEU QD   2.400     . 3.600 1.849 1.748 2.140     .  0 0 "[    .    1    ]" 1 
        624 1  39 CYS HB2  1  40 VAL H    2.600     . 3.500 3.317 2.616 3.925 0.425 13 0 "[    .    1    ]" 1 
        625 1  39 CYS HB2  1  40 VAL QG   2.600     . 4.500 2.171 1.856 2.591     .  0 0 "[    .    1    ]" 1 
        626 1  39 CYS HB2  1  54 ALA MB   2.700     . 4.500 4.358 4.175 4.507 0.007 14 0 "[    .    1    ]" 1 
        627 1  39 CYS HB2  1 125 GLY H    3.100     . 5.000 5.182 4.886 5.587 0.587  1 1 "[+   .    1    ]" 1 
        628 1  39 CYS HB2  1 118 THR MG   2.600     . 4.500 4.077 3.345 4.477     .  0 0 "[    .    1    ]" 1 
        629 1  39 CYS HB2  1 112 ILE MG   3.000     . 4.800 4.740 4.519 4.963 0.163  3 0 "[    .    1    ]" 1 
        630 1  39 CYS HB2  1 122 MET ME   2.500     . 3.400 2.906 2.019 3.965 0.565 11 1 "[    .    1+   ]" 1 
        631 1  39 CYS HB3  1 122 MET ME   2.400     . 3.600 2.315 1.862 3.071     .  0 0 "[    .    1    ]" 1 
        632 1  40 VAL C    1 123 CYS N    4.100 3.800 4.400 3.890 3.787 4.108 0.013 13 0 "[    .    1    ]" 1 
        633 1  40 VAL H    1  40 VAL HA   2.700     . 3.600 2.934 2.902 2.950     .  0 0 "[    .    1    ]" 1 
        634 1  40 VAL H    1  40 VAL HA   2.600     . 3.500 2.239 2.101 2.415     .  0 0 "[    .    1    ]" 1 
        635 1  40 VAL H    1  40 VAL HB   3.300     . 5.500 3.476 2.635 3.937     .  0 0 "[    .    1    ]" 1 
        636 1  40 VAL H    1  40 VAL QG   2.800     . 3.500 2.262 1.876 2.952     .  0 0 "[    .    1    ]" 1 
        637 1  40 VAL H    1  40 VAL QG   2.400     . 3.200 1.989 1.865 2.321     .  0 0 "[    .    1    ]" 1 
        638 1  40 VAL H    1  40 VAL QG   2.600     . 4.000 2.250 1.873 2.919     .  0 0 "[    .    1    ]" 1 
        639 1  40 VAL H    1 122 MET ME   2.700     . 4.200 2.568 2.117 3.016     .  0 0 "[    .    1    ]" 1 
        640 1  40 VAL H    1  54 ALA MB   3.300     . 5.500 4.740 4.091 5.359     .  0 0 "[    .    1    ]" 1 
        641 1  40 VAL H    1  58 LEU QD   3.000     . 4.400 2.904 2.304 3.335     .  0 0 "[    .    1    ]" 1 
        642 1  40 VAL H    1 122 MET HA   3.500     . 5.500 4.348 3.912 5.079     .  0 0 "[    .    1    ]" 1 
        643 1  40 VAL H    1 122 MET ME   3.400 2.200 4.600 3.117 2.726 3.508     .  0 0 "[    .    1    ]" 1 
        644 1  40 VAL H    1 123 CYS H    3.000     . 4.000 3.063 2.437 3.645     .  0 0 "[    .    1    ]" 1 
        645 1  40 VAL H    1 124 HIS HA   3.300     . 5.500 3.709 3.261 4.044     .  0 0 "[    .    1    ]" 1 
        646 1  40 VAL H    1 125 GLY H    3.700     . 5.500 4.569 3.930 5.532 0.032  1 0 "[    .    1    ]" 1 
        647 1  40 VAL HA   1  40 VAL HB   2.300     . 3.100 2.593 2.463 2.780     .  0 0 "[    .    1    ]" 1 
        648 1  40 VAL HA   1  40 VAL QG   2.200     . 3.000 2.149 1.912 2.267     .  0 0 "[    .    1    ]" 1 
        649 1  40 VAL HA   1  40 VAL QG   2.300     . 3.100 2.145 1.910 2.257     .  0 0 "[    .    1    ]" 1 
        650 1  40 VAL HA   1  41 GLU H    2.200     . 3.000 2.332 2.153 2.569     .  0 0 "[    .    1    ]" 1 
        651 1  40 VAL HA   1  41 GLU HA   2.800     . 4.400 4.354 4.331 4.391     .  0 0 "[    .    1    ]" 1 
        652 1  40 VAL HA   1  41 GLU HA   2.600     . 4.000 3.914 3.888 3.947     .  0 0 "[    .    1    ]" 1 
        653 1  40 VAL HA   1 123 CYS H    3.700     . 5.500 4.527 4.301 4.647     .  0 0 "[    .    1    ]" 1 
        654 1  40 VAL HA   1  58 LEU QD   2.900     . 4.600 3.576 3.180 3.880     .  0 0 "[    .    1    ]" 1 
        655 1  40 VAL HA   1  63 ARG QG   2.600     . 4.000 3.938 3.695 4.093 0.093  3 0 "[    .    1    ]" 1 
        656 1  40 VAL HA   1 122 MET ME   2.600     . 3.500 2.860 2.424 3.171     .  0 0 "[    .    1    ]" 1 
        657 1  40 VAL HB   1  40 VAL QG   2.100     . 2.800 1.877 1.859 1.896     .  0 0 "[    .    1    ]" 1 
        658 1  40 VAL HB   1  40 VAL QG   1.800     . 2.400 1.754 1.740 1.762     .  0 0 "[    .    1    ]" 1 
        659 1  40 VAL HB   1  40 VAL QG   1.900     . 2.600 1.609 1.601 1.614     .  0 0 "[    .    1    ]" 1 
        660 1  40 VAL HB   1  41 GLU H    2.900     . 3.900 3.205 2.147 3.932 0.032  4 0 "[    .    1    ]" 1 
        661 1  40 VAL HB   1  54 ALA MB   2.900     . 4.600 3.905 3.699 4.097     .  0 0 "[    .    1    ]" 1 
        662 1  40 VAL HB   1  57 VAL MG2  2.600     . 3.500 3.152 2.942 3.559 0.059 12 0 "[    .    1    ]" 1 
        663 1  40 VAL HB   1  58 LEU H    2.200     . 4.500 4.364 3.863 4.543 0.043 12 0 "[    .    1    ]" 1 
        664 1  40 VAL HB   1  57 VAL MG1  2.000     . 2.700 1.847 1.792 1.870     .  0 0 "[    .    1    ]" 1 
        665 1  40 VAL HB   1  58 LEU QD   2.500     . 4.500 3.047 1.714 3.890     .  0 0 "[    .    1    ]" 1 
        666 1  40 VAL HB   1 122 MET ME   2.700     . 4.500 3.831 2.722 4.093     .  0 0 "[    .    1    ]" 1 
        667 1  40 VAL HB   1 122 MET ME   3.000     . 4.800 4.489 4.232 4.833 0.033 11 0 "[    .    1    ]" 1 
        668 1  40 VAL QG   1  41 GLU H    3.000     . 4.800 2.882 1.924 3.392     .  0 0 "[    .    1    ]" 1 
        669 1  40 VAL QG   1  41 GLU H    2.600     . 4.000 2.925 1.927 3.499     .  0 0 "[    .    1    ]" 1 
        670 1  40 VAL QG   1  57 VAL HB   3.100     . 5.000 2.089 1.844 2.462     .  0 0 "[    .    1    ]" 1 
        671 1  40 VAL MG1  1  40 VAL MG2  1.800     . 2.400 1.978 1.849 2.085     .  0 0 "[    .    1    ]" 1 
        672 1  40 VAL QG   1  56 LYS QG   3.000     . 4.800 4.241 3.533 4.643     .  0 0 "[    .    1    ]" 1 
        673 1  40 VAL QG   1  57 VAL MG2  2.600     . 3.500 2.899 2.575 3.220     .  0 0 "[    .    1    ]" 1 
        674 1  40 VAL QG   1 124 HIS H    3.500     . 5.500 3.956 3.513 4.292     .  0 0 "[    .    1    ]" 1 
        675 1  40 VAL QG   1  57 VAL H    3.400     . 5.500 3.915 3.574 4.209     .  0 0 "[    .    1    ]" 1 
        676 1  40 VAL QG   1  42 VAL QG   2.800     . 4.400 2.355 1.696 2.638     .  0 0 "[    .    1    ]" 1 
        677 1  40 VAL QG   1 122 MET ME   2.900     . 4.600 3.345 3.222 3.444     .  0 0 "[    .    1    ]" 1 
        678 1  40 VAL QG   1 123 CYS H    3.000     . 4.800 3.065 2.722 3.423     .  0 0 "[    .    1    ]" 1 
        679 1  40 VAL QG   1  51 CYS HA   2.800     . 4.500 4.439 3.989 4.538 0.038  4 0 "[    .    1    ]" 1 
        680 1  40 VAL QG   1  54 ALA HA   2.700     . 3.600 2.849 2.426 3.222     .  0 0 "[    .    1    ]" 1 
        681 1  40 VAL QG   1  54 ALA MB   2.100     . 2.800 2.617 2.261 2.804 0.004  8 0 "[    .    1    ]" 1 
        682 1  40 VAL QG   1  57 VAL H    3.100     . 4.200 3.437 3.324 3.552     .  0 0 "[    .    1    ]" 1 
        683 1  40 VAL QG   1  57 VAL HB   2.700     . 3.600 2.222 1.903 2.610     .  0 0 "[    .    1    ]" 1 
        684 1  40 VAL MG1  1  40 VAL MG2  1.600     . 2.200 1.907 1.674 2.071     .  0 0 "[    .    1    ]" 1 
        685 1  40 VAL QG   1  58 LEU H    2.900     . 3.900 2.914 2.388 3.407     .  0 0 "[    .    1    ]" 1 
        686 1  40 VAL QG   1  58 LEU HA   2.900     . 4.600 2.423 1.809 3.049     .  0 0 "[    .    1    ]" 1 
        687 1  40 VAL QG   1  58 LEU QD   2.300     . 3.100 1.645 1.449 1.948 0.051  2 0 "[    .    1    ]" 1 
        688 1  40 VAL QG   1  63 ARG QG   2.900     . 4.600 2.172 1.855 2.598     .  0 0 "[    .    1    ]" 1 
        689 1  40 VAL QG   1  57 VAL MG2  2.400     . 3.600 2.859 2.631 3.100     .  0 0 "[    .    1    ]" 1 
        690 1  40 VAL QG   1  58 LEU H    2.800     . 4.400 2.832 2.126 3.166     .  0 0 "[    .    1    ]" 1 
        691 1  40 VAL QG   1  58 LEU H    3.000     . 4.800 3.027 2.486 3.595     .  0 0 "[    .    1    ]" 1 
        692 1  40 VAL QG   1  58 LEU QD   2.300     . 3.000 1.650 1.450 1.968 0.150  2 0 "[    .    1    ]" 1 
        693 1  40 VAL QG   1  63 ARG QG   2.400     . 3.200 2.177 1.857 2.610     .  0 0 "[    .    1    ]" 1 
        694 1  40 VAL QG   1 122 MET ME   2.600     . 4.000 3.597 3.370 3.735     .  0 0 "[    .    1    ]" 1 
        695 1  40 VAL N    1 123 CYS C    4.100 3.800 4.400 3.986 3.896 4.162     .  0 0 "[    .    1    ]" 1 
        696 1  40 VAL N    1 123 CYS O    3.000 2.800 3.200 3.028 2.791 3.211 0.011  3 0 "[    .    1    ]" 1 
        697 1  40 VAL O    1 123 CYS N    3.000 2.800 3.200 2.824 2.775 2.958 0.025 13 0 "[    .    1    ]" 1 
        698 1  41 GLU H    1  41 GLU HA   3.000     . 4.000 2.873 2.788 2.943     .  0 0 "[    .    1    ]" 1 
        699 1  41 GLU H    1  41 GLU HB2  2.400     . 3.200 2.646 2.121 3.161     .  0 0 "[    .    1    ]" 1 
        700 1  41 GLU H    1  42 VAL H    3.300     . 5.500 4.560 4.488 4.644     .  0 0 "[    .    1    ]" 1 
        701 1  41 GLU HA   1  42 VAL H    2.400     . 3.200 2.215 2.145 2.326     .  0 0 "[    .    1    ]" 1 
        702 1  41 GLU HA   1 120 ARG QB   2.800     . 4.400 4.088 3.312 4.405 0.005  2 0 "[    .    1    ]" 1 
        703 1  41 GLU HA   1 122 MET HA   2.900     . 4.600 2.573 1.947 2.822     .  0 0 "[    .    1    ]" 1 
        704 1  41 GLU HA   1 122 MET ME   2.600     . 3.500 2.180 1.916 2.373     .  0 0 "[    .    1    ]" 1 
        705 1  41 GLU HA   1 123 CYS H    3.300     . 5.500 3.447 2.924 3.907     .  0 0 "[    .    1    ]" 1 
        706 1  41 GLU QB   1  42 VAL H    2.900     . 3.900 3.001 2.579 3.457     .  0 0 "[    .    1    ]" 1 
        707 1  41 GLU QB   1  42 VAL HB   2.500     . 4.500 4.255 3.823 4.601 0.101 13 0 "[    .    1    ]" 1 
        708 1  41 GLU QB   1  42 VAL QG   2.800     . 4.400 3.828 3.468 3.983     .  0 0 "[    .    1    ]" 1 
        709 1  41 GLU QB   1 120 ARG QG   1.800     . 4.500 3.274 2.790 4.014     .  0 0 "[    .    1    ]" 1 
        710 1  41 GLU QB   1 122 MET ME   2.200     . 3.200 2.588 2.132 3.209 0.009  8 0 "[    .    1    ]" 1 
        711 1  42 VAL H    1  42 VAL HA   2.400     . 3.200 2.923 2.882 2.949     .  0 0 "[    .    1    ]" 1 
        712 1  42 VAL H    1  42 VAL HB   3.600     . 5.500 3.819 3.723 3.914     .  0 0 "[    .    1    ]" 1 
        713 1  42 VAL H    1  42 VAL QG   3.200 2.100 3.200 2.299 2.117 2.492     .  0 0 "[    .    1    ]" 1 
        714 1  42 VAL H    1 122 MET H    3.800     . 5.500 4.536 4.375 4.785     .  0 0 "[    .    1    ]" 1 
        715 1  42 VAL H    1 120 ARG QD   3.500     . 5.500 3.014 2.377 3.567     .  0 0 "[    .    1    ]" 1 
        716 1  42 VAL H    1 121 TRP H    2.700     . 4.500 4.535 4.507 4.566 0.066  4 0 "[    .    1    ]" 1 
        717 1  42 VAL H    1 122 MET H    3.700     . 5.500 3.807 3.518 4.165     .  0 0 "[    .    1    ]" 1 
        718 1  42 VAL H    1 122 MET HA   3.200 2.100 4.300 3.329 2.905 3.806     .  0 0 "[    .    1    ]" 1 
        719 1  42 VAL H    1 122 MET ME   3.000     . 4.800 3.952 3.625 4.222     .  0 0 "[    .    1    ]" 1 
        720 1  42 VAL HA   1  42 VAL HB   2.400     . 3.200 2.505 2.439 2.585     .  0 0 "[    .    1    ]" 1 
        721 1  42 VAL HA   1  42 VAL QG   2.300     . 3.100 2.197 2.103 2.272     .  0 0 "[    .    1    ]" 1 
        722 1  42 VAL HA   1  43 PHE H    2.600     . 3.500 2.526 2.406 2.660     .  0 0 "[    .    1    ]" 1 
        723 1  42 VAL HA   1  43 PHE QR   2.700     . 4.200 3.685 2.832 4.202 0.002  1 0 "[    .    1    ]" 1 
        724 1  42 VAL HA   1  44 GLU H    3.200 2.100 4.300 4.204 4.013 4.369 0.069 13 0 "[    .    1    ]" 1 
        725 1  42 VAL HA   1  50 VAL MG1  2.400     . 4.500 3.971 3.816 4.163     .  0 0 "[    .    1    ]" 1 
        726 1  42 VAL HB   1  42 VAL QG   2.200     . 3.000 1.885 1.870 1.895     .  0 0 "[    .    1    ]" 1 
        727 1  42 VAL HB   1  43 PHE H    2.600     . 3.500 2.135 1.928 2.375     .  0 0 "[    .    1    ]" 1 
        728 1  42 VAL HB   1  44 GLU H    2.500     . 3.400 2.528 2.315 2.848     .  0 0 "[    .    1    ]" 1 
        729 1  42 VAL HB   1  45 SER H    2.800     . 4.400 3.792 3.058 4.304     .  0 0 "[    .    1    ]" 1 
        730 1  42 VAL HB   1  50 VAL MG2  2.400     . 3.200 2.988 1.894 3.230 0.030 11 0 "[    .    1    ]" 1 
        731 1  42 VAL HB   1 112 ILE MG   3.000     . 4.800 4.731 4.265 4.861 0.061  3 0 "[    .    1    ]" 1 
        732 1  42 VAL HB   1  50 VAL MG1  2.200     . 3.000 2.610 2.210 3.018 0.018 13 0 "[    .    1    ]" 1 
        733 1  42 VAL QG   1  43 PHE H    3.200     . 5.200 3.014 2.802 3.166     .  0 0 "[    .    1    ]" 1 
        734 1  42 VAL QG   1  43 PHE H    3.200 2.100 4.300 2.905 2.718 3.047     .  0 0 "[    .    1    ]" 1 
        735 1  42 VAL QG   1  43 PHE HA   2.900     . 4.600 3.975 3.527 4.261     .  0 0 "[    .    1    ]" 1 
        736 1  42 VAL QG   1  44 GLU H    2.700     . 3.600 2.486 2.023 2.870     .  0 0 "[    .    1    ]" 1 
        737 1  42 VAL QG   1  44 GLU H    2.700     . 3.600 2.348 2.009 2.625     .  0 0 "[    .    1    ]" 1 
        738 1  42 VAL QG   1  46 ARG H    3.200 2.100 4.300 3.551 3.087 3.909     .  0 0 "[    .    1    ]" 1 
        739 1  42 VAL MG1  1  42 VAL MG2  2.000     . 2.700 1.944 1.825 2.033     .  0 0 "[    .    1    ]" 1 
        740 1  42 VAL QG   1  51 CYS HA   2.600     . 4.000 3.529 3.266 3.720     .  0 0 "[    .    1    ]" 1 
        741 1  42 VAL QG   1  54 ALA H    3.200 2.100 4.300 3.483 3.251 3.695     .  0 0 "[    .    1    ]" 1 
        742 1  42 VAL QG   1  54 ALA MB   1.900     . 2.600 2.289 2.032 2.521     .  0 0 "[    .    1    ]" 1 
        743 1  42 VAL QG   1 111 TYR H    3.400     . 5.500 4.635 4.280 4.911     .  0 0 "[    .    1    ]" 1 
        744 1  42 VAL QG   1  50 VAL MG1  1.700     . 2.300 1.721 1.656 1.789     .  0 0 "[    .    1    ]" 1 
        745 1  42 VAL QG   1 112 ILE MG   2.600     . 3.500 2.770 2.351 2.891     .  0 0 "[    .    1    ]" 1 
        746 1  42 VAL QG   1  53 GLU QG   2.700     . 4.200 3.655 3.092 4.123     .  0 0 "[    .    1    ]" 1 
        747 1  42 VAL QG   1  54 ALA MB   2.200     . 3.000 2.525 2.111 2.929     .  0 0 "[    .    1    ]" 1 
        748 1  42 VAL QG   1  54 ALA MB   2.800     . 4.400 2.517 2.111 2.906     .  0 0 "[    .    1    ]" 1 
        749 1  42 VAL QG   1 125 GLY H    3.200     . 5.200 4.333 3.519 4.760     .  0 0 "[    .    1    ]" 1 
        750 1  42 VAL QG   1 111 TYR H    3.700     . 5.500 5.046 4.955 5.164     .  0 0 "[    .    1    ]" 1 
        751 1  42 VAL QG   1 113 CYS H    2.900     . 4.600 4.236 3.826 4.457     .  0 0 "[    .    1    ]" 1 
        752 1  42 VAL QG   1 124 HIS H    3.700     . 5.500 4.580 4.395 4.797     .  0 0 "[    .    1    ]" 1 
        753 1  42 VAL QG   1 112 ILE MG   2.400     . 3.200 3.066 2.960 3.121     .  0 0 "[    .    1    ]" 1 
        754 1  42 VAL QG   1 120 ARG QD   2.800     . 4.400 3.995 3.675 4.264     .  0 0 "[    .    1    ]" 1 
        755 1  42 VAL QG   1 121 TRP H    3.400 2.200 4.600 4.391 4.228 4.557     .  0 0 "[    .    1    ]" 1 
        756 1  42 VAL QG   1 121 TRP QB   2.600     . 3.500 1.970 1.791 2.159     .  0 0 "[    .    1    ]" 1 
        757 1  42 VAL QG   1 122 MET H    3.400     . 5.500 4.033 3.466 4.296     .  0 0 "[    .    1    ]" 1 
        758 1  42 VAL QG   1 123 CYS H    3.000     . 4.000 2.540 2.154 2.767     .  0 0 "[    .    1    ]" 1 
        759 1  42 VAL QG   1 123 CYS HA   3.000     . 4.800 3.440 3.102 3.711     .  0 0 "[    .    1    ]" 1 
        760 1  42 VAL QG   1 123 CYS HB2  2.700     . 3.600 2.120 1.842 2.601     .  0 0 "[    .    1    ]" 1 
        761 1  42 VAL QG   1 123 CYS QB   3.100     . 5.000 2.091 1.821 2.549     .  0 0 "[    .    1    ]" 1 
        762 1  43 PHE H    1  43 PHE HB2  3.000     . 4.000 2.438 2.188 2.767     .  0 0 "[    .    1    ]" 1 
        763 1  43 PHE H    1  43 PHE HB3  3.000     . 4.800 3.587 3.343 3.852     .  0 0 "[    .    1    ]" 1 
        764 1  43 PHE H    1  43 PHE QD   3.100     . 4.200 3.183 2.353 3.781     .  0 0 "[    .    1    ]" 1 
        765 1  43 PHE H    1  44 GLU H    2.400     . 3.200 2.416 2.077 2.722     .  0 0 "[    .    1    ]" 1 
        766 1  43 PHE HA   1  43 PHE HB2  2.700     . 4.200 2.988 2.906 3.028     .  0 0 "[    .    1    ]" 1 
        767 1  43 PHE HA   1  43 PHE HB3  2.600     . 3.500 2.591 2.396 2.790     .  0 0 "[    .    1    ]" 1 
        768 1  43 PHE HA   1  43 PHE QD   2.400     . 3.200 2.492 1.939 3.068     .  0 0 "[    .    1    ]" 1 
        769 1  43 PHE HA   1  44 GLU H    3.000     . 4.000 3.189 2.967 3.454     .  0 0 "[    .    1    ]" 1 
        770 1  43 PHE HA   1 121 TRP HD1  2.700     . 3.600 2.706 1.928 3.607 0.007  4 0 "[    .    1    ]" 1 
        771 1  43 PHE HB2  1  44 GLU H    3.200     . 5.200 3.735 3.031 4.175     .  0 0 "[    .    1    ]" 1 
        772 1  43 PHE HB3  1  44 GLU H    3.400     . 5.500 4.178 3.776 4.493     .  0 0 "[    .    1    ]" 1 
        773 1  43 PHE QR   1 120 ARG HE   3.000     . 4.500 4.322 3.546 4.524 0.024  9 0 "[    .    1    ]" 1 
        774 1  44 GLU H    1  44 GLU HA   2.600     . 3.500 2.911 2.844 2.952     .  0 0 "[    .    1    ]" 1 
        775 1  44 GLU H    1  44 GLU HB2  2.600     . 3.500 2.767 2.572 2.978     .  0 0 "[    .    1    ]" 1 
        776 1  44 GLU H    1  44 GLU HB3  3.100     . 4.200 3.766 3.592 3.934     .  0 0 "[    .    1    ]" 1 
        777 1  44 GLU H    1  45 SER H    3.300 2.100 4.500 3.773 2.499 4.474     .  0 0 "[    .    1    ]" 1 
        778 1  44 GLU H    1  46 ARG H    3.400 2.200 4.600 4.445 3.571 4.664 0.064  7 0 "[    .    1    ]" 1 
        779 1  44 GLU H    1  46 ARG H    3.400     . 5.500 3.531 2.767 4.363     .  0 0 "[    .    1    ]" 1 
        780 1  44 GLU H    1  47 GLY H    3.600     . 5.500 5.396 5.110 5.523 0.023  7 0 "[    .    1    ]" 1 
        781 1  44 GLU H    1  50 VAL MG2  2.700     . 4.200 3.987 3.294 4.222 0.022  1 0 "[    .    1    ]" 1 
        782 1  44 GLU HA   1  45 SER H    2.100     . 2.800 2.218 2.041 2.633     .  0 0 "[    .    1    ]" 1 
        783 1  44 GLU HA   1  46 ARG H    3.300 2.100 4.500 3.509 3.229 3.881     .  0 0 "[    .    1    ]" 1 
        784 1  44 GLU HA   1 121 TRP HE1  3.200     . 5.200 4.513 3.231 5.231 0.031  9 0 "[    .    1    ]" 1 
        785 1  44 GLU HB2  1  45 SER H    2.900     . 4.600 3.633 1.955 4.430     .  0 0 "[    .    1    ]" 1 
        786 1  44 GLU HB2  1  46 ARG H    2.900     . 3.900 3.792 2.624 3.971 0.071  4 0 "[    .    1    ]" 1 
        787 1  44 GLU HB2  1  50 VAL MG1  2.300     . 3.100 2.656 2.136 2.987     .  0 0 "[    .    1    ]" 1 
        788 1  44 GLU HB2  1  50 VAL MG1  2.300     . 3.400 2.647 2.135 2.975     .  0 0 "[    .    1    ]" 1 
        789 1  44 GLU HB2  1  50 VAL MG1  2.300     . 3.100 2.712 2.143 3.075     .  0 0 "[    .    1    ]" 1 
        790 1  44 GLU HB2  1  50 VAL MG2  2.300     . 3.100 2.030 1.839 2.352     .  0 0 "[    .    1    ]" 1 
        791 1  44 GLU HB3  1  45 SER H    2.700     . 3.600 2.983 2.121 3.592     .  0 0 "[    .    1    ]" 1 
        792 1  44 GLU HB3  1  46 ARG H    2.500     . 3.400 2.489 2.215 3.006     .  0 0 "[    .    1    ]" 1 
        793 1  44 GLU QG   1  46 ARG H    3.200 2.100 4.300 4.282 4.072 4.368 0.068 13 0 "[    .    1    ]" 1 
        794 1  45 SER H    1  45 SER HA   3.000     . 4.000 2.744 2.273 2.941     .  0 0 "[    .    1    ]" 1 
        795 1  45 SER H    1  45 SER QB   3.000     . 3.600 2.903 2.211 3.284     .  0 0 "[    .    1    ]" 1 
        796 1  45 SER H    1  46 ARG H    2.500     . 3.400 2.544 2.187 2.769     .  0 0 "[    .    1    ]" 1 
        797 1  45 SER H    1  50 VAL QG   3.500     . 5.500 3.781 2.167 4.677     .  0 0 "[    .    1    ]" 1 
        798 1  45 SER HA   1  45 SER QB   2.500     . 3.400 2.316 2.172 2.541     .  0 0 "[    .    1    ]" 1 
        799 1  45 SER HA   1  46 ARG H    3.000     . 4.000 3.006 2.939 3.057     .  0 0 "[    .    1    ]" 1 
        800 1  45 SER HA   1  50 VAL MG1  2.800     . 4.400 3.104 2.492 3.423     .  0 0 "[    .    1    ]" 1 
        801 1  45 SER HA   1 112 ILE MD   3.000     . 4.800 3.118 1.925 3.959     .  0 0 "[    .    1    ]" 1 
        802 1  45 SER HA   1 112 ILE MD   2.900     . 4.600 3.182 1.926 4.085     .  0 0 "[    .    1    ]" 1 
        803 1  45 SER HA   1 112 ILE MG   2.400     . 3.200 2.545 1.926 3.003     .  0 0 "[    .    1    ]" 1 
        804 1  45 SER QB   1  46 ARG H    3.700     . 5.500 3.883 3.682 4.037     .  0 0 "[    .    1    ]" 1 
        805 1  45 SER QB   1  46 ARG H    2.600     . 3.500 3.168 2.794 3.554 0.054  2 0 "[    .    1    ]" 1 
        806 1  45 SER QB   1  97 SER H    3.400     . 5.500 5.111 4.406 5.352     .  0 0 "[    .    1    ]" 1 
        807 1  45 SER QB   1 112 ILE MG   2.800     . 4.400 3.685 3.092 3.966     .  0 0 "[    .    1    ]" 1 
        808 1  45 SER QB   1 113 CYS H    3.600     . 5.500 3.697 3.010 4.198     .  0 0 "[    .    1    ]" 1 
        809 1  45 SER QB   1 114 ARG H    3.400 2.200 4.600 3.893 2.966 4.305     .  0 0 "[    .    1    ]" 1 
        810 1  45 SER QB   1 115 ASP H    3.200     . 5.200 4.617 4.119 4.958     .  0 0 "[    .    1    ]" 1 
        811 1  45 SER QB   1 121 TRP HB3  3.000     . 4.800 2.303 1.910 3.897     .  0 0 "[    .    1    ]" 1 
        812 1  45 SER QB   1 121 TRP HE1  3.300     . 5.500 5.078 3.098 5.482     .  0 0 "[    .    1    ]" 1 
        813 1  46 ARG H    1  46 ARG HA   2.700     . 3.600 2.907 2.850 2.935     .  0 0 "[    .    1    ]" 1 
        814 1  46 ARG H    1  46 ARG HB2  3.000     . 4.000 3.357 2.838 3.853     .  0 0 "[    .    1    ]" 1 
        815 1  46 ARG H    1  46 ARG QG   3.100     . 4.200 3.278 2.059 4.272 0.072  6 0 "[    .    1    ]" 1 
        816 1  46 ARG H    1  47 GLY H    3.300     . 5.500 3.193 2.035 4.415     .  0 0 "[    .    1    ]" 1 
        817 1  46 ARG H    1  50 VAL QG   3.200 2.100 4.300 3.296 2.712 3.561     .  0 0 "[    .    1    ]" 1 
        818 1  46 ARG H    1 112 ILE MD   3.100     . 5.000 3.687 3.115 4.284     .  0 0 "[    .    1    ]" 1 
        819 1  46 ARG HA   1  47 GLY H    2.400     . 3.200 2.616 2.139 3.032     .  0 0 "[    .    1    ]" 1 
        820 1  46 ARG HA   1 112 ILE MD   2.500     . 3.400 2.607 2.004 3.200     .  0 0 "[    .    1    ]" 1 
        821 1  46 ARG HB2  1  46 ARG HE   3.300     . 5.500 3.291 2.188 4.539     .  0 0 "[    .    1    ]" 1 
        822 1  46 ARG HB2  1  46 ARG QG   2.500     . 3.400 2.359 2.138 2.523     .  0 0 "[    .    1    ]" 1 
        823 1  46 ARG HB2  1  47 GLY H    3.100     . 5.000 3.959 2.305 4.491     .  0 0 "[    .    1    ]" 1 
        824 1  46 ARG HB3  1  46 ARG HE   3.100     . 4.200 3.673 2.230 4.808 0.608  5 1 "[    +    1    ]" 1 
        825 1  46 ARG HB3  1  47 GLY H    3.100     . 4.200 4.124 2.426 4.655 0.455 12 0 "[    .    1    ]" 1 
        826 1  46 ARG QD   1  46 ARG HE   3.000     . 4.000 2.385 2.196 2.490     .  0 0 "[    .    1    ]" 1 
        827 1  46 ARG HG3  1 114 ARG QD   2.700     . 4.200 3.666 2.804 4.127     .  0 0 "[    .    1    ]" 1 
        828 1  46 ARG HG3  1 121 TRP HB3  3.300     . 5.500 3.533 2.946 4.256     .  0 0 "[    .    1    ]" 1 
        829 1  47 GLY H    1  47 GLY HA3  2.900     . 3.900 2.759 2.471 2.956     .  0 0 "[    .    1    ]" 1 
        830 1  47 GLY H    1  48 MET HA   3.100     . 5.000 3.402 2.780 4.339     .  0 0 "[    .    1    ]" 1 
        831 1  47 GLY H    1  48 MET QB   3.700     . 5.500 5.239 4.937 5.506 0.006  2 0 "[    .    1    ]" 1 
        832 1  47 GLY H    1  50 VAL H    3.600     . 5.500 4.389 3.983 5.530 0.030  5 0 "[    .    1    ]" 1 
        833 1  47 GLY H    1  50 VAL MG2  3.800     . 5.500 3.843 2.613 5.021     .  0 0 "[    .    1    ]" 1 
        834 1  47 GLY H    1 112 ILE MG   2.900     . 4.600 4.177 3.666 4.829 0.229  8 0 "[    .    1    ]" 1 
        835 1  47 GLY H    1 112 ILE MD   3.200     . 5.200 2.940 2.226 3.821     .  0 0 "[    .    1    ]" 1 
        836 1  47 GLY HA3  1  48 MET H    2.900     . 3.900 2.979 2.233 3.380     .  0 0 "[    .    1    ]" 1 
        837 1  47 GLY HA3  1  50 VAL H    3.300     . 5.500 3.591 3.000 4.755     .  0 0 "[    .    1    ]" 1 
        838 1  47 GLY HA3  1  50 VAL MG2  2.700     . 3.600 2.826 2.090 3.542     .  0 0 "[    .    1    ]" 1 
        839 1  47 GLY HA3  1  51 CYS H    3.500     . 5.500 5.242 4.807 5.531 0.031  5 0 "[    .    1    ]" 1 
        840 1  48 MET H    1  48 MET QB   2.800     . 4.400 2.264 2.054 2.711     .  0 0 "[    .    1    ]" 1 
        841 1  48 MET H    1  48 MET HB3  2.800     . 3.800 2.850 2.613 3.321     .  0 0 "[    .    1    ]" 1 
        842 1  48 MET H    1  48 MET HG2  3.500     . 5.500 3.864 2.522 4.333     .  0 0 "[    .    1    ]" 1 
        843 1  48 MET H    1  48 MET HG3  3.300     . 5.500 2.902 2.577 3.342     .  0 0 "[    .    1    ]" 1 
        844 1  48 MET H    1  49 GLN H    3.400     . 5.500 2.644 1.942 4.593     .  0 0 "[    .    1    ]" 1 
        845 1  48 MET H    1  50 VAL QG   3.600     . 5.500 4.512 3.613 4.999     .  0 0 "[    .    1    ]" 1 
        846 1  48 MET HA   1  48 MET QB   2.500     . 3.400 2.452 2.380 2.540     .  0 0 "[    .    1    ]" 1 
        847 1  48 MET HA   1  48 MET HB3  2.600     . 3.500 2.991 2.835 3.023     .  0 0 "[    .    1    ]" 1 
        848 1  48 MET HA   1  48 MET ME   2.800     . 4.400 3.513 3.126 4.084     .  0 0 "[    .    1    ]" 1 
        849 1  48 MET HA   1  48 MET HG2  2.700     . 3.600 2.233 2.047 2.401     .  0 0 "[    .    1    ]" 1 
        850 1  48 MET HA   1  48 MET HG3  2.800     . 4.400 3.327 3.027 3.612     .  0 0 "[    .    1    ]" 1 
        851 1  48 MET HA   1  49 GLN H    3.500     . 5.500 3.438 2.583 3.561     .  0 0 "[    .    1    ]" 1 
        852 1  48 MET HA   1  49 GLN HA   3.000     . 4.800 4.156 3.698 4.494     .  0 0 "[    .    1    ]" 1 
        853 1  48 MET HA   1  51 CYS H    3.200 2.100 4.300 3.451 3.286 3.803     .  0 0 "[    .    1    ]" 1 
        854 1  48 MET HA   1  51 CYS HA   2.500     . 4.500 4.500 4.448 4.537 0.037 14 0 "[    .    1    ]" 1 
        855 1  48 MET HA   1  51 CYS HB2  3.200     . 5.200 3.508 2.799 4.791     .  0 0 "[    .    1    ]" 1 
        856 1  48 MET HA   1  51 CYS HB3  3.000     . 4.800 4.593 3.096 5.181 0.381 13 0 "[    .    1    ]" 1 
        857 1  48 MET HA   1  52 GLU H    3.500     . 5.500 4.428 4.091 4.762     .  0 0 "[    .    1    ]" 1 
        858 1  48 MET HA   1 100 ALA MB   2.700     . 4.200 2.811 2.392 3.669     .  0 0 "[    .    1    ]" 1 
        859 1  48 MET QB   1 100 ALA MB   3.000     . 4.800 3.191 2.817 3.553     .  0 0 "[    .    1    ]" 1 
        860 1  48 MET HB2  1  49 GLN H    2.300     . 3.100 2.418 2.068 3.345 0.245  5 0 "[    .    1    ]" 1 
        861 1  48 MET HB3  1  51 CYS H    3.300     . 5.500 4.122 3.611 4.485     .  0 0 "[    .    1    ]" 1 
        862 1  48 MET ME   1  48 MET HG2  2.100     . 2.800 2.132 1.983 2.299     .  0 0 "[    .    1    ]" 1 
        863 1  48 MET ME   1  48 MET HG3  2.400     . 3.200 3.075 2.819 3.215 0.015 10 0 "[    .    1    ]" 1 
        864 1  48 MET ME   1  49 GLN HB3  2.400     . 4.500 4.493 4.247 4.571 0.071 14 0 "[    .    1    ]" 1 
        865 1  48 MET ME   1  50 VAL QG   3.100     . 5.000 4.942 4.727 5.049 0.049 14 0 "[    .    1    ]" 1 
        866 1  48 MET ME   1  51 CYS HB2  2.800     . 4.400 3.015 2.374 3.833     .  0 0 "[    .    1    ]" 1 
        867 1  48 MET ME   1  52 GLU H    2.600     . 4.000 3.260 2.638 3.868     .  0 0 "[    .    1    ]" 1 
        868 1  48 MET ME   1  52 GLU HA   2.800     . 4.400 3.921 3.357 4.353     .  0 0 "[    .    1    ]" 1 
        869 1  48 MET ME   1  52 GLU QB   2.800     . 4.400 3.249 2.296 4.107     .  0 0 "[    .    1    ]" 1 
        870 1  48 MET ME   1  52 GLU QB   2.600     . 3.500 3.175 2.295 3.548 0.048 14 0 "[    .    1    ]" 1 
        871 1  48 MET ME   1  52 GLU QG   2.700     . 3.600 2.283 1.817 3.196     .  0 0 "[    .    1    ]" 1 
        872 1  48 MET ME   1 100 ALA MB   2.400     . 3.600 2.884 2.351 3.303     .  0 0 "[    .    1    ]" 1 
        873 1  48 MET ME   1 100 ALA MB   2.400     . 3.200 2.542 1.948 2.859     .  0 0 "[    .    1    ]" 1 
        874 1  48 MET ME   1 102 ASP QB   2.700     . 4.500 3.537 1.830 4.496     .  0 0 "[    .    1    ]" 1 
        875 1  48 MET ME   1 103 ARG H    3.300     . 5.500 4.071 2.359 4.729     .  0 0 "[    .    1    ]" 1 
        876 1  48 MET ME   1 103 ARG HA   2.700     . 4.200 4.047 3.576 4.221 0.021  6 0 "[    .    1    ]" 1 
        877 1  48 MET ME   1 103 ARG QB   2.400     . 3.600 3.607 2.969 4.123 0.523 14 1 "[    .    1   +]" 1 
        878 1  48 MET ME   2   5 PRO HG3  2.600     . 4.500 4.470 4.219 4.532 0.032 14 0 "[    .    1    ]" 1 
        879 1  48 MET HG2  1  51 CYS H    3.500     . 5.500 4.804 4.357 5.505 0.005 14 0 "[    .    1    ]" 1 
        880 1  48 MET HG2  1 100 ALA H    3.000     . 4.800 4.336 3.930 4.531     .  0 0 "[    .    1    ]" 1 
        881 1  48 MET HG2  1 100 ALA MB   2.600     . 3.500 2.187 1.906 3.210     .  0 0 "[    .    1    ]" 1 
        882 1  48 MET HG3  1 100 ALA MB   2.900     . 4.600 2.846 1.904 4.254     .  0 0 "[    .    1    ]" 1 
        883 1  48 MET HG3  2   1 ALA MB   4.200     . 5.500 4.921 3.945 5.435     .  0 0 "[    .    1    ]" 1 
        884 1  49 GLN H    1  49 GLN HA   2.700     . 3.600 2.770 2.283 2.882     .  0 0 "[    .    1    ]" 1 
        885 1  49 GLN H    1  49 GLN HB3  2.900     . 3.900 2.575 2.030 3.056     .  0 0 "[    .    1    ]" 1 
        886 1  49 GLN H    1  49 GLN HB3  2.700     . 4.200 3.360 2.306 3.775     .  0 0 "[    .    1    ]" 1 
        887 1  49 GLN H    1  50 VAL H    2.700     . 3.600 2.729 2.381 3.649 0.049  5 0 "[    .    1    ]" 1 
        888 1  49 GLN H    1  50 VAL QG   3.200     . 5.200 3.763 3.423 4.482     .  0 0 "[    .    1    ]" 1 
        889 1  49 GLN H    1  51 CYS H    3.400     . 5.500 4.157 3.797 4.361     .  0 0 "[    .    1    ]" 1 
        890 1  49 GLN HA   1  49 GLN HB2  2.300     . 3.100 2.985 2.899 3.025     .  0 0 "[    .    1    ]" 1 
        891 1  49 GLN HA   1  49 GLN HB2  2.100     . 3.000 2.104 2.031 2.201     .  0 0 "[    .    1    ]" 1 
        892 1  49 GLN HA   1  49 GLN HB3  2.200     . 3.000 2.127 1.961 2.309     .  0 0 "[    .    1    ]" 1 
        893 1  49 GLN HA   1  49 GLN QG   2.500     . 3.400 2.340 2.003 3.031     .  0 0 "[    .    1    ]" 1 
        894 1  49 GLN HA   1  50 VAL H    3.000     . 4.000 3.503 3.421 3.573     .  0 0 "[    .    1    ]" 1 
        895 1  49 GLN HA   1  52 GLU H    2.800     . 3.800 3.083 2.927 3.252     .  0 0 "[    .    1    ]" 1 
        896 1  49 GLN HA   1  52 GLU HA   3.100     . 5.000 4.512 4.403 4.644     .  0 0 "[    .    1    ]" 1 
        897 1  49 GLN HA   1  52 GLU HB3  2.100     . 2.800 2.144 2.060 2.257     .  0 0 "[    .    1    ]" 1 
        898 1  49 GLN HB2  1  50 VAL H    3.100     . 4.200 2.865 2.113 3.487     .  0 0 "[    .    1    ]" 1 
        899 1  49 GLN HB2  1  50 VAL HA   2.700     . 4.500 4.497 4.064 5.112 0.612 12 3 "[    . *  1 + -]" 1 
        900 1  49 GLN HB2  1  50 VAL HA   2.700     . 4.200 3.757 3.587 4.061     .  0 0 "[    .    1    ]" 1 
        901 1  49 GLN HB2  1  50 VAL MG1  2.500     . 4.500 4.498 4.398 4.647 0.147 10 0 "[    .    1    ]" 1 
        902 1  49 GLN HB2  1  50 VAL MG2  2.800     . 4.400 3.443 2.966 3.925     .  0 0 "[    .    1    ]" 1 
        903 1  49 GLN HB3  1  50 VAL H    3.200     . 5.200 3.455 2.986 3.681     .  0 0 "[    .    1    ]" 1 
        904 1  50 VAL H    1  50 VAL HA   2.500     . 3.400 2.815 2.749 2.898     .  0 0 "[    .    1    ]" 1 
        905 1  50 VAL H    1  50 VAL HB   2.300     . 3.100 2.607 2.542 2.693     .  0 0 "[    .    1    ]" 1 
        906 1  50 VAL H    1  50 VAL MG2  2.300     . 3.100 2.053 1.920 2.259     .  0 0 "[    .    1    ]" 1 
        907 1  50 VAL H    1  51 CYS H    2.500     . 3.400 2.627 2.342 2.784     .  0 0 "[    .    1    ]" 1 
        908 1  50 VAL H    1  52 GLU H    3.500     . 5.500 4.239 3.966 4.621     .  0 0 "[    .    1    ]" 1 
        909 1  50 VAL H    1  53 GLU H    3.700     . 5.500 5.058 4.720 5.475     .  0 0 "[    .    1    ]" 1 
        910 1  50 VAL HA   1  50 VAL HB   2.500     . 3.400 3.020 3.015 3.023     .  0 0 "[    .    1    ]" 1 
        911 1  50 VAL HA   1  50 VAL MG1  2.300     . 3.100 2.328 2.215 2.415     .  0 0 "[    .    1    ]" 1 
        912 1  50 VAL HA   1  50 VAL MG2  2.100     . 2.800 2.424 2.310 2.481     .  0 0 "[    .    1    ]" 1 
        913 1  50 VAL HA   1  51 CYS H    3.300 2.100 4.500 3.502 3.445 3.558     .  0 0 "[    .    1    ]" 1 
        914 1  50 VAL HA   1  52 GLU H    3.600     . 5.500 4.284 4.053 4.603     .  0 0 "[    .    1    ]" 1 
        915 1  50 VAL HA   1  53 GLU H    3.400 2.200 4.600 3.648 3.442 3.908     .  0 0 "[    .    1    ]" 1 
        916 1  50 VAL HA   1  53 GLU QB   2.600     . 4.500 4.065 3.882 4.389     .  0 0 "[    .    1    ]" 1 
        917 1  50 VAL HA   1  53 GLU QB   2.900     . 4.600 2.734 1.929 3.485     .  0 0 "[    .    1    ]" 1 
        918 1  50 VAL HA   1  53 GLU HG3  2.800     . 4.400 3.154 2.567 3.446     .  0 0 "[    .    1    ]" 1 
        919 1  50 VAL HA   1  54 ALA H    3.400     . 5.500 3.838 3.620 4.079     .  0 0 "[    .    1    ]" 1 
        920 1  50 VAL HB   1  50 VAL MG2  2.000     . 2.700 2.108 2.084 2.128     .  0 0 "[    .    1    ]" 1 
        921 1  50 VAL HB   1  51 CYS H    2.500     . 3.400 2.793 2.446 3.099     .  0 0 "[    .    1    ]" 1 
        922 1  50 VAL HB   1  54 ALA H    3.200     . 5.200 4.235 4.093 4.355     .  0 0 "[    .    1    ]" 1 
        923 1  50 VAL HB   1 112 ILE MD   2.900     . 4.600 4.036 3.223 4.606 0.006  5 0 "[    .    1    ]" 1 
        924 1  50 VAL MG1  1  55 LEU HB2  2.500     . 4.500 2.479 2.250 2.800     .  0 0 "[    .    1    ]" 1 
        925 1  50 VAL QG   1  51 CYS H    2.800     . 3.800 3.338 3.133 3.487     .  0 0 "[    .    1    ]" 1 
        926 1  50 VAL QG   1  52 GLU H    3.400     . 5.500 4.468 4.266 4.626     .  0 0 "[    .    1    ]" 1 
        927 1  50 VAL QG   1  53 GLU H    3.300     . 5.500 4.407 4.237 4.698     .  0 0 "[    .    1    ]" 1 
        928 1  50 VAL QG   1 112 ILE MD   2.200     . 4.500 3.936 3.231 4.411     .  0 0 "[    .    1    ]" 1 
        929 1  50 VAL MG1  1  53 GLU QG   2.600     . 3.500 2.948 2.729 3.302     .  0 0 "[    .    1    ]" 1 
        930 1  50 VAL MG1  1  54 ALA MB   2.300     . 3.100 2.685 2.415 2.875     .  0 0 "[    .    1    ]" 1 
        931 1  50 VAL MG1  1  54 ALA MB   2.000     . 2.800 2.606 2.390 2.785     .  0 0 "[    .    1    ]" 1 
        932 1  50 VAL MG1  1 122 MET ME   2.500     . 4.500 2.412 2.212 2.544     .  0 0 "[    .    1    ]" 1 
        933 1  50 VAL MG1  1 112 ILE MG   2.400     . 3.600 3.196 2.468 3.590     .  0 0 "[    .    1    ]" 1 
        934 1  50 VAL MG1  1 123 CYS QB   2.700     . 4.200 3.799 3.473 4.236 0.036  5 0 "[    .    1    ]" 1 
        935 1  51 CYS C    1  55 LEU N    4.100 3.800 4.400 4.054 3.848 4.263     .  0 0 "[    .    1    ]" 1 
        936 1  51 CYS H    1  51 CYS HA   2.600     . 3.500 2.840 2.807 2.860     .  0 0 "[    .    1    ]" 1 
        937 1  51 CYS H    1  51 CYS HB2  3.000     . 4.000 2.605 2.118 3.596     .  0 0 "[    .    1    ]" 1 
        938 1  51 CYS H    1  51 CYS HB3  2.700     . 3.600 3.407 2.400 3.604 0.004  4 0 "[    .    1    ]" 1 
        939 1  51 CYS H    1  52 GLU H    2.600     . 3.500 2.593 2.495 2.744     .  0 0 "[    .    1    ]" 1 
        940 1  51 CYS H    1  52 GLU HA   3.700     . 5.500 5.202 5.133 5.303     .  0 0 "[    .    1    ]" 1 
        941 1  51 CYS H    1  53 GLU H    3.800     . 5.500 4.201 3.913 4.567     .  0 0 "[    .    1    ]" 1 
        942 1  51 CYS H    1  53 GLU HG2  2.700     . 4.500 4.413 4.040 4.909 0.409 10 0 "[    .    1    ]" 1 
        943 1  51 CYS H    1  54 ALA MB   3.300     . 5.500 4.147 3.955 4.286     .  0 0 "[    .    1    ]" 1 
        944 1  51 CYS H    1 112 ILE MD   3.600     . 5.500 4.668 4.322 4.985     .  0 0 "[    .    1    ]" 1 
        945 1  51 CYS HA   1  51 CYS HB2  2.500     . 3.400 2.922 2.348 3.028     .  0 0 "[    .    1    ]" 1 
        946 1  51 CYS HA   1  51 CYS HB3  2.500     . 3.400 2.514 2.383 2.756     .  0 0 "[    .    1    ]" 1 
        947 1  51 CYS HA   1  54 ALA H    3.200 2.100 4.300 3.279 3.134 3.454     .  0 0 "[    .    1    ]" 1 
        948 1  51 CYS HA   1  54 ALA MB   2.400     . 3.200 2.068 1.917 2.247     .  0 0 "[    .    1    ]" 1 
        949 1  51 CYS HA   1  55 LEU H    3.600     . 5.500 3.735 3.246 4.252     .  0 0 "[    .    1    ]" 1 
        950 1  51 CYS HA   1  55 LEU HB2  2.700     . 4.500 4.384 4.053 4.502 0.002 14 0 "[    .    1    ]" 1 
        951 1  51 CYS HA   1 110 SER QB   2.700     . 3.600 3.352 2.570 3.626 0.026 13 0 "[    .    1    ]" 1 
        952 1  51 CYS HB2  1  52 GLU H    3.500 2.300 4.700 2.826 2.258 3.988 0.042  8 0 "[    .    1    ]" 1 
        953 1  51 CYS HB2  1  58 LEU QD   2.900     . 4.600 2.583 1.837 3.398     .  0 0 "[    .    1    ]" 1 
        954 1  51 CYS HB2  1 100 ALA MB   3.000     . 4.800 3.223 2.849 3.709     .  0 0 "[    .    1    ]" 1 
        955 1  51 CYS HB2  1 110 SER HA   3.100     . 5.000 3.711 2.783 4.533     .  0 0 "[    .    1    ]" 1 
        956 1  51 CYS HB2  1 111 TYR H    3.600     . 5.500 5.344 4.818 5.704 0.204 10 0 "[    .    1    ]" 1 
        957 1  51 CYS HB3  1  52 GLU H    2.900     . 3.900 3.612 3.102 3.930 0.030  7 0 "[    .    1    ]" 1 
        958 1  51 CYS HB3  1 100 ALA MB   3.000     . 4.800 3.572 2.945 3.828     .  0 0 "[    .    1    ]" 1 
        959 1  51 CYS O    1  55 LEU N    3.000 2.800 3.200 2.928 2.781 3.148 0.019 12 0 "[    .    1    ]" 1 
        960 1  52 GLU H    1  52 GLU HA   2.700     . 3.600 2.789 2.739 2.833     .  0 0 "[    .    1    ]" 1 
        961 1  52 GLU H    1  52 GLU QB   2.900     . 3.900 2.120 2.040 2.532     .  0 0 "[    .    1    ]" 1 
        962 1  52 GLU H    1  52 GLU QG   2.600     . 3.500 3.089 1.999 3.437     .  0 0 "[    .    1    ]" 1 
        963 1  52 GLU H    1  53 GLU H    2.700     . 3.600 2.765 2.578 2.982     .  0 0 "[    .    1    ]" 1 
        964 1  52 GLU H    1  54 ALA H    3.600     . 5.500 3.969 3.812 4.250     .  0 0 "[    .    1    ]" 1 
        965 1  52 GLU H    1  54 ALA MB   3.900     . 5.500 4.480 4.215 4.703     .  0 0 "[    .    1    ]" 1 
        966 1  52 GLU HA   1  52 GLU QG   2.500     . 3.400 2.207 2.030 2.553     .  0 0 "[    .    1    ]" 1 
        967 1  52 GLU HA   1  52 GLU QG   2.700     . 3.600 1.940 1.829 2.132     .  0 0 "[    .    1    ]" 1 
        968 1  52 GLU HA   1  53 GLU H    3.200     . 5.200 3.536 3.498 3.572     .  0 0 "[    .    1    ]" 1 
        969 1  52 GLU HA   1  54 ALA H    3.500     . 5.500 4.332 4.112 4.496     .  0 0 "[    .    1    ]" 1 
        970 1  52 GLU HA   1  55 LEU H    2.900     . 4.600 4.057 3.595 4.354     .  0 0 "[    .    1    ]" 1 
        971 1  52 GLU HA   1  55 LEU HB2  2.800     . 4.400 3.806 3.400 4.399     .  0 0 "[    .    1    ]" 1 
        972 1  52 GLU HA   1  55 LEU QD   2.700     . 4.200 4.012 3.721 4.230 0.030  2 0 "[    .    1    ]" 1 
        973 1  52 GLU HA   1  55 LEU QD   2.700     . 4.200 3.323 2.592 3.719     .  0 0 "[    .    1    ]" 1 
        974 1  52 GLU HA   1 102 ASP H    3.600     . 5.500 5.174 4.492 5.543 0.043  4 0 "[    .    1    ]" 1 
        975 1  52 GLU QB   1  53 GLU H    3.100     . 4.200 2.613 2.287 2.864     .  0 0 "[    .    1    ]" 1 
        976 1  52 GLU QB   1  55 LEU H    3.500     . 5.500 4.257 3.933 4.385     .  0 0 "[    .    1    ]" 1 
        977 1  52 GLU HB2  1  53 GLU HA   2.100     . 2.800 2.731 2.538 2.980 0.180  5 0 "[    .    1    ]" 1 
        978 1  52 GLU HB3  1  55 LEU QD   2.700     . 4.200 3.072 2.682 3.539     .  0 0 "[    .    1    ]" 1 
        979 1  52 GLU QG   1 102 ASP H    3.000     . 4.000 3.491 2.027 4.017 0.017 12 0 "[    .    1    ]" 1 
        980 1  52 GLU QG   1 103 ARG H    3.300     . 5.500 4.212 2.714 5.196     .  0 0 "[    .    1    ]" 1 
        981 1  53 GLU C    1  57 VAL N    4.100 3.800 4.400 4.144 3.927 4.284     .  0 0 "[    .    1    ]" 1 
        982 1  53 GLU H    1  53 GLU HA   2.600     . 3.500 2.876 2.815 2.919     .  0 0 "[    .    1    ]" 1 
        983 1  53 GLU H    1  53 GLU QB   2.200     . 3.000 2.605 2.436 2.731     .  0 0 "[    .    1    ]" 1 
        984 1  53 GLU H    1  53 GLU HG2  2.500     . 3.400 2.107 1.943 2.259     .  0 0 "[    .    1    ]" 1 
        985 1  53 GLU H    1  54 ALA H    2.500     . 3.400 2.417 2.232 2.620     .  0 0 "[    .    1    ]" 1 
        986 1  53 GLU H    1  54 ALA MB   3.200     . 5.200 4.075 3.923 4.238     .  0 0 "[    .    1    ]" 1 
        987 1  53 GLU HA   1  53 GLU HG3  2.300     . 4.500 3.738 3.612 4.007     .  0 0 "[    .    1    ]" 1 
        988 1  53 GLU HA   1  54 ALA H    2.400     . 3.200 2.683 2.659 2.724     .  0 0 "[    .    1    ]" 1 
        989 1  53 GLU HA   1  55 LEU H    2.900     . 4.600 3.385 3.142 3.492     .  0 0 "[    .    1    ]" 1 
        990 1  53 GLU HA   1  56 LYS H    2.700     . 3.600 3.245 2.826 3.455     .  0 0 "[    .    1    ]" 1 
        991 1  53 GLU HA   1  56 LYS QG   3.100     . 5.000 3.830 1.909 4.562     .  0 0 "[    .    1    ]" 1 
        992 1  53 GLU HA   1  57 VAL H    2.900     . 3.900 3.277 3.062 3.511     .  0 0 "[    .    1    ]" 1 
        993 1  53 GLU HA   1  56 LYS QE   2.900     . 4.600 3.831 2.794 4.604 0.004 13 0 "[    .    1    ]" 1 
        994 1  53 GLU HA   1  57 VAL MG2  2.800     . 4.400 3.969 3.581 4.279     .  0 0 "[    .    1    ]" 1 
        995 1  53 GLU QB   1  53 GLU HG3  1.900     . 2.600 1.905 1.837 1.939     .  0 0 "[    .    1    ]" 1 
        996 1  53 GLU QB   1  54 ALA H    2.400     . 3.600 3.442 3.377 3.514     .  0 0 "[    .    1    ]" 1 
        997 1  53 GLU QB   1  57 VAL MG2  2.900     . 4.600 3.361 3.034 3.602     .  0 0 "[    .    1    ]" 1 
        998 1  53 GLU HB2  1  56 LYS QD   2.800     . 4.400 3.041 2.602 3.614     .  0 0 "[    .    1    ]" 1 
        999 1  53 GLU QG   1  54 ALA H    2.800     . 4.400 2.101 2.001 2.271     .  0 0 "[    .    1    ]" 1 
       1000 1  53 GLU QG   1  54 ALA MB   2.700     . 3.600 3.139 2.985 3.367     .  0 0 "[    .    1    ]" 1 
       1001 1  53 GLU HG3  1  57 VAL MG2  2.600     . 3.500 3.209 2.965 3.463     .  0 0 "[    .    1    ]" 1 
       1002 1  53 GLU HG3  1  57 VAL MG2  2.600     . 4.000 3.037 2.658 3.255     .  0 0 "[    .    1    ]" 1 
       1003 1  53 GLU O    1  57 VAL N    3.000 2.800 3.200 2.984 2.793 3.187 0.007 13 0 "[    .    1    ]" 1 
       1004 1  54 ALA H    1  54 ALA MB   2.200     . 3.000 2.201 2.073 2.240     .  0 0 "[    .    1    ]" 1 
       1005 1  54 ALA H    1  55 LEU H    2.500     . 3.400 2.812 2.529 2.908     .  0 0 "[    .    1    ]" 1 
       1006 1  54 ALA H    1  55 LEU H    2.500     . 3.400 2.471 2.090 2.585     .  0 0 "[    .    1    ]" 1 
       1007 1  54 ALA H    1  55 LEU HB2  3.400     . 5.500 4.809 4.562 5.248     .  0 0 "[    .    1    ]" 1 
       1008 1  54 ALA H    1  55 LEU HB3  3.500     . 5.500 5.069 4.701 5.372     .  0 0 "[    .    1    ]" 1 
       1009 1  54 ALA HA   1  54 ALA MB   2.100     . 2.800 2.118 2.090 2.127     .  0 0 "[    .    1    ]" 1 
       1010 1  54 ALA HA   1  55 LEU HA   2.900     . 4.600 3.236 2.861 3.375     .  0 0 "[    .    1    ]" 1 
       1011 1  54 ALA HA   1  57 VAL MG1  2.700     . 3.600 2.653 2.332 2.931     .  0 0 "[    .    1    ]" 1 
       1012 1  54 ALA HA   1  57 VAL MG2  2.400     . 3.200 2.065 1.925 2.668     .  0 0 "[    .    1    ]" 1 
       1013 1  54 ALA HA   1  58 LEU H    3.400     . 5.500 3.785 3.608 3.906     .  0 0 "[    .    1    ]" 1 
       1014 1  54 ALA MB   1  55 LEU H    2.400     . 3.200 2.457 2.151 2.940     .  0 0 "[    .    1    ]" 1 
       1015 1  54 ALA MB   1  55 LEU HB2  2.800     . 4.400 3.903 3.737 4.012     .  0 0 "[    .    1    ]" 1 
       1016 1  54 ALA MB   1  56 LYS H    3.200 2.100 4.300 3.476 2.493 3.799     .  0 0 "[    .    1    ]" 1 
       1017 1  54 ALA MB   1  57 VAL H    3.200     . 5.200 3.353 2.068 3.777     .  0 0 "[    .    1    ]" 1 
       1018 1  54 ALA MB   1  57 VAL MG1  2.800     . 4.400 3.417 3.279 3.729     .  0 0 "[    .    1    ]" 1 
       1019 1  54 ALA MB   1  57 VAL MG2  2.500     . 3.400 3.165 1.983 3.451 0.051  1 0 "[    .    1    ]" 1 
       1020 1  54 ALA MB   1  58 LEU H    3.300     . 5.500 4.475 4.242 4.637     .  0 0 "[    .    1    ]" 1 
       1021 1  54 ALA MB   1  57 VAL HB   2.800     . 4.400 4.196 3.830 4.431 0.031  9 0 "[    .    1    ]" 1 
       1022 1  54 ALA MB   1  57 VAL MG2  2.700     . 4.200 3.608 3.506 3.998     .  0 0 "[    .    1    ]" 1 
       1023 1  54 ALA MB   1  58 LEU QD   2.800     . 4.400 2.930 2.608 3.593     .  0 0 "[    .    1    ]" 1 
       1024 1  54 ALA MB   1 112 ILE MG   2.200     . 4.500 3.573 3.166 3.802     .  0 0 "[    .    1    ]" 1 
       1025 1  54 ALA MB   1 123 CYS H    3.000     . 4.800 4.484 4.086 4.805 0.005 13 0 "[    .    1    ]" 1 
       1026 1  54 ALA MB   1 123 CYS QB   2.500     . 3.400 1.917 1.759 2.120     .  0 0 "[    .    1    ]" 1 
       1027 1  54 ALA MB   1 124 HIS H    3.000     . 4.000 3.811 3.355 4.027 0.027  5 0 "[    .    1    ]" 1 
       1028 1  55 LEU H    1  55 LEU HA   2.700     . 3.600 2.783 2.727 2.912     .  0 0 "[    .    1    ]" 1 
       1029 1  55 LEU H    1  55 LEU HB2  2.400     . 3.200 2.240 2.047 2.505     .  0 0 "[    .    1    ]" 1 
       1030 1  55 LEU H    1  55 LEU HB3  2.600     . 3.500 2.883 2.505 3.275     .  0 0 "[    .    1    ]" 1 
       1031 1  55 LEU H    1  55 LEU QD   2.900     . 3.900 3.595 2.829 3.756     .  0 0 "[    .    1    ]" 1 
       1032 1  55 LEU H    1  55 LEU QD   3.000     . 4.800 3.259 2.677 3.464     .  0 0 "[    .    1    ]" 1 
       1033 1  55 LEU H    1  56 LYS H    2.500     . 3.400 2.744 2.227 2.908     .  0 0 "[    .    1    ]" 1 
       1034 1  55 LEU H    1  57 VAL MG2  3.500     . 5.500 4.226 4.044 4.423     .  0 0 "[    .    1    ]" 1 
       1035 1  55 LEU H    1  58 LEU QD   3.500     . 5.500 3.820 3.333 4.553     .  0 0 "[    .    1    ]" 1 
       1036 1  55 LEU HA   1  55 LEU HB2  2.500     . 3.400 2.633 2.419 2.819     .  0 0 "[    .    1    ]" 1 
       1037 1  55 LEU HA   1  55 LEU HB3  2.600     . 3.500 2.371 2.127 2.896     .  0 0 "[    .    1    ]" 1 
       1038 1  55 LEU HA   1  55 LEU QD   2.200     . 3.000 2.590 1.938 2.968     .  0 0 "[    .    1    ]" 1 
       1039 1  55 LEU HA   1  55 LEU HG   2.600     . 4.000 2.586 2.180 3.727     .  0 0 "[    .    1    ]" 1 
       1040 1  55 LEU HA   1  56 LYS H    2.400     . 3.600 2.708 2.672 2.755     .  0 0 "[    .    1    ]" 1 
       1041 1  55 LEU HA   1  57 VAL H    3.200 2.100 4.300 3.378 3.309 3.435     .  0 0 "[    .    1    ]" 1 
       1042 1  55 LEU HA   1  58 LEU H    2.700     . 3.600 2.664 2.636 2.714     .  0 0 "[    .    1    ]" 1 
       1043 1  55 LEU HA   1  58 LEU QD   2.600     . 3.500 1.792 1.700 2.106 0.000 14 0 "[    .    1    ]" 1 
       1044 1  55 LEU HA   1  58 LEU QB   2.800     . 4.400 2.710 2.343 3.275     .  0 0 "[    .    1    ]" 1 
       1045 1  55 LEU HA   1  58 LEU QD   2.600     . 3.500 2.321 1.909 2.854     .  0 0 "[    .    1    ]" 1 
       1046 1  55 LEU HB2  1  56 LYS H    2.900     . 3.900 3.558 3.120 3.919 0.019 12 0 "[    .    1    ]" 1 
       1047 1  55 LEU HB2  1  58 LEU QD   2.600     . 4.000 3.788 3.728 3.848     .  0 0 "[    .    1    ]" 1 
       1048 1  55 LEU HB3  1  59 ARG H    3.400     . 5.500 4.951 4.679 5.378     .  0 0 "[    .    1    ]" 1 
       1049 1  55 LEU HB3  1 110 SER H    3.400     . 5.500 4.616 4.274 4.947     .  0 0 "[    .    1    ]" 1 
       1050 1  55 LEU QD   1  55 LEU HG   1.800     . 2.400 1.678 1.598 1.710     .  0 0 "[    .    1    ]" 1 
       1051 1  55 LEU QD   1  56 LYS H    3.100     . 5.000 3.634 2.794 4.079     .  0 0 "[    .    1    ]" 1 
       1052 1  55 LEU QD   1  58 LEU QB   2.600     . 4.500 3.323 2.599 4.420     .  0 0 "[    .    1    ]" 1 
       1053 1  55 LEU QD   1  59 ARG H    3.300     . 5.500 4.656 4.030 5.332     .  0 0 "[    .    1    ]" 1 
       1054 1  55 LEU QD   1 101 PRO HA   2.800     . 4.400 2.200 1.875 2.890     .  0 0 "[    .    1    ]" 1 
       1055 1  55 LEU QD   1 103 ARG H    2.800     . 4.400 2.032 1.847 2.293     .  0 0 "[    .    1    ]" 1 
       1056 1  55 LEU QD   1 125 GLY HA2  2.500     . 3.800 2.197 1.783 2.681     .  0 0 "[    .    1    ]" 1 
       1057 1  55 LEU QD   1 105 HIS H    3.300     . 5.500 4.273 3.219 5.456     .  0 0 "[    .    1    ]" 1 
       1058 1  55 LEU QD   1 108 GLY H    3.400     . 5.500 3.570 3.251 4.213     .  0 0 "[    .    1    ]" 1 
       1059 1  55 LEU QD   1 108 GLY QA   2.900     . 4.600 2.939 2.098 3.849     .  0 0 "[    .    1    ]" 1 
       1060 1  55 LEU QD   1 110 SER HA   2.900     . 4.600 3.794 3.133 4.612 0.012  2 0 "[    .    1    ]" 1 
       1061 1  55 LEU QD   1 110 SER QB   3.000     . 4.800 2.612 1.863 4.101     .  0 0 "[    .    1    ]" 1 
       1062 1  55 LEU QD   1 126 PHE H    3.000     . 4.000 2.784 1.992 3.571 0.008  6 0 "[    .    1    ]" 1 
       1063 1  56 LYS C    1  60 GLN N    4.100 3.800 4.400 4.203 3.920 4.381     .  0 0 "[    .    1    ]" 1 
       1064 1  56 LYS H    1  56 LYS HA   2.500     . 3.400 2.812 2.762 2.894     .  0 0 "[    .    1    ]" 1 
       1065 1  56 LYS H    1  56 LYS QB   2.100     . 2.800 2.242 2.188 2.409     .  0 0 "[    .    1    ]" 1 
       1066 1  56 LYS H    1  56 LYS QD   2.700     . 4.200 4.004 3.874 4.170     .  0 0 "[    .    1    ]" 1 
       1067 1  56 LYS H    1  57 VAL H    2.700     . 4.200 2.633 2.283 2.796     .  0 0 "[    .    1    ]" 1 
       1068 1  56 LYS H    1  57 VAL HA   3.600     . 5.500 4.973 4.777 5.118     .  0 0 "[    .    1    ]" 1 
       1069 1  56 LYS H    1  57 VAL HB   3.500     . 5.500 5.076 4.411 5.416     .  0 0 "[    .    1    ]" 1 
       1070 1  56 LYS H    1  57 VAL MG2  3.100     . 5.000 3.744 3.583 3.895     .  0 0 "[    .    1    ]" 1 
       1071 1  56 LYS HA   1  56 LYS QB   2.100     . 2.800 2.270 2.168 2.316     .  0 0 "[    .    1    ]" 1 
       1072 1  56 LYS HA   1  56 LYS QD   2.900     . 4.600 3.701 3.381 4.132     .  0 0 "[    .    1    ]" 1 
       1073 1  56 LYS HA   1  56 LYS QG   2.600     . 3.500 2.732 2.485 3.507 0.007 12 0 "[    .    1    ]" 1 
       1074 1  56 LYS HA   1  56 LYS HG3  2.800     . 4.400 3.631 3.504 3.732     .  0 0 "[    .    1    ]" 1 
       1075 1  56 LYS HA   1  59 ARG H    2.900     . 3.900 3.157 3.013 3.235     .  0 0 "[    .    1    ]" 1 
       1076 1  56 LYS HA   1  60 GLN H    3.200 2.100 4.300 4.092 3.768 4.237     .  0 0 "[    .    1    ]" 1 
       1077 1  56 LYS HA   1  59 ARG QB   2.700     . 3.600 3.180 2.452 3.487     .  0 0 "[    .    1    ]" 1 
       1078 1  56 LYS QB   1  57 VAL H    2.500     . 3.400 2.790 2.536 3.458 0.058  5 0 "[    .    1    ]" 1 
       1079 1  56 LYS QD   1  56 LYS HE2  2.400     . 3.200 2.398 2.169 2.517     .  0 0 "[    .    1    ]" 1 
       1080 1  56 LYS QD   1  56 LYS HE3  2.500     . 3.400 2.261 2.141 2.516     .  0 0 "[    .    1    ]" 1 
       1081 1  56 LYS QD   1  56 LYS QG   2.200     . 3.000 2.038 2.028 2.064     .  0 0 "[    .    1    ]" 1 
       1082 1  56 LYS QD   1  57 VAL H    3.100     . 5.000 2.898 2.399 4.214     .  0 0 "[    .    1    ]" 1 
       1083 1  56 LYS QD   1  57 VAL MG1  2.600     . 3.500 2.569 1.921 3.095     .  0 0 "[    .    1    ]" 1 
       1084 1  56 LYS QD   1  57 VAL MG1  2.600     . 4.000 2.731 1.927 3.294     .  0 0 "[    .    1    ]" 1 
       1085 1  56 LYS QD   1  57 VAL MG1  2.500     . 3.400 3.194 2.766 3.456 0.056 14 0 "[    .    1    ]" 1 
       1086 1  56 LYS QD   1  57 VAL MG1  2.500     . 4.500 2.596 1.924 3.170     .  0 0 "[    .    1    ]" 1 
       1087 1  56 LYS QD   1  57 VAL MG2  2.900     . 4.600 2.415 1.919 3.739     .  0 0 "[    .    1    ]" 1 
       1088 1  56 LYS QD   1  60 GLN QB   2.800     . 4.400 3.165 2.616 4.196     .  0 0 "[    .    1    ]" 1 
       1089 1  56 LYS QD   1  60 GLN QB   3.100     . 5.000 2.310 2.117 2.845     .  0 0 "[    .    1    ]" 1 
       1090 1  56 LYS QD   1  60 GLN QG   3.000     . 4.800 2.429 2.094 3.621     .  0 0 "[    .    1    ]" 1 
       1091 1  56 LYS QD   1  61 SER H    3.500     . 5.500 4.545 3.267 5.221     .  0 0 "[    .    1    ]" 1 
       1092 1  56 LYS HE2  1  56 LYS QG   2.800     . 4.400 2.355 1.950 3.319     .  0 0 "[    .    1    ]" 1 
       1093 1  56 LYS HE2  1  57 VAL MG1  2.800     . 4.400 2.923 2.000 3.405     .  0 0 "[    .    1    ]" 1 
       1094 1  56 LYS QG   1  60 GLN QB   2.900     . 4.600 3.940 3.421 4.584     .  0 0 "[    .    1    ]" 1 
       1095 1  56 LYS QG   1  60 GLN QG   3.200     . 5.200 3.551 2.948 4.377     .  0 0 "[    .    1    ]" 1 
       1096 1  56 LYS O    1  60 GLN N    3.000 2.800 3.200 3.058 2.748 3.208 0.052 12 0 "[    .    1    ]" 1 
       1097 1  57 VAL C    1  61 SER N    4.100 3.800 4.400 3.973 3.880 4.074     .  0 0 "[    .    1    ]" 1 
       1098 1  57 VAL H    1  57 VAL HA   2.500     . 3.400 2.813 2.772 2.835     .  0 0 "[    .    1    ]" 1 
       1099 1  57 VAL H    1  57 VAL HB   2.300     . 3.100 2.733 2.514 2.892     .  0 0 "[    .    1    ]" 1 
       1100 1  57 VAL H    1  57 VAL MG2  2.300     . 3.100 2.025 1.921 2.183     .  0 0 "[    .    1    ]" 1 
       1101 1  57 VAL H    1  58 LEU H    2.700     . 3.600 2.658 2.553 2.888     .  0 0 "[    .    1    ]" 1 
       1102 1  57 VAL H    1  58 LEU QD   3.700     . 5.500 3.876 3.416 4.733     .  0 0 "[    .    1    ]" 1 
       1103 1  57 VAL HA   1  57 VAL HB   2.400     . 3.600 2.468 1.911 2.926     .  0 0 "[    .    1    ]" 1 
       1104 1  57 VAL HA   1  57 VAL HB   2.400     . 3.200 2.675 2.500 2.803     .  0 0 "[    .    1    ]" 1 
       1105 1  57 VAL HA   1  57 VAL MG1  2.200     . 3.000 2.240 2.094 2.455     .  0 0 "[    .    1    ]" 1 
       1106 1  57 VAL HA   1  57 VAL MG2  2.100     . 2.600 1.989 1.960 2.084     .  0 0 "[    .    1    ]" 1 
       1107 1  57 VAL HA   1  58 LEU H    3.200     . 5.200 3.523 3.487 3.560     .  0 0 "[    .    1    ]" 1 
       1108 1  57 VAL HA   1  60 GLN H    3.100     . 4.200 3.169 2.720 3.480     .  0 0 "[    .    1    ]" 1 
       1109 1  57 VAL HA   1  60 GLN QB   2.700     . 3.600 2.454 1.911 2.927     .  0 0 "[    .    1    ]" 1 
       1110 1  57 VAL HA   1  60 GLN HE21 3.500     . 5.500 4.336 2.546 5.478     .  0 0 "[    .    1    ]" 1 
       1111 1  57 VAL HA   1  60 GLN QG   2.800     . 4.400 2.645 1.806 3.602     .  0 0 "[    .    1    ]" 1 
       1112 1  57 VAL HA   1  61 SER H    3.800     . 5.500 3.864 3.532 4.615     .  0 0 "[    .    1    ]" 1 
       1113 1  57 VAL HB   1  57 VAL MG1  2.000     . 2.700 2.119 2.085 2.129     .  0 0 "[    .    1    ]" 1 
       1114 1  57 VAL HB   1  57 VAL MG2  2.100     . 2.800 2.090 2.083 2.105     .  0 0 "[    .    1    ]" 1 
       1115 1  57 VAL HB   1  58 LEU H    2.700     . 3.600 2.685 2.311 2.921     .  0 0 "[    .    1    ]" 1 
       1116 1  57 VAL MG1  1  57 VAL MG2  1.800     . 2.400 2.012 1.867 2.065     .  0 0 "[    .    1    ]" 1 
       1117 1  57 VAL MG1  1  58 LEU HA   3.000     . 4.800 3.870 3.185 4.211     .  0 0 "[    .    1    ]" 1 
       1118 1  57 VAL MG1  1  58 LEU QD   2.500     . 4.000 3.601 3.121 4.034 0.034  8 0 "[    .    1    ]" 1 
       1119 1  57 VAL MG1  1  60 GLN H    3.600     . 5.500 4.444 3.895 4.832     .  0 0 "[    .    1    ]" 1 
       1120 1  57 VAL MG1  1  60 GLN QG   2.900     . 4.600 3.544 2.586 4.432     .  0 0 "[    .    1    ]" 1 
       1121 1  57 VAL MG1  1  61 SER H    3.600     . 5.500 3.796 3.525 4.307     .  0 0 "[    .    1    ]" 1 
       1122 1  57 VAL MG1  1  61 SER QB   3.000     . 4.800 2.687 2.349 2.985     .  0 0 "[    .    1    ]" 1 
       1123 1  57 VAL MG1  1  63 ARG HG2  2.700     . 4.200 2.678 1.906 3.257     .  0 0 "[    .    1    ]" 1 
       1124 1  57 VAL MG2  1  60 GLN H    3.600     . 5.500 4.461 4.186 4.652     .  0 0 "[    .    1    ]" 1 
       1125 1  57 VAL O    1  61 SER N    3.000 2.800 3.200 2.796 2.762 2.902 0.038 12 0 "[    .    1    ]" 1 
       1126 1  58 LEU H    1  58 LEU QB   2.900     . 3.900 2.200 2.069 2.395     .  0 0 "[    .    1    ]" 1 
       1127 1  58 LEU H    1  58 LEU QD   2.800     . 4.200 2.243 1.950 2.979 0.050 14 0 "[    .    1    ]" 1 
       1128 1  58 LEU H    1  59 ARG H    3.000     . 4.800 2.700 2.599 2.781     .  0 0 "[    .    1    ]" 1 
       1129 1  58 LEU HA   1  58 LEU QB   2.600     . 3.500 2.485 2.401 2.536     .  0 0 "[    .    1    ]" 1 
       1130 1  58 LEU HA   1  58 LEU QD   2.100     . 2.800 1.901 1.817 2.244     .  0 0 "[    .    1    ]" 1 
       1131 1  58 LEU HA   1  59 ARG HA   2.600     . 3.500 3.291 2.881 3.443     .  0 0 "[    .    1    ]" 1 
       1132 1  58 LEU HA   1  61 SER H    3.300 2.100 4.500 3.947 3.396 4.142     .  0 0 "[    .    1    ]" 1 
       1133 1  58 LEU HA   1  61 SER QB   2.400     . 4.500 3.369 2.910 3.543     .  0 0 "[    .    1    ]" 1 
       1134 1  58 LEU QB   1  58 LEU QD   2.500     . 3.400 2.037 1.904 2.100     .  0 0 "[    .    1    ]" 1 
       1135 1  58 LEU QB   1  59 ARG H    3.200 2.100 4.300 2.939 2.732 3.069     .  0 0 "[    .    1    ]" 1 
       1136 1  58 LEU QD   1  59 ARG H    3.200     . 5.200 3.940 3.795 4.218     .  0 0 "[    .    1    ]" 1 
       1137 1  58 LEU QD   1  61 SER H    3.500     . 5.500 4.779 4.586 4.954     .  0 0 "[    .    1    ]" 1 
       1138 1  58 LEU QD   1  61 SER QB   3.000     . 4.800 3.809 3.412 4.287     .  0 0 "[    .    1    ]" 1 
       1139 1  58 LEU QD   1  63 ARG QD   2.900     . 4.600 2.588 1.837 3.419     .  0 0 "[    .    1    ]" 1 
       1140 1  58 LEU QD   1  63 ARG QD   2.700     . 3.600 2.160 1.755 2.651 0.045  4 0 "[    .    1    ]" 1 
       1141 1  58 LEU QD   1  63 ARG QG   2.700     . 3.000 1.854 1.751 2.153     .  0 0 "[    .    1    ]" 1 
       1142 1  58 LEU QD   1  64 ARG QB   2.500     . 4.500 4.098 3.924 4.290     .  0 0 "[    .    1    ]" 1 
       1143 1  58 LEU QD   1 123 CYS H    3.200     . 5.200 4.751 4.335 4.977     .  0 0 "[    .    1    ]" 1 
       1144 1  58 LEU QD   1 124 HIS H    3.700     . 5.500 4.227 3.731 4.575     .  0 0 "[    .    1    ]" 1 
       1145 1  58 LEU QD   1 125 GLY H    2.700     . 3.600 2.369 1.920 3.027     .  0 0 "[    .    1    ]" 1 
       1146 1  58 LEU QD   1 125 GLY HA3  2.900     . 4.600 2.458 2.101 2.777     .  0 0 "[    .    1    ]" 1 
       1147 1  58 LEU QD   1 126 PHE H    3.400     . 5.500 4.912 4.525 5.240     .  0 0 "[    .    1    ]" 1 
       1148 1  59 ARG H    1  59 ARG HA   2.600     . 3.500 2.908 2.872 2.924     .  0 0 "[    .    1    ]" 1 
       1149 1  59 ARG H    1  59 ARG QB   2.300     . 3.100 2.232 2.105 2.359     .  0 0 "[    .    1    ]" 1 
       1150 1  59 ARG H    1  59 ARG HD2  3.700     . 5.500 4.594 3.955 5.828 0.328  6 0 "[    .    1    ]" 1 
       1151 1  59 ARG H    1  59 ARG HD3  3.700     . 5.500 4.801 3.110 5.480     .  0 0 "[    .    1    ]" 1 
       1152 1  59 ARG H    1  59 ARG QG   3.100     . 4.200 3.863 3.227 4.083     .  0 0 "[    .    1    ]" 1 
       1153 1  59 ARG H    1  60 GLN H    2.600     . 3.500 2.382 2.194 2.614     .  0 0 "[    .    1    ]" 1 
       1154 1  59 ARG H    1  60 GLN HA   3.600     . 5.500 5.021 4.891 5.176     .  0 0 "[    .    1    ]" 1 
       1155 1  59 ARG H    1  60 GLN QB   3.600     . 5.500 4.299 3.793 4.649     .  0 0 "[    .    1    ]" 1 
       1156 1  59 ARG H    1  60 GLN QG   3.700     . 5.500 4.250 3.642 5.171     .  0 0 "[    .    1    ]" 1 
       1157 1  59 ARG H    1  61 SER H    3.400     . 5.500 3.632 3.449 3.956     .  0 0 "[    .    1    ]" 1 
       1158 1  59 ARG H    1  61 SER H    2.900     . 3.900 3.479 3.353 3.706     .  0 0 "[    .    1    ]" 1 
       1159 1  59 ARG HA   1  59 ARG QB   2.100     . 2.800 2.475 2.343 2.540     .  0 0 "[    .    1    ]" 1 
       1160 1  59 ARG HA   1  59 ARG QG   2.400     . 3.200 2.291 2.050 3.033     .  0 0 "[    .    1    ]" 1 
       1161 1  59 ARG HA   1  60 GLN H    2.900     . 3.900 3.542 3.461 3.574     .  0 0 "[    .    1    ]" 1 
       1162 1  59 ARG HA   1  61 SER H    2.200     . 4.500 2.262 2.096 2.633     .  0 0 "[    .    1    ]" 1 
       1163 1  59 ARG QB   1  59 ARG HD2  3.200     . 5.200 2.444 1.963 3.286     .  0 0 "[    .    1    ]" 1 
       1164 1  59 ARG QB   1  60 GLN H    3.000     . 4.000 2.486 2.209 2.842     .  0 0 "[    .    1    ]" 1 
       1165 1  59 ARG QB   1  60 GLN HA   2.300     . 4.500 3.860 3.618 4.256     .  0 0 "[    .    1    ]" 1 
       1166 1  59 ARG QB   1  60 GLN QB   2.800     . 4.400 3.964 3.702 4.222     .  0 0 "[    .    1    ]" 1 
       1167 1  59 ARG QB   1  61 SER H    3.400     . 5.500 4.407 4.284 4.594     .  0 0 "[    .    1    ]" 1 
       1168 1  59 ARG QG   1  60 GLN H    3.600     . 5.500 4.125 3.899 4.428     .  0 0 "[    .    1    ]" 1 
       1169 1  60 GLN H    1  60 GLN HA   2.400     . 3.200 2.809 2.740 2.918     .  0 0 "[    .    1    ]" 1 
       1170 1  60 GLN H    1  60 GLN QB   2.400     . 3.600 2.307 2.028 2.468     .  0 0 "[    .    1    ]" 1 
       1171 1  60 GLN H    1  60 GLN QG   3.100     . 3.800 2.626 2.186 3.275     .  0 0 "[    .    1    ]" 1 
       1172 1  60 GLN H    1  61 SER H    2.300     . 3.100 2.659 2.352 2.823     .  0 0 "[    .    1    ]" 1 
       1173 1  60 GLN HA   1  60 GLN QB   2.300     . 3.100 2.329 2.172 2.543     .  0 0 "[    .    1    ]" 1 
       1174 1  60 GLN HA   1  60 GLN QG   2.400     . 3.800 2.895 2.304 3.428     .  0 0 "[    .    1    ]" 1 
       1175 1  60 GLN HA   1  61 SER H    2.400     . 3.200 2.752 2.664 2.776     .  0 0 "[    .    1    ]" 1 
       1176 1  60 GLN QB   1  60 GLN QG   2.100     . 2.800 2.015 1.983 2.023     .  0 0 "[    .    1    ]" 1 
       1177 1  60 GLN QB   1  61 SER H    2.800 2.100 4.300 3.323 2.735 3.804     .  0 0 "[    .    1    ]" 1 
       1178 1  60 GLN QG   1  61 SER H    3.500     . 5.500 3.360 1.943 4.714     .  0 0 "[    .    1    ]" 1 
       1179 1  61 SER H    1  61 SER HA   2.300     . 3.400 2.903 2.858 2.941     .  0 0 "[    .    1    ]" 1 
       1180 1  61 SER H    1  62 ARG H    3.200     . 5.200 4.479 4.327 4.574     .  0 0 "[    .    1    ]" 1 
       1181 1  61 SER H    1  63 ARG H    3.500     . 5.500 4.292 3.847 4.585     .  0 0 "[    .    1    ]" 1 
       1182 1  61 SER HA   1  61 SER QB   2.000     . 2.700 2.452 2.190 2.529     .  0 0 "[    .    1    ]" 1 
       1183 1  61 SER HA   1  62 ARG H    2.200     . 3.000 2.392 2.166 2.549     .  0 0 "[    .    1    ]" 1 
       1184 1  61 SER HA   1  63 ARG HB3  2.900     . 4.600 4.925 4.770 5.053 0.453  4 0 "[    .    1    ]" 1 
       1185 1  61 SER HA   1  62 ARG QG   3.400     . 5.500 3.862 3.427 4.701     .  0 0 "[    .    1    ]" 1 
       1186 1  61 SER QB   1  62 ARG H    3.000 2.300 4.700 2.375 1.919 3.162 0.381  5 0 "[    .    1    ]" 1 
       1187 1  61 SER QB   1  62 ARG HA   2.800     . 4.400 3.977 3.703 4.268     .  0 0 "[    .    1    ]" 1 
       1188 1  61 SER QB   1  62 ARG QG   2.900     . 4.600 3.517 3.011 4.230     .  0 0 "[    .    1    ]" 1 
       1189 1  61 SER QB   1  63 ARG H    3.200 2.100 4.300 2.357 2.068 2.940 0.032  9 0 "[    .    1    ]" 1 
       1190 1  61 SER QB   1  63 ARG QG   2.900     . 4.600 2.713 1.851 3.703     .  0 0 "[    .    1    ]" 1 
       1191 1  62 ARG H    1  62 ARG HB2  2.700     . 3.600 3.562 3.385 3.637 0.037 13 0 "[    .    1    ]" 1 
       1192 1  62 ARG H    1  62 ARG HB3  3.200 2.100 4.300 2.799 2.319 3.486     .  0 0 "[    .    1    ]" 1 
       1193 1  62 ARG H    1  62 ARG QD   3.500     . 5.500 3.153 1.912 4.126     .  0 0 "[    .    1    ]" 1 
       1194 1  62 ARG H    1  62 ARG QG   3.000     . 4.000 2.258 1.940 3.362 0.060 14 0 "[    .    1    ]" 1 
       1195 1  62 ARG H    1  63 ARG H    2.600     . 3.500 2.670 2.319 2.936     .  0 0 "[    .    1    ]" 1 
       1196 1  62 ARG HA   1  62 ARG HG2  2.300     . 3.100 2.337 1.972 2.965     .  0 0 "[    .    1    ]" 1 
       1197 1  62 ARG HA   1  62 ARG HB2  2.300     . 3.100 2.527 2.355 2.791     .  0 0 "[    .    1    ]" 1 
       1198 1  62 ARG HA   1  62 ARG HB3  2.400     . 3.200 2.398 2.236 2.555     .  0 0 "[    .    1    ]" 1 
       1199 1  62 ARG HA   1  62 ARG QD   2.400     . 4.500 3.818 3.595 4.075     .  0 0 "[    .    1    ]" 1 
       1200 1  62 ARG HA   1  62 ARG HE   2.800     . 4.400 2.928 2.067 4.066     .  0 0 "[    .    1    ]" 1 
       1201 1  62 ARG HA   1  62 ARG HE   3.000     . 4.000 2.924 2.066 4.051 0.051  4 0 "[    .    1    ]" 1 
       1202 1  62 ARG HA   1  62 ARG QG   2.200     . 4.500 3.357 3.188 3.449     .  0 0 "[    .    1    ]" 1 
       1203 1  62 ARG HA   1  62 ARG HG2  2.300     . 3.100 2.379 2.032 3.192 0.092  8 0 "[    .    1    ]" 1 
       1204 1  62 ARG HA   1  63 ARG H    2.200     . 3.000 2.603 2.516 2.634     .  0 0 "[    .    1    ]" 1 
       1205 1  62 ARG HB2  1  62 ARG QD   2.800     . 4.400 2.351 1.926 3.488     .  0 0 "[    .    1    ]" 1 
       1206 1  62 ARG HB2  1  62 ARG QG   2.300     . 3.100 2.424 2.159 2.525     .  0 0 "[    .    1    ]" 1 
       1207 1  62 ARG HB3  1  62 ARG QD   2.700     . 4.200 3.145 2.187 3.437     .  0 0 "[    .    1    ]" 1 
       1208 1  62 ARG HB3  1  62 ARG QG   2.300     . 3.100 2.178 2.132 2.401     .  0 0 "[    .    1    ]" 1 
       1209 1  62 ARG HB3  1  63 ARG H    3.200 2.100 4.300 4.301 3.992 4.674 0.374  5 0 "[    .    1    ]" 1 
       1210 1  62 ARG QD   1  62 ARG QG   1.800     . 2.400 1.718 1.669 1.775     .  0 0 "[    .    1    ]" 1 
       1211 1  62 ARG QD   1  63 ARG QB   3.000     . 4.800 4.469 3.793 4.780     .  0 0 "[    .    1    ]" 1 
       1212 1  62 ARG QD   1  64 ARG H    3.300     . 5.500 4.656 3.627 5.516 0.016  9 0 "[    .    1    ]" 1 
       1213 1  62 ARG HD3  1  64 ARG H    3.300 2.100 4.500 3.597 2.431 4.358     .  0 0 "[    .    1    ]" 1 
       1214 1  63 ARG H    1  63 ARG QB   2.200     . 3.000 2.332 2.177 2.491     .  0 0 "[    .    1    ]" 1 
       1215 1  63 ARG H    1  63 ARG QD   3.100     . 5.000 3.748 1.942 4.356     .  0 0 "[    .    1    ]" 1 
       1216 1  63 ARG H    1  64 ARG H    3.000     . 4.800 4.263 3.689 4.656     .  0 0 "[    .    1    ]" 1 
       1217 1  63 ARG HA   1  63 ARG QB   2.300     . 3.100 2.421 2.179 2.511     .  0 0 "[    .    1    ]" 1 
       1218 1  63 ARG HA   1  63 ARG QD   2.600     . 4.000 2.435 1.922 3.670     .  0 0 "[    .    1    ]" 1 
       1219 1  63 ARG HA   1  63 ARG QG   2.600     . 3.500 2.774 2.570 3.494     .  0 0 "[    .    1    ]" 1 
       1220 1  63 ARG HA   1  64 ARG H    2.000     . 2.700 2.299 2.149 2.562     .  0 0 "[    .    1    ]" 1 
       1221 1  63 ARG HA   1  64 ARG HA   2.900     . 4.600 4.487 4.395 4.616 0.016  1 0 "[    .    1    ]" 1 
       1222 1  63 ARG QB   1  63 ARG QD   2.600     . 3.500 2.260 2.090 2.447     .  0 0 "[    .    1    ]" 1 
       1223 1  63 ARG HB2  1  63 ARG HE   2.800     . 3.800 2.940 1.976 3.884 0.084 13 0 "[    .    1    ]" 1 
       1224 1  63 ARG QD   1  63 ARG HE   2.900     . 3.900 2.048 1.920 2.150     .  0 0 "[    .    1    ]" 1 
       1225 1  63 ARG QD   1  63 ARG QG   2.000     . 2.700 2.035 2.022 2.057     .  0 0 "[    .    1    ]" 1 
       1226 1  63 ARG QG   1  64 ARG H    3.300 2.100 4.500 3.934 3.532 4.092     .  0 0 "[    .    1    ]" 1 
       1227 1  64 ARG H    1  64 ARG HA   2.600     . 3.500 2.876 2.710 2.948     .  0 0 "[    .    1    ]" 1 
       1228 1  64 ARG H    1  64 ARG QB   2.200     . 3.000 2.516 2.119 2.890     .  0 0 "[    .    1    ]" 1 
       1229 1  64 ARG HA   1  64 ARG QB   2.500     . 3.400 2.276 2.177 2.524     .  0 0 "[    .    1    ]" 1 
       1230 1  64 ARG HA   1  65 PRO HG3  2.500     . 3.400 2.978 2.810 3.385     .  0 0 "[    .    1    ]" 1 
       1231 1  64 ARG QB   1  66 VAL HA   2.700     . 4.500 4.369 4.075 4.606 0.106  2 0 "[    .    1    ]" 1 
       1232 1  64 ARG QB   1  66 VAL QG   2.900     . 4.600 3.664 3.556 3.777     .  0 0 "[    .    1    ]" 1 
       1233 1  64 ARG QG   1  66 VAL HA   2.700     . 4.200 4.096 3.911 4.267 0.067  8 0 "[    .    1    ]" 1 
       1234 1  65 PRO HA   1  65 PRO HB2  2.400     . 3.200 2.904 2.671 2.987     .  0 0 "[    .    1    ]" 1 
       1235 1  65 PRO HA   1  65 PRO HB3  2.100     . 2.800 2.296 2.247 2.324     .  0 0 "[    .    1    ]" 1 
       1236 1  65 PRO HA   1  66 VAL H    2.100     . 2.800 2.323 2.180 2.530     .  0 0 "[    .    1    ]" 1 
       1237 1  65 PRO HA   1  66 VAL QG   2.800     . 4.400 3.852 3.311 4.191     .  0 0 "[    .    1    ]" 1 
       1238 1  65 PRO HA   1  66 VAL QG   2.500     . 3.400 2.429 2.120 2.985     .  0 0 "[    .    1    ]" 1 
       1239 1  65 PRO HB2  1  66 VAL H    2.800     . 3.800 3.225 2.287 3.589     .  0 0 "[    .    1    ]" 1 
       1240 1  65 PRO HB2  1  66 VAL HA   3.000     . 4.800 3.681 3.184 3.912     .  0 0 "[    .    1    ]" 1 
       1241 1  65 PRO HB3  1  66 VAL H    2.800     . 3.800 3.079 2.755 3.716     .  0 0 "[    .    1    ]" 1 
       1242 1  66 VAL H    1  66 VAL HA   2.700     . 3.600 2.934 2.859 2.947     .  0 0 "[    .    1    ]" 1 
       1243 1  66 VAL H    1  66 VAL HB   2.500     . 3.400 3.051 2.753 3.558 0.158  1 0 "[    .    1    ]" 1 
       1244 1  66 VAL H    1  66 VAL QG   3.000     . 3.500 2.218 1.850 2.590     .  0 0 "[    .    1    ]" 1 
       1245 1  66 VAL H    1  67 ARG H    3.400     . 5.500 4.310 4.073 4.541     .  0 0 "[    .    1    ]" 1 
       1246 1  66 VAL H    1  88 ILE MD   3.600     . 5.500 4.671 4.090 5.209     .  0 0 "[    .    1    ]" 1 
       1247 1  66 VAL HA   1  66 VAL HB   2.700     . 3.600 2.551 2.492 2.635     .  0 0 "[    .    1    ]" 1 
       1248 1  66 VAL HA   1  66 VAL QG   2.000     . 2.800 2.119 1.990 2.280     .  0 0 "[    .    1    ]" 1 
       1249 1  66 VAL HA   1  66 VAL QG   2.200     . 3.000 1.919 1.842 2.002     .  0 0 "[    .    1    ]" 1 
       1250 1  66 VAL HA   1  67 ARG H    2.000     . 2.700 2.359 2.139 2.682     .  0 0 "[    .    1    ]" 1 
       1251 1  66 VAL HA   1  88 ILE MD   2.200     . 3.200 3.198 3.097 3.273 0.073  1 0 "[    .    1    ]" 1 
       1252 1  66 VAL HA   1  88 ILE MD   2.400     . 4.500 3.667 3.584 3.755     .  0 0 "[    .    1    ]" 1 
       1253 1  66 VAL HB   1  66 VAL QG   2.100     . 2.800 1.871 1.856 1.888     .  0 0 "[    .    1    ]" 1 
       1254 1  66 VAL HB   1  66 VAL QG   2.100     . 2.800 1.862 1.848 1.878     .  0 0 "[    .    1    ]" 1 
       1255 1  66 VAL HB   1  67 ARG H    3.400     . 5.500 3.853 1.961 4.444     .  0 0 "[    .    1    ]" 1 
       1256 1  66 VAL HB   1  79 VAL MG2  2.200     . 4.500 4.471 3.998 4.568 0.068  6 0 "[    .    1    ]" 1 
       1257 1  66 VAL HB   1  88 ILE MD   3.000     . 4.800 2.733 2.369 3.244     .  0 0 "[    .    1    ]" 1 
       1258 1  66 VAL MG1  1  66 VAL MG2  1.700     . 2.300 2.001 1.919 2.094     .  0 0 "[    .    1    ]" 1 
       1259 1  66 VAL QG   1  67 ARG H    2.600 2.200 3.500 2.471 1.819 3.061 0.381  3 0 "[    .    1    ]" 1 
       1260 1  66 VAL QG   1  67 ARG HB3  2.700     . 3.600 3.327 3.067 3.488     .  0 0 "[    .    1    ]" 1 
       1261 1  66 VAL QG   1  79 VAL MG2  2.700     . 3.800 2.364 2.228 2.543     .  0 0 "[    .    1    ]" 1 
       1262 1  66 VAL QG   1  79 VAL MG2  1.900     . 4.500 2.344 2.219 2.499     .  0 0 "[    .    1    ]" 1 
       1263 1  66 VAL QG   1  81 ASP H    3.300     . 5.500 3.683 3.051 4.171     .  0 0 "[    .    1    ]" 1 
       1264 1  66 VAL QG   1  81 ASP HA   3.100     . 5.000 2.496 2.129 3.393     .  0 0 "[    .    1    ]" 1 
       1265 1  66 VAL QG   1  81 ASP QB   2.700     . 3.500 1.971 1.856 2.267     .  0 0 "[    .    1    ]" 1 
       1266 1  66 VAL QG   1  82 ASP H    3.200     . 5.200 3.693 3.182 4.670     .  0 0 "[    .    1    ]" 1 
       1267 1  66 VAL QG   1  88 ILE MD   2.300     . 2.800 1.714 1.620 1.793     .  0 0 "[    .    1    ]" 1 
       1268 1  66 VAL QG   1  88 ILE MD   1.500     . 2.200 1.652 1.562 1.742     .  0 0 "[    .    1    ]" 1 
       1269 1  66 VAL QG   1  88 ILE QG   2.600     . 3.500 3.100 2.871 3.242     .  0 0 "[    .    1    ]" 1 
       1270 1  67 ARG C    1  82 ASP N    4.100 3.800 4.400 3.872 3.784 4.029 0.016 10 0 "[    .    1    ]" 1 
       1271 1  67 ARG H    1  67 ARG HA   2.800     . 3.800 2.882 2.841 2.931     .  0 0 "[    .    1    ]" 1 
       1272 1  67 ARG H    1  67 ARG HB2  2.600     . 3.500 2.802 2.211 3.380     .  0 0 "[    .    1    ]" 1 
       1273 1  67 ARG H    1  67 ARG HB3  2.500     . 3.400 2.849 2.591 3.201     .  0 0 "[    .    1    ]" 1 
       1274 1  67 ARG H    1  67 ARG QD   3.400     . 5.500 4.603 4.322 5.000     .  0 0 "[    .    1    ]" 1 
       1275 1  67 ARG H    1  67 ARG QG   2.700     . 4.200 4.058 3.762 4.284 0.084  3 0 "[    .    1    ]" 1 
       1276 1  67 ARG H    1  68 GLY H    3.400     . 5.500 3.418 2.928 3.971     .  0 0 "[    .    1    ]" 1 
       1277 1  67 ARG H    1  81 ASP QB   3.500     . 5.500 4.146 3.220 4.988     .  0 0 "[    .    1    ]" 1 
       1278 1  67 ARG HA   1  67 ARG HB2  2.700     . 3.600 2.561 2.438 2.765     .  0 0 "[    .    1    ]" 1 
       1279 1  67 ARG HA   1  67 ARG HB3  2.700     . 3.600 3.007 2.924 3.028     .  0 0 "[    .    1    ]" 1 
       1280 1  67 ARG HA   1  67 ARG QD   2.800     . 4.400 3.797 3.119 4.035     .  0 0 "[    .    1    ]" 1 
       1281 1  67 ARG HA   1  67 ARG QG   2.500     . 3.400 2.305 2.074 2.409     .  0 0 "[    .    1    ]" 1 
       1282 1  67 ARG HA   1  68 GLY H    2.100     . 2.800 2.378 2.219 2.518     .  0 0 "[    .    1    ]" 1 
       1283 1  67 ARG HA   1  68 GLY HA2  2.200     . 4.500 4.382 4.343 4.443     .  0 0 "[    .    1    ]" 1 
       1284 1  67 ARG HB2  1  67 ARG QD   2.700     . 3.600 2.593 2.007 3.068     .  0 0 "[    .    1    ]" 1 
       1285 1  67 ARG HB2  1  67 ARG QG   2.100     . 3.000 2.284 2.130 2.524     .  0 0 "[    .    1    ]" 1 
       1286 1  67 ARG HB2  1  68 GLY H    3.000     . 4.800 4.641 4.573 4.672     .  0 0 "[    .    1    ]" 1 
       1287 1  67 ARG HB3  1  68 GLY H    3.100     . 5.000 4.395 4.153 4.488     .  0 0 "[    .    1    ]" 1 
       1288 1  67 ARG HB3  1  82 ASP QB   3.100     . 5.000 3.807 3.306 4.283     .  0 0 "[    .    1    ]" 1 
       1289 1  67 ARG HB3  1  83 GLU QB   2.900     . 4.600 4.218 3.409 4.620 0.020  3 0 "[    .    1    ]" 1 
       1290 1  67 ARG QD   1  67 ARG QG   2.100     . 2.800 2.052 2.013 2.089     .  0 0 "[    .    1    ]" 1 
       1291 1  67 ARG QD   1  68 GLY H    3.700     . 5.500 5.270 4.875 5.550 0.050  2 0 "[    .    1    ]" 1 
       1292 1  67 ARG QG   1  82 ASP HB2  2.900     . 4.600 4.135 3.759 4.655 0.055  9 0 "[    .    1    ]" 1 
       1293 1  67 ARG QG   1  68 GLY H    3.200 2.100 4.300 3.809 3.389 4.032     .  0 0 "[    .    1    ]" 1 
       1294 1  67 ARG QG   1  68 GLY HA2  2.900     . 4.600 4.310 3.853 4.628 0.028  2 0 "[    .    1    ]" 1 
       1295 1  67 ARG HG3  1 129 CYS HB2  3.200     . 5.200 4.597 3.926 5.485 0.285  1 0 "[    .    1    ]" 1 
       1296 1  67 ARG O    1  82 ASP N    3.000 2.800 3.200 3.105 2.780 3.210 0.020  2 0 "[    .    1    ]" 1 
       1297 1  68 GLY H    1  68 GLY HA2  2.900     . 3.900 2.937 2.897 2.956     .  0 0 "[    .    1    ]" 1 
       1298 1  68 GLY H    1  68 GLY HA3  2.800     . 3.800 2.574 2.457 2.703     .  0 0 "[    .    1    ]" 1 
       1299 1  68 GLY H    1  69 LEU H    3.300     . 5.500 4.125 3.870 4.349     .  0 0 "[    .    1    ]" 1 
       1300 1  68 GLY H    1  69 LEU H    3.000     . 4.000 3.564 3.490 3.644     .  0 0 "[    .    1    ]" 1 
       1301 1  68 GLY H    1  69 LEU QD   2.900     . 4.600 2.450 1.971 3.215     .  0 0 "[    .    1    ]" 1 
       1302 1  68 GLY H    1  81 ASP HA   3.500     . 5.500 3.847 3.393 4.248     .  0 0 "[    .    1    ]" 1 
       1303 1  68 GLY H    1  81 ASP QB   3.800     . 5.500 4.137 4.029 4.282     .  0 0 "[    .    1    ]" 1 
       1304 1  68 GLY HA2  1  69 LEU H    2.600     . 3.500 2.940 2.688 3.160     .  0 0 "[    .    1    ]" 1 
       1305 1  68 GLY HA2  1  82 ASP H    2.600     . 3.500 2.425 1.956 2.981     .  0 0 "[    .    1    ]" 1 
       1306 1  68 GLY HA3  1  69 LEU H    2.400     . 3.200 2.250 2.143 2.428     .  0 0 "[    .    1    ]" 1 
       1307 1  68 GLY HA3  1  82 ASP H    2.900     . 3.900 2.757 2.301 3.323     .  0 0 "[    .    1    ]" 1 
       1308 1  69 LEU C    1  80 VAL N    4.100 3.800 4.400 4.169 3.920 4.313     .  0 0 "[    .    1    ]" 1 
       1309 1  69 LEU H    1  69 LEU QB   2.500     . 3.400 2.445 2.291 2.626     .  0 0 "[    .    1    ]" 1 
       1310 1  69 LEU H    1  69 LEU QD   2.800     . 3.800 3.048 2.353 3.431     .  0 0 "[    .    1    ]" 1 
       1311 1  69 LEU H    1  70 LEU QB   3.200     . 5.200 3.885 2.992 4.948     .  0 0 "[    .    1    ]" 1 
       1312 1  69 LEU H    1  88 ILE MD   3.100     . 5.000 3.746 3.281 4.089     .  0 0 "[    .    1    ]" 1 
       1313 1  69 LEU H    1  79 VAL HA   3.300     . 5.500 4.651 3.976 5.035     .  0 0 "[    .    1    ]" 1 
       1314 1  69 LEU H    1  79 VAL MG2  3.200 2.100 4.300 3.845 3.005 4.315 0.015  9 0 "[    .    1    ]" 1 
       1315 1  69 LEU H    1  80 VAL H    2.800     . 3.800 3.276 2.607 3.801 0.001  9 0 "[    .    1    ]" 1 
       1316 1  69 LEU H    1  81 ASP HA   3.100     . 5.000 3.807 3.638 3.967     .  0 0 "[    .    1    ]" 1 
       1317 1  69 LEU H    1  82 ASP H    3.300     . 5.500 4.487 4.072 4.989     .  0 0 "[    .    1    ]" 1 
       1318 1  69 LEU H    1  82 ASP QB   3.400     . 5.500 4.355 3.511 5.340     .  0 0 "[    .    1    ]" 1 
       1319 1  69 LEU HA   1  69 LEU QD   2.200     . 3.000 2.211 1.877 2.922     .  0 0 "[    .    1    ]" 1 
       1320 1  69 LEU HA   1  70 LEU H    2.300     . 3.100 2.174 2.138 2.263     .  0 0 "[    .    1    ]" 1 
       1321 1  69 LEU QB   1  69 LEU QD   2.100     . 2.800 1.901 1.728 1.979     .  0 0 "[    .    1    ]" 1 
       1322 1  69 LEU QB   1  70 LEU H    3.100     . 5.000 3.486 2.645 3.849     .  0 0 "[    .    1    ]" 1 
       1323 1  69 LEU QB   1  79 VAL HA   2.900     . 4.600 4.408 4.272 4.558     .  0 0 "[    .    1    ]" 1 
       1324 1  69 LEU QB   1  79 VAL MG2  3.300     . 5.500 4.310 4.164 4.502     .  0 0 "[    .    1    ]" 1 
       1325 1  69 LEU QB   1  80 VAL H    3.200     . 5.200 4.107 3.760 4.740     .  0 0 "[    .    1    ]" 1 
       1326 1  69 LEU HB3  1  80 VAL HA   3.300     . 5.500 4.591 3.717 4.945     .  0 0 "[    .    1    ]" 1 
       1327 1  69 LEU MD1  1  69 LEU MD2  1.700     . 2.300 2.004 1.911 2.072     .  0 0 "[    .    1    ]" 1 
       1328 1  69 LEU QD   1  70 LEU QD   2.700     . 3.600 2.503 1.965 2.847     .  0 0 "[    .    1    ]" 1 
       1329 1  69 LEU QD   1  70 LEU H    2.700     . 3.600 2.455 1.971 3.226     .  0 0 "[    .    1    ]" 1 
       1330 1  69 LEU QD   1  71 HIS H    3.000     . 4.800 3.475 2.302 3.811     .  0 0 "[    .    1    ]" 1 
       1331 1  69 LEU QD   1  82 ASP HA   3.300     . 5.500 3.952 3.635 4.304     .  0 0 "[    .    1    ]" 1 
       1332 1  69 LEU QD   1 139 ALA MB   2.700     . 4.500 2.748 2.534 3.702     .  0 0 "[    .    1    ]" 1 
       1333 1  69 LEU N    1  80 VAL C    4.100 3.800 4.400 4.067 3.888 4.240     .  0 0 "[    .    1    ]" 1 
       1334 1  69 LEU N    1  80 VAL O    3.000 2.800 3.200 2.961 2.776 3.206 0.024  7 0 "[    .    1    ]" 1 
       1335 1  69 LEU O    1  80 VAL N    3.000 2.800 3.200 3.107 2.838 3.222 0.022  9 0 "[    .    1    ]" 1 
       1336 1  70 LEU H    1  70 LEU QB   2.800     . 3.800 2.246 2.146 2.391     .  0 0 "[    .    1    ]" 1 
       1337 1  70 LEU H    1  70 LEU QD   3.300     . 5.500 3.549 3.472 3.653     .  0 0 "[    .    1    ]" 1 
       1338 1  70 LEU H    1  70 LEU QD   3.300     . 5.500 3.450 2.925 3.682     .  0 0 "[    .    1    ]" 1 
       1339 1  70 LEU H    1  71 HIS H    3.500     . 5.500 4.235 3.984 4.446     .  0 0 "[    .    1    ]" 1 
       1340 1  70 LEU H    1 136 LEU HG   3.500     . 5.500 5.364 5.026 5.572 0.072 10 0 "[    .    1    ]" 1 
       1341 1  70 LEU HA   1  70 LEU QD   2.400     . 3.200 2.136 1.831 3.012     .  0 0 "[    .    1    ]" 1 
       1342 1  70 LEU HA   1  71 HIS H    2.400     . 3.200 2.176 2.125 2.280     .  0 0 "[    .    1    ]" 1 
       1343 1  70 LEU HA   1  78 ARG H    3.600     . 5.500 4.749 4.195 5.377     .  0 0 "[    .    1    ]" 1 
       1344 1  70 LEU HA   1  79 VAL HA   2.500     . 3.400 2.129 1.923 2.587     .  0 0 "[    .    1    ]" 1 
       1345 1  70 LEU HA   1  80 VAL H    3.400     . 5.500 3.545 3.069 4.190     .  0 0 "[    .    1    ]" 1 
       1346 1  70 LEU QB   1  70 LEU QD   2.600     . 3.500 1.950 1.855 2.045     .  0 0 "[    .    1    ]" 1 
       1347 1  70 LEU HB2  1  88 ILE MD   2.900     . 4.600 4.592 4.435 4.640 0.040  5 0 "[    .    1    ]" 1 
       1348 1  70 LEU MD1  1  70 LEU MD2  2.100     . 2.800 2.012 1.877 2.085     .  0 0 "[    .    1    ]" 1 
       1349 1  70 LEU QD   1  71 HIS H    2.700     . 4.200 2.707 2.120 3.104     .  0 0 "[    .    1    ]" 1 
       1350 1  70 LEU QD   1  71 HIS H    2.900     . 3.900 2.685 2.116 3.065     .  0 0 "[    .    1    ]" 1 
       1351 1  70 LEU QD   1  71 HIS QB   2.600     . 4.000 3.664 3.447 3.804     .  0 0 "[    .    1    ]" 1 
       1352 1  70 LEU QD   1  72 VAL HA   2.600     . 4.500 3.634 3.086 4.202     .  0 0 "[    .    1    ]" 1 
       1353 1  70 LEU QD   1  78 ARG H    3.100     . 4.200 3.056 2.585 3.630     .  0 0 "[    .    1    ]" 1 
       1354 1  70 LEU QD   1 140 VAL QG   2.600     . 3.500 1.656 1.500 1.852 0.200  8 0 "[    .    1    ]" 1 
       1355 1  70 LEU QD   1  72 VAL QG   2.400     . 3.600 2.031 1.661 2.405     .  0 0 "[    .    1    ]" 1 
       1356 1  70 LEU QD   1  77 LEU HA   2.600     . 4.000 2.618 2.315 3.067     .  0 0 "[    .    1    ]" 1 
       1357 1  70 LEU QD   1  77 LEU QD   2.700     . 4.200 2.591 1.981 3.036     .  0 0 "[    .    1    ]" 1 
       1358 1  70 LEU QD   1  77 LEU QD   2.500     . 3.400 1.999 1.744 2.365     .  0 0 "[    .    1    ]" 1 
       1359 1  70 LEU QD   1  78 ARG H    2.800     . 4.400 3.135 2.625 3.778     .  0 0 "[    .    1    ]" 1 
       1360 1  70 LEU QD   1  79 VAL H    3.300 2.100 4.500 2.873 2.564 3.116     .  0 0 "[    .    1    ]" 1 
       1361 1  70 LEU QD   1  79 VAL H    2.900     . 4.600 3.091 2.346 3.623     .  0 0 "[    .    1    ]" 1 
       1362 1  70 LEU MD1  1  70 LEU MD2  2.000     . 2.700 1.743 1.642 1.803     .  0 0 "[    .    1    ]" 1 
       1363 1  70 LEU QD   1 109 PHE H    3.600     . 5.500 4.838 3.504 5.405     .  0 0 "[    .    1    ]" 1 
       1364 1  70 LEU QD   1 136 LEU HG   2.200     . 4.500 2.516 1.844 4.410     .  0 0 "[    .    1    ]" 1 
       1365 1  71 HIS H    1  71 HIS HB3  2.700     . 3.600 3.460 3.055 3.600 0.000 14 0 "[    .    1    ]" 1 
       1366 1  71 HIS H    1  71 HIS HD2  3.200     . 5.200 3.291 2.407 4.492     .  0 0 "[    .    1    ]" 1 
       1367 1  71 HIS H    1  72 VAL H    3.500     . 5.500 4.154 3.695 4.439     .  0 0 "[    .    1    ]" 1 
       1368 1  71 HIS H    1  78 ARG H    3.000     . 4.000 3.417 2.901 3.868     .  0 0 "[    .    1    ]" 1 
       1369 1  71 HIS H    1  78 ARG QB   3.300     . 5.500 3.535 3.359 3.807     .  0 0 "[    .    1    ]" 1 
       1370 1  71 HIS H    1  79 VAL HA   3.000     . 4.000 2.877 2.614 3.243     .  0 0 "[    .    1    ]" 1 
       1371 1  71 HIS H    1  80 VAL H    3.500     . 5.500 3.760 3.079 4.286     .  0 0 "[    .    1    ]" 1 
       1372 1  71 HIS HA   1  72 VAL H    2.400     . 3.200 2.248 2.119 2.506     .  0 0 "[    .    1    ]" 1 
       1373 1  71 HIS QB   1  77 LEU H    3.700     . 5.500 5.310 4.907 5.546 0.046  6 0 "[    .    1    ]" 1 
       1374 1  71 HIS QB   1  78 ARG H    3.100     . 4.200 2.731 1.997 3.103 0.003 11 0 "[    .    1    ]" 1 
       1375 1  71 HIS HB3  1  79 VAL H    3.500     . 5.500 5.242 4.580 5.546 0.046  2 0 "[    .    1    ]" 1 
       1376 1  71 HIS HB3  1  87 LEU QD   3.100     . 5.000 2.534 1.845 3.197     .  0 0 "[    .    1    ]" 1 
       1377 1  71 HIS HD2  1  80 VAL H    3.500     . 5.500 3.900 2.605 5.208     .  0 0 "[    .    1    ]" 1 
       1378 1  71 HIS HD2  1  80 VAL QG   2.200     . 3.000 2.509 1.932 2.970     .  0 0 "[    .    1    ]" 1 
       1379 1  71 HIS N    1  78 ARG C    4.100 3.800 4.400 3.826 3.779 3.900 0.021 10 0 "[    .    1    ]" 1 
       1380 1  71 HIS N    1  78 ARG O    3.000 2.800 3.200 3.069 2.800 3.207 0.007  1 0 "[    .    1    ]" 1 
       1381 1  72 VAL H    1  72 VAL HB   2.700     . 3.600 2.650 2.453 3.625 0.025  7 0 "[    .    1    ]" 1 
       1382 1  72 VAL H    1  72 VAL QG   2.700     . 3.600 2.484 1.860 2.741     .  0 0 "[    .    1    ]" 1 
       1383 1  72 VAL H    1  77 LEU H    3.500     . 5.500 5.352 5.074 5.534 0.034  9 0 "[    .    1    ]" 1 
       1384 1  72 VAL H    1  78 ARG H    3.400     . 5.500 4.543 4.356 4.734     .  0 0 "[    .    1    ]" 1 
       1385 1  72 VAL H    1  78 ARG QB   3.500     . 5.500 5.471 5.333 5.564 0.064  3 0 "[    .    1    ]" 1 
       1386 1  72 VAL H    1 139 ALA MB   3.000     . 4.800 4.102 3.879 4.336     .  0 0 "[    .    1    ]" 1 
       1387 1  72 VAL HA   1  72 VAL HB   2.400     . 3.200 2.652 2.243 2.690     .  0 0 "[    .    1    ]" 1 
       1388 1  72 VAL HA   1  72 VAL QG   2.400     . 3.100 2.148 2.024 2.501     .  0 0 "[    .    1    ]" 1 
       1389 1  72 VAL HA   1  73 SER H    2.100     . 2.800 2.230 2.148 2.607     .  0 0 "[    .    1    ]" 1 
       1390 1  72 VAL HA   1  74 GLY H    2.800     . 4.400 3.813 3.386 4.428 0.028  7 0 "[    .    1    ]" 1 
       1391 1  72 VAL HA   1  77 LEU H    3.100     . 5.000 3.990 3.392 4.381     .  0 0 "[    .    1    ]" 1 
       1392 1  72 VAL HA   1  77 LEU HA   2.900     . 3.900 3.033 2.277 3.397     .  0 0 "[    .    1    ]" 1 
       1393 1  72 VAL HA   1  77 LEU QD   2.400     . 3.200 2.538 2.191 2.808     .  0 0 "[    .    1    ]" 1 
       1394 1  72 VAL HA   1  77 LEU QD   3.000     . 4.800 2.512 2.180 2.790     .  0 0 "[    .    1    ]" 1 
       1395 1  72 VAL HA   1  78 ARG H    3.100     . 5.000 4.144 3.474 4.626     .  0 0 "[    .    1    ]" 1 
       1396 1  72 VAL HA   1 139 ALA MB   3.100     . 5.000 4.378 3.507 5.046 0.046  7 0 "[    .    1    ]" 1 
       1397 1  72 VAL QG   1  73 SER H    2.700     . 3.600 2.804 1.892 3.352     .  0 0 "[    .    1    ]" 1 
       1398 1  72 VAL QG   1  73 SER HA   2.400     . 3.600 3.514 3.082 3.638 0.038  3 0 "[    .    1    ]" 1 
       1399 1  72 VAL QG   1  74 GLY H    3.200 2.100 4.300 2.293 2.089 2.695 0.011 13 0 "[    .    1    ]" 1 
       1400 1  72 VAL QG   1  75 ASP H    3.600     . 5.500 4.253 3.519 4.833     .  0 0 "[    .    1    ]" 1 
       1401 1  72 VAL QG   1  76 GLY H    3.500     . 5.500 4.745 4.067 5.236     .  0 0 "[    .    1    ]" 1 
       1402 1  72 VAL QG   1  77 LEU HA   3.300     . 5.500 3.466 3.087 3.868     .  0 0 "[    .    1    ]" 1 
       1403 1  72 VAL QG   1 111 TYR QE   2.500     . 4.500 4.331 4.230 4.462     .  0 0 "[    .    1    ]" 1 
       1404 1  72 VAL QG   1 136 LEU HA   2.900     . 4.600 2.673 2.037 3.314     .  0 0 "[    .    1    ]" 1 
       1405 1  72 VAL QG   1 139 ALA H    3.100     . 5.000 3.725 3.575 3.852     .  0 0 "[    .    1    ]" 1 
       1406 1  72 VAL QG   1 139 ALA MB   2.400     . 3.200 2.734 2.538 2.880     .  0 0 "[    .    1    ]" 1 
       1407 1  72 VAL QG   1 140 VAL H    2.500     . 3.800 1.935 1.865 2.545     .  0 0 "[    .    1    ]" 1 
       1408 1  72 VAL QG   1 136 LEU HG   2.500     . 3.800 1.803 1.619 2.593     .  0 0 "[    .    1    ]" 1 
       1409 1  72 VAL QG   1 139 ALA MB   2.400     . 3.200 2.795 2.557 3.061     .  0 0 "[    .    1    ]" 1 
       1410 1  72 VAL QG   1 140 VAL H    2.400     . 4.500 1.937 1.865 2.555     .  0 0 "[    .    1    ]" 1 
       1411 1  72 VAL QG   1 140 VAL HA   2.500     . 3.400 2.027 1.802 2.650     .  0 0 "[    .    1    ]" 1 
       1412 1  72 VAL QG   1 140 VAL HA   2.500     . 3.400 1.802 1.685 2.021     .  0 0 "[    .    1    ]" 1 
       1413 1  72 VAL QG   1 140 VAL MG1  2.200     . 3.000 1.863 1.654 2.030     .  0 0 "[    .    1    ]" 1 
       1414 1  72 VAL QG   1 143 ALA MB   2.700     . 3.600 1.741 1.614 2.424 0.186  3 0 "[    .    1    ]" 1 
       1415 1  72 VAL QG   1 143 ALA MB   2.700     . 2.700 1.810 1.620 2.643 0.180  3 0 "[    .    1    ]" 1 
       1416 1  73 SER H    1  73 SER HA   2.800     . 3.800 2.921 2.805 2.946     .  0 0 "[    .    1    ]" 1 
       1417 1  73 SER H    1  73 SER QB   3.100     . 5.000 3.029 2.617 3.315     .  0 0 "[    .    1    ]" 1 
       1418 1  73 SER H    1  74 GLY H    3.700     . 5.500 2.495 1.913 2.989     .  0 0 "[    .    1    ]" 1 
       1419 1  73 SER H    1  75 ASP H    2.600     . 4.000 3.140 2.885 3.836     .  0 0 "[    .    1    ]" 1 
       1420 1  73 SER H    1  76 GLY H    2.800     . 3.800 3.282 3.019 3.512     .  0 0 "[    .    1    ]" 1 
       1421 1  73 SER H    1  77 LEU HA   3.400 2.200 4.600 4.143 3.800 4.405     .  0 0 "[    .    1    ]" 1 
       1422 1  73 SER H    1  77 LEU QD   2.800     . 3.800 3.517 2.988 3.775     .  0 0 "[    .    1    ]" 1 
       1423 1  73 SER H    1  77 LEU QD   3.500     . 5.500 3.462 2.958 3.709     .  0 0 "[    .    1    ]" 1 
       1424 1  73 SER H    1 143 ALA MB   3.500     . 5.500 3.740 2.935 4.204     .  0 0 "[    .    1    ]" 1 
       1425 1  73 SER HA   1  73 SER QB   2.400     . 3.200 2.192 2.158 2.307     .  0 0 "[    .    1    ]" 1 
       1426 1  73 SER HA   1  74 GLY H    2.500     . 3.400 2.863 2.712 3.094     .  0 0 "[    .    1    ]" 1 
       1427 1  73 SER HA   1  75 ASP H    3.200     . 5.200 4.553 4.251 5.119     .  0 0 "[    .    1    ]" 1 
       1428 1  73 SER HA   1  76 GLY H    3.600     . 5.500 5.339 4.640 5.603 0.103 12 0 "[    .    1    ]" 1 
       1429 1  73 SER HA   1 143 ALA MB   3.200     . 5.200 4.446 4.093 5.106     .  0 0 "[    .    1    ]" 1 
       1430 1  73 SER HB2  1  75 ASP H    2.900     . 3.900 2.757 2.546 3.032     .  0 0 "[    .    1    ]" 1 
       1431 1  74 GLY H    1  74 GLY HA2  2.600     . 3.500 2.308 2.291 2.330     .  0 0 "[    .    1    ]" 1 
       1432 1  74 GLY H    1  74 GLY HA3  2.500     . 3.400 2.725 2.660 2.809     .  0 0 "[    .    1    ]" 1 
       1433 1  74 GLY H    1  75 ASP H    2.700     . 3.600 2.944 2.742 3.316     .  0 0 "[    .    1    ]" 1 
       1434 1  74 GLY H    1  76 GLY H    3.400     . 5.500 4.246 3.689 4.473     .  0 0 "[    .    1    ]" 1 
       1435 1  74 GLY H    1 143 ALA MB   3.700     . 5.500 2.140 1.891 2.984     .  0 0 "[    .    1    ]" 1 
       1436 1  74 GLY HA2  1  93 ILE MD   2.400     . 3.200 2.849 2.368 3.161     .  0 0 "[    .    1    ]" 1 
       1437 1  74 GLY HA2  1  93 ILE MG   2.500     . 3.400 2.743 2.551 2.847     .  0 0 "[    .    1    ]" 1 
       1438 1  74 GLY HA2  1 147 CYS H    3.400     . 5.500 4.515 3.795 4.834     .  0 0 "[    .    1    ]" 1 
       1439 1  74 GLY HA2  1 140 VAL H    3.300     . 5.500 5.236 4.790 5.396     .  0 0 "[    .    1    ]" 1 
       1440 1  74 GLY HA2  1 144 PHE H    3.400     . 5.500 3.689 3.463 3.832     .  0 0 "[    .    1    ]" 1 
       1441 1  74 GLY HA2  1 146 VAL H    3.300     . 5.500 4.191 4.025 4.653     .  0 0 "[    .    1    ]" 1 
       1442 1  74 GLY HA2  1 143 ALA HA   2.900     . 4.600 2.646 1.936 3.508     .  0 0 "[    .    1    ]" 1 
       1443 1  74 GLY HA2  1 143 ALA MB   2.700     . 3.600 2.116 1.899 2.715     .  0 0 "[    .    1    ]" 1 
       1444 1  74 GLY HA3  1  75 ASP H    2.900     . 3.900 3.505 3.391 3.576     .  0 0 "[    .    1    ]" 1 
       1445 1  74 GLY HA3  1  76 GLY H    3.600     . 5.500 5.124 4.818 5.326     .  0 0 "[    .    1    ]" 1 
       1446 1  74 GLY HA3  1  93 ILE MD   3.300     . 5.500 3.546 3.308 3.886     .  0 0 "[    .    1    ]" 1 
       1447 1  74 GLY HA3  1 143 ALA MB   2.100     . 2.800 2.080 2.038 2.117     .  0 0 "[    .    1    ]" 1 
       1448 1  74 GLY HA3  1 146 VAL H    2.800     . 4.400 2.640 2.582 2.708     .  0 0 "[    .    1    ]" 1 
       1449 1  74 GLY HA3  1 147 CYS H    3.000     . 4.000 3.320 3.148 3.411     .  0 0 "[    .    1    ]" 1 
       1450 1  75 ASP H    1  75 ASP HA   2.500     . 3.400 2.865 2.794 2.936     .  0 0 "[    .    1    ]" 1 
       1451 1  75 ASP H    1  75 ASP HB2  2.500     . 3.400 3.191 3.014 3.399     .  0 0 "[    .    1    ]" 1 
       1452 1  75 ASP H    1  75 ASP HB3  3.000     . 4.000 3.225 2.816 3.817     .  0 0 "[    .    1    ]" 1 
       1453 1  75 ASP H    1  76 GLY H    2.300     . 3.100 1.931 1.841 2.045     .  0 0 "[    .    1    ]" 1 
       1454 1  75 ASP H    1  76 GLY HA2  3.500     . 5.500 4.231 4.014 4.487     .  0 0 "[    .    1    ]" 1 
       1455 1  75 ASP H    1  92 THR MG   3.400     . 5.500 4.998 4.700 5.518 0.018 10 0 "[    .    1    ]" 1 
       1456 1  75 ASP H    1  93 ILE HB   3.600     . 5.500 3.702 3.364 4.191     .  0 0 "[    .    1    ]" 1 
       1457 1  75 ASP H    1 144 PHE H    3.300     . 5.500 5.471 5.245 5.546 0.046  8 0 "[    .    1    ]" 1 
       1458 1  75 ASP HA   1  76 GLY H    2.700     . 4.200 3.440 2.998 3.556     .  0 0 "[    .    1    ]" 1 
       1459 1  75 ASP HA   1  92 THR MG   2.600     . 4.500 3.961 3.398 4.507 0.007 14 0 "[    .    1    ]" 1 
       1460 1  75 ASP HA   1  93 ILE MG   2.700     . 3.600 2.067 1.862 2.420     .  0 0 "[    .    1    ]" 1 
       1461 1  75 ASP HB2  1  76 GLY H    3.100     . 4.200 3.809 3.320 4.512 0.312 12 0 "[    .    1    ]" 1 
       1462 1  75 ASP HB3  1  76 GLY H    2.900     . 4.600 2.971 2.524 4.264     .  0 0 "[    .    1    ]" 1 
       1463 1  76 GLY H    1  76 GLY HA2  2.800     . 3.800 2.841 2.660 2.924     .  0 0 "[    .    1    ]" 1 
       1464 1  76 GLY H    1  76 GLY HA3  2.500     . 3.400 2.747 2.631 2.911     .  0 0 "[    .    1    ]" 1 
       1465 1  76 GLY H    1  77 LEU H    3.500 2.300 4.700 3.903 3.286 4.196     .  0 0 "[    .    1    ]" 1 
       1466 1  76 GLY H    1  92 THR MG   3.400 2.200 4.600 4.486 4.206 4.673 0.073  4 0 "[    .    1    ]" 1 
       1467 1  76 GLY H    1  93 ILE HB   3.100     . 4.200 3.365 2.535 3.782     .  0 0 "[    .    1    ]" 1 
       1468 1  76 GLY H    1  93 ILE MD   3.200 2.100 4.300 3.888 2.801 4.327 0.027  5 0 "[    .    1    ]" 1 
       1469 1  76 GLY H    1  93 ILE MG   3.200     . 5.200 3.162 2.287 3.648     .  0 0 "[    .    1    ]" 1 
       1470 1  76 GLY HA2  1  77 LEU H    2.500     . 3.400 2.136 2.105 2.207     .  0 0 "[    .    1    ]" 1 
       1471 1  76 GLY HA2  1  77 LEU QD   2.900     . 4.600 3.760 2.832 4.231     .  0 0 "[    .    1    ]" 1 
       1472 1  76 GLY HA2  1  92 THR HA   2.700     . 4.200 2.335 1.919 2.913     .  0 0 "[    .    1    ]" 1 
       1473 1  76 GLY HA2  1  93 ILE HG13 3.100     . 5.000 4.801 4.100 5.011 0.011 13 0 "[    .    1    ]" 1 
       1474 1  76 GLY HA3  1  77 LEU H    2.600     . 3.500 3.280 3.174 3.442     .  0 0 "[    .    1    ]" 1 
       1475 1  76 GLY HA3  1  92 THR HA   2.900     . 4.600 2.613 2.200 3.131     .  0 0 "[    .    1    ]" 1 
       1476 1  77 LEU H    1  77 LEU HA   2.800     . 3.800 2.880 2.825 2.942     .  0 0 "[    .    1    ]" 1 
       1477 1  77 LEU H    1  77 LEU QD   3.300 2.100 4.500 2.681 1.774 3.094 0.326  1 0 "[    .    1    ]" 1 
       1478 1  77 LEU H    1  91 GLN H    3.100     . 5.000 4.537 3.987 4.919     .  0 0 "[    .    1    ]" 1 
       1479 1  77 LEU H    1  91 GLN H    3.200     . 5.200 4.757 4.089 5.208 0.008  2 0 "[    .    1    ]" 1 
       1480 1  77 LEU H    1  92 THR HA   3.000     . 4.800 3.528 3.297 3.776     .  0 0 "[    .    1    ]" 1 
       1481 1  77 LEU H    1  93 ILE HB   3.000     . 4.800 2.948 2.594 3.170     .  0 0 "[    .    1    ]" 1 
       1482 1  77 LEU H    1  93 ILE HG13 2.800     . 4.400 4.285 3.533 4.429 0.029  9 0 "[    .    1    ]" 1 
       1483 1  77 LEU H    1  93 ILE MG   3.300 2.100 4.500 4.375 3.980 4.529 0.029 10 0 "[    .    1    ]" 1 
       1484 1  77 LEU HA   1  77 LEU QD   2.800     . 4.400 2.305 1.926 2.709     .  0 0 "[    .    1    ]" 1 
       1485 1  77 LEU HA   1  78 ARG H    2.200     . 3.000 2.151 2.086 2.322     .  0 0 "[    .    1    ]" 1 
       1486 1  77 LEU HA   1  89 VAL QG   3.100     . 5.000 3.721 3.267 3.972     .  0 0 "[    .    1    ]" 1 
       1487 1  77 LEU HA   1  89 VAL QG   2.800     . 4.400 3.824 3.318 4.100     .  0 0 "[    .    1    ]" 1 
       1488 1  77 LEU HB3  1  79 VAL H    2.700     . 4.200 2.724 2.208 3.023     .  0 0 "[    .    1    ]" 1 
       1489 1  77 LEU MD1  1  77 LEU MD2  2.000     . 2.700 2.017 1.907 2.086     .  0 0 "[    .    1    ]" 1 
       1490 1  77 LEU QD   1  92 THR H    3.400     . 5.500 4.966 4.693 5.243     .  0 0 "[    .    1    ]" 1 
       1491 1  77 LEU QD   1  89 VAL QG   2.900     . 4.600 3.816 3.660 4.008     .  0 0 "[    .    1    ]" 1 
       1492 1  77 LEU QD   1  93 ILE HA   3.100     . 5.000 3.055 2.782 3.248     .  0 0 "[    .    1    ]" 1 
       1493 1  77 LEU QD   1  93 ILE HB   2.600     . 4.500 2.886 2.314 3.468     .  0 0 "[    .    1    ]" 1 
       1494 1  77 LEU QD   1  93 ILE HB   2.900     . 4.600 2.741 2.278 3.087     .  0 0 "[    .    1    ]" 1 
       1495 1  77 LEU QD   1  93 ILE MD   2.500     . 3.400 1.923 1.660 2.385     .  0 0 "[    .    1    ]" 1 
       1496 1  77 LEU QD   1  93 ILE MD   2.300     . 3.100 1.891 1.650 2.300     .  0 0 "[    .    1    ]" 1 
       1497 1  77 LEU QD   1  93 ILE MG   2.500     . 4.500 3.697 3.314 4.054     .  0 0 "[    .    1    ]" 1 
       1498 1  77 LEU QD   1  96 VAL QG   2.300     . 3.100 2.897 2.526 3.031     .  0 0 "[    .    1    ]" 1 
       1499 1  77 LEU QD   1 111 TYR QD   2.600     . 3.500 2.534 2.230 2.889     .  0 0 "[    .    1    ]" 1 
       1500 1  77 LEU QD   1 111 TYR QE   2.700     . 3.600 2.367 2.042 2.583     .  0 0 "[    .    1    ]" 1 
       1501 1  77 LEU QD   1 140 VAL HB   3.200     . 5.200 4.027 3.625 4.324     .  0 0 "[    .    1    ]" 1 
       1502 1  77 LEU QD   1 140 VAL MG2  2.100     . 2.800 1.886 1.572 1.992 0.028  7 0 "[    .    1    ]" 1 
       1503 1  77 LEU QD   1 143 ALA MB   2.500     . 3.800 2.338 1.778 2.893     .  0 0 "[    .    1    ]" 1 
       1504 1  77 LEU QD   1 144 PHE H    3.500     . 5.500 3.891 3.644 4.381     .  0 0 "[    .    1    ]" 1 
       1505 1  77 LEU QD   1 143 ALA MB   2.600     . 3.500 2.847 2.320 3.410     .  0 0 "[    .    1    ]" 1 
       1506 1  78 ARG H    1  78 ARG QG   2.300     . 3.100 2.718 2.277 3.102 0.002  8 0 "[    .    1    ]" 1 
       1507 1  78 ARG H    1  79 VAL H    3.500     . 5.500 3.892 3.603 4.330     .  0 0 "[    .    1    ]" 1 
       1508 1  78 ARG HA   1  78 ARG QG   2.800     . 4.400 2.497 2.403 2.702     .  0 0 "[    .    1    ]" 1 
       1509 1  78 ARG HA   1  79 VAL H    2.200     . 3.000 2.162 2.106 2.236     .  0 0 "[    .    1    ]" 1 
       1510 1  78 ARG HA   1  79 VAL MG1  2.500     . 3.800 3.021 3.000 3.038     .  0 0 "[    .    1    ]" 1 
       1511 1  78 ARG HA   1  89 VAL H    3.400 2.200 4.600 3.835 3.580 3.971     .  0 0 "[    .    1    ]" 1 
       1512 1  78 ARG HA   1  87 LEU QD   2.700     . 4.200 2.512 1.903 3.517     .  0 0 "[    .    1    ]" 1 
       1513 1  78 ARG HA   1  91 GLN H    3.000     . 4.000 3.971 3.828 4.049 0.049 13 0 "[    .    1    ]" 1 
       1514 1  78 ARG HB3  1  78 ARG HE   2.600     . 3.500 2.509 2.064 2.932     .  0 0 "[    .    1    ]" 1 
       1515 1  78 ARG HB3  1  91 GLN H    3.000     . 4.800 3.461 3.181 3.864     .  0 0 "[    .    1    ]" 1 
       1516 1  78 ARG HB3  1  79 VAL H    2.600     . 3.500 2.739 2.632 2.838     .  0 0 "[    .    1    ]" 1 
       1517 1  78 ARG HB3  1  87 LEU QD   2.100     . 2.800 1.884 1.707 2.160     .  0 0 "[    .    1    ]" 1 
       1518 1  78 ARG QD   1  78 ARG HE   2.300     . 3.100 2.301 2.180 2.487     .  0 0 "[    .    1    ]" 1 
       1519 1  78 ARG QD   1  87 LEU QD   2.600     . 3.500 2.541 1.845 3.211     .  0 0 "[    .    1    ]" 1 
       1520 1  78 ARG HE   1  87 LEU QD   2.900     . 3.900 3.175 2.365 3.873     .  0 0 "[    .    1    ]" 1 
       1521 1  78 ARG QG   1  91 GLN H    3.200 2.100 4.300 3.508 3.207 3.967     .  0 0 "[    .    1    ]" 1 
       1522 1  78 ARG QG   1  92 THR H    3.300     . 5.500 5.377 4.598 5.576 0.076  6 0 "[    .    1    ]" 1 
       1523 1  79 VAL C    1  88 ILE N    4.100 3.800 4.400 4.235 4.093 4.388     .  0 0 "[    .    1    ]" 1 
       1524 1  79 VAL H    1  79 VAL MG1  2.600     . 3.500 1.992 1.894 2.095     .  0 0 "[    .    1    ]" 1 
       1525 1  79 VAL H    1  79 VAL MG2  2.900     . 4.600 3.612 3.532 3.685     .  0 0 "[    .    1    ]" 1 
       1526 1  79 VAL H    1  80 VAL H    3.400     . 5.500 3.780 3.638 3.889     .  0 0 "[    .    1    ]" 1 
       1527 1  79 VAL H    1  87 LEU QD   2.600     . 4.000 3.098 2.484 3.794     .  0 0 "[    .    1    ]" 1 
       1528 1  79 VAL H    1  89 VAL H    2.500     . 3.800 2.301 2.071 2.633     .  0 0 "[    .    1    ]" 1 
       1529 1  79 VAL H    1  89 VAL H    2.800     . 3.800 3.047 2.807 3.451     .  0 0 "[    .    1    ]" 1 
       1530 1  79 VAL H    1  89 VAL HA   3.700     . 5.500 5.117 4.831 5.454     .  0 0 "[    .    1    ]" 1 
       1531 1  79 VAL H    1  89 VAL HB   2.700     . 3.600 2.749 2.211 3.062     .  0 0 "[    .    1    ]" 1 
       1532 1  79 VAL H    1  89 VAL QG   2.600     . 4.500 3.449 3.103 3.686     .  0 0 "[    .    1    ]" 1 
       1533 1  79 VAL H    1  90 ASP HA   3.400     . 5.500 5.194 4.728 5.499     .  0 0 "[    .    1    ]" 1 
       1534 1  79 VAL HA   1  79 VAL HB   2.900     . 4.600 2.411 2.363 2.450     .  0 0 "[    .    1    ]" 1 
       1535 1  79 VAL HA   1  79 VAL MG1  2.500     . 3.400 3.190 3.180 3.202     .  0 0 "[    .    1    ]" 1 
       1536 1  79 VAL HA   1  79 VAL MG1  2.400     . 3.200 3.014 2.930 3.063     .  0 0 "[    .    1    ]" 1 
       1537 1  79 VAL HA   1  79 VAL MG2  2.400     . 3.200 2.358 2.253 2.455     .  0 0 "[    .    1    ]" 1 
       1538 1  79 VAL HA   1  80 VAL H    2.300     . 3.100 2.178 2.143 2.262     .  0 0 "[    .    1    ]" 1 
       1539 1  79 VAL HB   1  79 VAL MG2  2.300     . 3.100 2.102 2.083 2.131     .  0 0 "[    .    1    ]" 1 
       1540 1  79 VAL HB   1  80 VAL H    3.600     . 5.500 4.321 4.011 4.532     .  0 0 "[    .    1    ]" 1 
       1541 1  79 VAL MG1  1  79 VAL MG2  1.900     . 2.600 2.004 1.893 2.098     .  0 0 "[    .    1    ]" 1 
       1542 1  79 VAL MG1  1  79 VAL MG2  2.000     . 2.700 1.893 1.748 2.010     .  0 0 "[    .    1    ]" 1 
       1543 1  79 VAL MG1  1  89 VAL H    2.600     . 3.500 1.897 1.768 2.096     .  0 0 "[    .    1    ]" 1 
       1544 1  79 VAL MG1  1  88 ILE HB   2.500     . 3.800 1.859 1.802 1.978     .  0 0 "[    .    1    ]" 1 
       1545 1  79 VAL MG1  1  89 VAL HA   2.800     . 4.400 3.956 3.766 4.188     .  0 0 "[    .    1    ]" 1 
       1546 1  79 VAL MG1  1  89 VAL HB   2.400     . 3.200 2.295 1.942 2.784     .  0 0 "[    .    1    ]" 1 
       1547 1  79 VAL MG1  1  89 VAL MG2  1.900     . 2.600 1.762 1.668 1.840     .  0 0 "[    .    1    ]" 1 
       1548 1  79 VAL MG2  1  80 VAL H    2.900     . 3.900 2.850 2.230 3.475     .  0 0 "[    .    1    ]" 1 
       1549 1  79 VAL MG2  1  80 VAL HA   3.200     . 5.200 3.856 3.399 4.198     .  0 0 "[    .    1    ]" 1 
       1550 1  79 VAL MG2  1  88 ILE H    3.400     . 5.500 3.783 3.512 3.987     .  0 0 "[    .    1    ]" 1 
       1551 1  79 VAL MG2  1  88 ILE HB   2.200     . 4.500 3.343 3.089 3.684     .  0 0 "[    .    1    ]" 1 
       1552 1  79 VAL MG2  1  88 ILE MD   2.300     . 3.400 2.039 1.871 2.463     .  0 0 "[    .    1    ]" 1 
       1553 1  79 VAL MG2  1  88 ILE QG   2.300     . 3.400 3.342 3.106 3.423 0.023  2 0 "[    .    1    ]" 1 
       1554 1  79 VAL MG2  1 126 PHE QD   2.800     . 4.400 4.299 3.642 4.439 0.039  6 0 "[    .    1    ]" 1 
       1555 1  79 VAL O    1  88 ILE N    3.000 2.800 3.200 3.101 2.913 3.211 0.011  7 0 "[    .    1    ]" 1 
       1556 1  80 VAL H    1  80 VAL HA   3.000     . 4.000 2.928 2.865 2.950     .  0 0 "[    .    1    ]" 1 
       1557 1  80 VAL H    1  80 VAL HB   2.700     . 3.600 2.802 2.496 3.300     .  0 0 "[    .    1    ]" 1 
       1558 1  80 VAL H    1  80 VAL QG   2.700     . 3.600 2.396 2.028 2.734     .  0 0 "[    .    1    ]" 1 
       1559 1  80 VAL HA   1  80 VAL HB   2.600     . 3.500 2.813 2.411 3.023     .  0 0 "[    .    1    ]" 1 
       1560 1  80 VAL HA   1  80 VAL QG   2.300     . 3.100 2.141 2.019 2.329     .  0 0 "[    .    1    ]" 1 
       1561 1  80 VAL HA   1  80 VAL QG   2.200     . 3.200 2.118 2.010 2.250     .  0 0 "[    .    1    ]" 1 
       1562 1  80 VAL HA   1  81 ASP H    2.200     . 3.000 2.246 2.144 2.395     .  0 0 "[    .    1    ]" 1 
       1563 1  80 VAL HA   1  87 LEU H    3.700     . 5.500 4.664 3.140 5.142     .  0 0 "[    .    1    ]" 1 
       1564 1  80 VAL HA   1  87 LEU HA   2.300     . 3.100 2.755 1.941 3.070     .  0 0 "[    .    1    ]" 1 
       1565 1  80 VAL HA   1  88 ILE H    3.000     . 4.000 3.184 2.365 3.739     .  0 0 "[    .    1    ]" 1 
       1566 1  80 VAL HA   1  88 ILE HG12 2.900     . 4.600 4.460 3.732 5.318 0.718  5 1 "[    +    1    ]" 1 
       1567 1  80 VAL HA   1  89 VAL H    3.500     . 5.500 5.067 4.637 5.500 0.000  5 0 "[    .    1    ]" 1 
       1568 1  80 VAL HB   1  81 ASP H    3.200     . 5.200 3.904 3.349 4.272     .  0 0 "[    .    1    ]" 1 
       1569 1  80 VAL HB   1  86 GLY H    3.400     . 5.500 4.144 4.045 4.258     .  0 0 "[    .    1    ]" 1 
       1570 1  80 VAL HB   1  87 LEU QD   2.900     . 4.600 3.931 2.761 4.544     .  0 0 "[    .    1    ]" 1 
       1571 1  80 VAL QG   1  81 ASP H    2.700     . 3.600 2.129 1.845 2.555     .  0 0 "[    .    1    ]" 1 
       1572 1  80 VAL QG   1  81 ASP HA   2.700     . 3.600 2.666 2.204 3.036     .  0 0 "[    .    1    ]" 1 
       1573 1  80 VAL QG   1  82 ASP H    3.400     . 5.500 4.364 4.041 4.713     .  0 0 "[    .    1    ]" 1 
       1574 1  80 VAL QG   1  82 ASP HA   2.900     . 4.600 4.006 3.720 4.359     .  0 0 "[    .    1    ]" 1 
       1575 1  80 VAL QG   1  84 THR H    3.800     . 5.500 4.880 4.625 5.223     .  0 0 "[    .    1    ]" 1 
       1576 1  80 VAL QG   1  85 LYS H    3.300 2.100 4.500 3.524 3.302 3.857     .  0 0 "[    .    1    ]" 1 
       1577 1  80 VAL QG   1  85 LYS HA   2.200     . 3.000 2.062 1.867 2.550     .  0 0 "[    .    1    ]" 1 
       1578 1  80 VAL QG   1  85 LYS HA   2.100     . 2.800 1.839 1.737 1.996     .  0 0 "[    .    1    ]" 1 
       1579 1  80 VAL QG   1  85 LYS HB3  2.900     . 4.600 3.629 3.003 4.264     .  0 0 "[    .    1    ]" 1 
       1580 1  80 VAL QG   1  85 LYS QD   2.900     . 4.600 2.900 1.931 3.695     .  0 0 "[    .    1    ]" 1 
       1581 1  80 VAL QG   1  85 LYS HG3  3.100     . 5.000 2.877 2.222 4.190     .  0 0 "[    .    1    ]" 1 
       1582 1  80 VAL QG   1  86 GLY H    3.000     . 4.800 2.999 2.494 3.371     .  0 0 "[    .    1    ]" 1 
       1583 1  80 VAL QG   1  87 LEU H    3.000     . 4.000 3.045 1.998 3.605 0.002 13 0 "[    .    1    ]" 1 
       1584 1  80 VAL QG   1  87 LEU HA   2.600     . 4.000 2.735 2.212 3.198     .  0 0 "[    .    1    ]" 1 
       1585 1  81 ASP H    1  81 ASP HA   2.700     . 3.600 2.878 2.770 2.945     .  0 0 "[    .    1    ]" 1 
       1586 1  81 ASP H    1  81 ASP QB   2.500     . 3.400 2.520 2.224 3.066     .  0 0 "[    .    1    ]" 1 
       1587 1  81 ASP H    1  82 ASP H    3.700     . 5.500 4.561 4.408 4.632     .  0 0 "[    .    1    ]" 1 
       1588 1  81 ASP H    1  84 THR H    3.700     . 5.500 3.745 3.211 4.146     .  0 0 "[    .    1    ]" 1 
       1589 1  81 ASP H    1  86 GLY H    3.200     . 5.200 3.159 2.691 3.673     .  0 0 "[    .    1    ]" 1 
       1590 1  81 ASP H    1  88 ILE QG   3.100     . 4.200 3.434 2.927 4.120     .  0 0 "[    .    1    ]" 1 
       1591 1  81 ASP HA   1  82 ASP H    2.100     . 2.800 2.165 2.093 2.298     .  0 0 "[    .    1    ]" 1 
       1592 1  81 ASP HA   1  83 GLU H    2.900     . 3.900 3.000 2.938 3.086     .  0 0 "[    .    1    ]" 1 
       1593 1  81 ASP HA   1  83 GLU QB   2.900     . 4.600 4.480 4.426 4.686 0.086 14 0 "[    .    1    ]" 1 
       1594 1  81 ASP HA   1  85 LYS H    3.300     . 5.500 3.734 3.353 4.012     .  0 0 "[    .    1    ]" 1 
       1595 1  81 ASP HA   1  85 LYS HA   3.100     . 5.000 3.921 3.642 4.157     .  0 0 "[    .    1    ]" 1 
       1596 1  81 ASP HA   1  86 GLY H    3.500     . 5.500 4.975 4.534 5.445     .  0 0 "[    .    1    ]" 1 
       1597 1  81 ASP HA   1  88 ILE MD   2.700     . 4.200 3.717 3.253 4.130     .  0 0 "[    .    1    ]" 1 
       1598 1  81 ASP QB   1  82 ASP H    3.400     . 5.500 3.357 2.829 3.680     .  0 0 "[    .    1    ]" 1 
       1599 1  81 ASP QB   1  82 ASP HA   2.700     . 4.200 3.268 2.201 3.959     .  0 0 "[    .    1    ]" 1 
       1600 1  81 ASP QB   1  83 GLU H    2.600     . 3.500 2.678 2.223 2.936     .  0 0 "[    .    1    ]" 1 
       1601 1  81 ASP QB   1  85 LYS H    3.400     . 5.500 2.652 2.275 3.356     .  0 0 "[    .    1    ]" 1 
       1602 1  81 ASP QB   1  83 GLU H    3.500     . 5.500 2.795 2.243 3.269     .  0 0 "[    .    1    ]" 1 
       1603 1  81 ASP QB   1  84 THR H    3.400 2.100 4.500 2.487 2.067 2.867 0.033  6 0 "[    .    1    ]" 1 
       1604 1  81 ASP QB   1  85 LYS H    3.300 2.100 4.500 2.657 2.276 3.378     .  0 0 "[    .    1    ]" 1 
       1605 1  81 ASP QB   1  85 LYS HG3  3.100     . 5.000 4.213 3.592 4.831     .  0 0 "[    .    1    ]" 1 
       1606 1  81 ASP QB   1  86 GLY H    2.700 2.100 3.600 2.994 2.591 3.486     .  0 0 "[    .    1    ]" 1 
       1607 1  81 ASP QB   1  88 ILE MD   2.500     . 3.400 3.005 2.648 3.324     .  0 0 "[    .    1    ]" 1 
       1608 1  81 ASP QB   1  88 ILE QG   3.000     . 4.800 3.723 3.456 4.081     .  0 0 "[    .    1    ]" 1 
       1609 1  82 ASP H    1  82 ASP QB   2.300     . 3.100 2.293 2.078 2.407     .  0 0 "[    .    1    ]" 1 
       1610 1  82 ASP H    1  83 GLU H    2.700     . 3.600 2.644 2.507 2.739     .  0 0 "[    .    1    ]" 1 
       1611 1  82 ASP H    1  83 GLU QB   3.300     . 5.500 4.053 3.817 4.265     .  0 0 "[    .    1    ]" 1 
       1612 1  82 ASP H    1  84 THR H    3.500     . 5.500 3.997 3.848 4.121     .  0 0 "[    .    1    ]" 1 
       1613 1  82 ASP HA   1  82 ASP QB   2.100     . 2.800 2.436 2.364 2.538     .  0 0 "[    .    1    ]" 1 
       1614 1  82 ASP HA   1  83 GLU HA   2.700     . 4.500 4.502 4.448 4.577 0.077  2 0 "[    .    1    ]" 1 
       1615 1  82 ASP HA   1  85 LYS HA   3.100     . 5.000 4.092 3.721 4.375     .  0 0 "[    .    1    ]" 1 
       1616 1  82 ASP HA   1  85 LYS QD   2.700     . 4.200 2.589 2.362 2.970     .  0 0 "[    .    1    ]" 1 
       1617 1  82 ASP HA   1  85 LYS HG2  3.400     . 5.500 5.255 3.623 5.517 0.017  5 0 "[    .    1    ]" 1 
       1618 1  82 ASP QB   1  83 GLU HB2  2.700     . 4.200 4.281 4.058 5.224 1.024 14 1 "[    .    1   +]" 1 
       1619 1  82 ASP QB   1  83 GLU HA   2.900     . 4.600 4.341 4.069 4.559     .  0 0 "[    .    1    ]" 1 
       1620 1  82 ASP QB   1  85 LYS QD   3.100     . 5.000 4.431 4.203 4.754     .  0 0 "[    .    1    ]" 1 
       1621 1  83 GLU H    1  83 GLU HA   2.500     . 3.400 2.937 2.915 2.946     .  0 0 "[    .    1    ]" 1 
       1622 1  83 GLU H    1  83 GLU QB   2.100     . 2.800 2.501 2.355 2.786     .  0 0 "[    .    1    ]" 1 
       1623 1  83 GLU H    1  84 THR H    2.300     . 3.100 2.025 1.924 2.301     .  0 0 "[    .    1    ]" 1 
       1624 1  83 GLU H    1  84 THR MG   2.900     . 4.600 4.255 4.074 4.432     .  0 0 "[    .    1    ]" 1 
       1625 1  83 GLU H    1  85 LYS H    3.100     . 4.200 2.961 2.689 3.465     .  0 0 "[    .    1    ]" 1 
       1626 1  83 GLU HA   1  83 GLU QB   2.000     . 2.700 2.414 2.176 2.463     .  0 0 "[    .    1    ]" 1 
       1627 1  83 GLU HA   1  84 THR H    3.200 2.100 4.300 3.511 3.453 3.569     .  0 0 "[    .    1    ]" 1 
       1628 1  83 GLU HA   1  84 THR MG   3.000     . 4.800 4.472 4.017 4.802 0.002  1 0 "[    .    1    ]" 1 
       1629 1  83 GLU QB   1  84 THR HA   2.900     . 4.600 4.140 3.878 4.647 0.047 14 0 "[    .    1    ]" 1 
       1630 1  83 GLU QB   1  83 GLU QG   1.900     . 2.600 2.036 1.972 2.087     .  0 0 "[    .    1    ]" 1 
       1631 1  83 GLU QB   1  84 THR H    2.500     . 3.400 2.682 2.109 3.493 0.093 14 0 "[    .    1    ]" 1 
       1632 1  83 GLU QB   1  84 THR HA   3.100     . 5.000 4.301 4.002 4.722     .  0 0 "[    .    1    ]" 1 
       1633 1  83 GLU QB   1  84 THR MG   2.200     . 3.000 2.826 2.677 2.963     .  0 0 "[    .    1    ]" 1 
       1634 1  83 GLU QB   1  85 LYS H    3.300 2.100 4.500 3.103 2.877 3.269     .  0 0 "[    .    1    ]" 1 
       1635 1  83 GLU QG   1  84 THR H    3.300     . 5.500 3.837 1.923 4.216     .  0 0 "[    .    1    ]" 1 
       1636 1  83 GLU QG   1  84 THR MG   2.600     . 3.500 3.070 2.286 3.507 0.007  2 0 "[    .    1    ]" 1 
       1637 1  84 THR H    1  84 THR HA   2.600     . 3.500 2.832 2.778 2.847     .  0 0 "[    .    1    ]" 1 
       1638 1  84 THR H    1  84 THR MG   2.500     . 3.400 2.853 2.460 3.216     .  0 0 "[    .    1    ]" 1 
       1639 1  84 THR H    1  85 LYS HA   3.100     . 5.000 4.203 3.952 4.590     .  0 0 "[    .    1    ]" 1 
       1640 1  84 THR H    1  86 GLY H    3.500     . 5.500 3.854 3.144 4.378     .  0 0 "[    .    1    ]" 1 
       1641 1  84 THR HA   1  84 THR MG   1.700     . 2.300 1.960 1.934 1.997     .  0 0 "[    .    1    ]" 1 
       1642 1  84 THR HA   1  85 LYS H    3.100     . 4.200 3.217 3.014 3.266     .  0 0 "[    .    1    ]" 1 
       1643 1  84 THR HA   1  86 GLY H    3.000     . 4.000 3.549 3.087 4.004 0.004 14 0 "[    .    1    ]" 1 
       1644 1  84 THR HA   1  84 THR MG   1.800     . 2.400 2.364 2.270 2.461 0.061 14 0 "[    .    1    ]" 1 
       1645 1  84 THR HA   1  85 LYS HA   3.200     . 5.200 5.035 4.844 5.108     .  0 0 "[    .    1    ]" 1 
       1646 1  84 THR HB   1  84 THR MG   2.000     . 2.700 2.094 2.069 2.117     .  0 0 "[    .    1    ]" 1 
       1647 1  84 THR HB   1  86 GLY HA2  3.200     . 5.200 5.139 4.853 5.436 0.236  9 0 "[    .    1    ]" 1 
       1648 1  84 THR MG   1  85 LYS H    3.200 2.100 4.300 3.803 2.901 3.933     .  0 0 "[    .    1    ]" 1 
       1649 1  84 THR MG   1  85 LYS HG3  2.400     . 4.500 2.954 1.815 4.046     .  0 0 "[    .    1    ]" 1 
       1650 1  84 THR MG   1  86 GLY H    3.200     . 5.200 4.517 4.205 4.793     .  0 0 "[    .    1    ]" 1 
       1651 1  85 LYS H    1  85 LYS HA   2.100     . 2.800 2.278 2.270 2.294     .  0 0 "[    .    1    ]" 1 
       1652 1  85 LYS H    1  85 LYS HB3  3.500 2.300 4.700 4.015 3.785 4.104     .  0 0 "[    .    1    ]" 1 
       1653 1  85 LYS H    1  85 LYS QD   3.400 2.100 4.500 2.912 2.097 3.575 0.003  5 0 "[    .    1    ]" 1 
       1654 1  85 LYS H    1  86 GLY H    2.600     . 3.500 2.660 2.441 2.981     .  0 0 "[    .    1    ]" 1 
       1655 1  85 LYS HA   1  85 LYS HB2  2.600     . 3.500 2.868 2.671 3.002     .  0 0 "[    .    1    ]" 1 
       1656 1  85 LYS HA   1  85 LYS HB3  2.700     . 3.600 2.805 2.588 2.972     .  0 0 "[    .    1    ]" 1 
       1657 1  85 LYS HA   1  85 LYS QD   2.600     . 3.500 2.243 1.897 2.734     .  0 0 "[    .    1    ]" 1 
       1658 1  85 LYS HA   1  85 LYS HG2  2.700     . 3.600 3.524 2.789 3.635 0.035  5 0 "[    .    1    ]" 1 
       1659 1  85 LYS HA   1  85 LYS HG3  2.700     . 3.600 2.552 2.270 3.666 0.066  8 0 "[    .    1    ]" 1 
       1660 1  85 LYS HA   1  86 GLY H    2.400     . 3.200 2.580 2.488 2.669     .  0 0 "[    .    1    ]" 1 
       1661 1  85 LYS HB2  1  85 LYS QD   2.900     . 4.600 2.414 2.168 3.304     .  0 0 "[    .    1    ]" 1 
       1662 1  85 LYS HB2  1  85 LYS HG3  2.800     . 4.400 2.961 2.381 3.012     .  0 0 "[    .    1    ]" 1 
       1663 1  85 LYS HB2  1  86 GLY H    3.400     . 5.500 4.309 4.022 4.592     .  0 0 "[    .    1    ]" 1 
       1664 1  85 LYS HB3  1  85 LYS QD   2.800     . 4.400 3.220 2.248 3.318     .  0 0 "[    .    1    ]" 1 
       1665 1  85 LYS QD   1  85 LYS HG2  2.500     . 2.800 2.391 2.177 2.530     .  0 0 "[    .    1    ]" 1 
       1666 1  85 LYS QD   1  85 LYS HG3  2.200     . 2.400 2.300 2.152 2.509 0.109  8 0 "[    .    1    ]" 1 
       1667 1  85 LYS QD   1  85 LYS HG3  1.900     . 2.600 1.968 1.888 2.072     .  0 0 "[    .    1    ]" 1 
       1668 1  85 LYS QD   1  86 GLY H    3.800     . 5.500 4.429 4.217 4.664     .  0 0 "[    .    1    ]" 1 
       1669 1  85 LYS QD   1  86 GLY H    3.500     . 5.500 4.450 4.245 4.714     .  0 0 "[    .    1    ]" 1 
       1670 1  85 LYS HE3  1  85 LYS HG3  2.500     . 3.400 2.117 1.942 2.767     .  0 0 "[    .    1    ]" 1 
       1671 1  86 GLY H    1  86 GLY HA3  2.300     . 3.100 2.396 2.330 2.517     .  0 0 "[    .    1    ]" 1 
       1672 1  86 GLY HA2  1  87 LEU H    2.200     . 3.000 2.406 2.118 3.172 0.172  3 0 "[    .    1    ]" 1 
       1673 1  86 GLY HA3  1  87 LEU H    2.400     . 3.200 3.047 2.144 3.375 0.175  6 0 "[    .    1    ]" 1 
       1674 1  87 LEU H    1  87 LEU HA   2.700     . 3.600 2.755 2.264 2.943     .  0 0 "[    .    1    ]" 1 
       1675 1  87 LEU H    1  87 LEU HB2  2.400     . 3.200 2.588 2.065 3.223 0.023 13 0 "[    .    1    ]" 1 
       1676 1  87 LEU H    1  87 LEU HB3  2.300     . 3.100 2.800 2.304 3.258 0.158  6 0 "[    .    1    ]" 1 
       1677 1  87 LEU H    1  88 ILE H    3.200     . 5.200 4.400 3.781 4.586     .  0 0 "[    .    1    ]" 1 
       1678 1  87 LEU HA   1  87 LEU QD   2.200     . 3.000 1.983 1.860 2.232     .  0 0 "[    .    1    ]" 1 
       1679 1  87 LEU HA   1  88 ILE H    2.300     . 3.100 2.160 2.133 2.262     .  0 0 "[    .    1    ]" 1 
       1680 1  87 LEU HA   1  89 VAL H    3.200 2.100 4.300 4.145 3.616 4.316 0.016  6 0 "[    .    1    ]" 1 
       1681 1  87 LEU HB2  1  87 LEU QD   2.000     . 2.800 2.091 1.990 2.133     .  0 0 "[    .    1    ]" 1 
       1682 1  87 LEU HB2  1  88 ILE H    3.300     . 5.500 3.447 2.867 4.015     .  0 0 "[    .    1    ]" 1 
       1683 1  87 LEU QD   1  88 ILE H    2.800     . 3.800 2.072 1.858 2.385     .  0 0 "[    .    1    ]" 1 
       1684 1  87 LEU QD   1  88 ILE QG   2.500     . 3.800 3.671 3.499 3.814 0.014  6 0 "[    .    1    ]" 1 
       1685 1  87 LEU QD   1  90 ASP H    2.500     . 3.400 2.912 2.067 3.138     .  0 0 "[    .    1    ]" 1 
       1686 1  87 LEU QD   1  90 ASP HA   2.400     . 3.600 2.441 1.875 3.133     .  0 0 "[    .    1    ]" 1 
       1687 1  87 LEU QD   1  90 ASP HB2  2.700     . 4.200 2.396 1.870 3.682     .  0 0 "[    .    1    ]" 1 
       1688 1  87 LEU QD   1  90 ASP HB3  2.400     . 3.200 2.608 1.904 3.299 0.099  5 0 "[    .    1    ]" 1 
       1689 1  87 LEU HG   1  89 VAL HA   3.400     . 5.500 4.766 4.449 5.523 0.023  4 0 "[    .    1    ]" 1 
       1690 1  88 ILE H    1  88 ILE HA   2.900     . 3.900 2.910 2.835 2.943     .  0 0 "[    .    1    ]" 1 
       1691 1  88 ILE H    1  88 ILE HB   2.800     . 3.800 2.750 2.631 2.942     .  0 0 "[    .    1    ]" 1 
       1692 1  88 ILE H    1  88 ILE HG12 2.600     . 3.500 3.302 3.119 3.502 0.002 13 0 "[    .    1    ]" 1 
       1693 1  88 ILE H    1  88 ILE MG   3.200     . 5.200 3.830 3.765 3.952     .  0 0 "[    .    1    ]" 1 
       1694 1  88 ILE H    1  89 VAL H    2.300     . 3.100 2.400 2.107 2.835     .  0 0 "[    .    1    ]" 1 
       1695 1  88 ILE HA   1  88 ILE QG   2.600     . 3.500 2.575 2.476 2.626     .  0 0 "[    .    1    ]" 1 
       1696 1  88 ILE HA   1  88 ILE MG   2.300     . 3.100 2.210 2.081 2.316     .  0 0 "[    .    1    ]" 1 
       1697 1  88 ILE HA   1  89 VAL H    3.100     . 4.200 3.550 3.454 3.581     .  0 0 "[    .    1    ]" 1 
       1698 1  88 ILE HA   1  89 VAL HA   2.700     . 4.500 4.530 4.506 4.538 0.038  3 0 "[    .    1    ]" 1 
       1699 1  88 ILE HA   1  89 VAL HA   2.400     . 4.500 4.487 4.413 4.520 0.020 13 0 "[    .    1    ]" 1 
       1700 1  88 ILE HA   1  89 VAL QG   3.200     . 5.200 4.071 3.850 4.223     .  0 0 "[    .    1    ]" 1 
       1701 1  88 ILE HB   1  88 ILE MD   2.400     . 3.200 2.378 2.258 2.504     .  0 0 "[    .    1    ]" 1 
       1702 1  88 ILE HB   1  88 ILE QG   2.500     . 3.400 2.374 2.335 2.419     .  0 0 "[    .    1    ]" 1 
       1703 1  88 ILE HB   1  89 VAL H    2.400     . 3.200 2.412 2.125 3.062     .  0 0 "[    .    1    ]" 1 
       1704 1  88 ILE HB   1  89 VAL QG   2.400     . 3.200 2.487 2.254 2.821     .  0 0 "[    .    1    ]" 1 
       1705 1  88 ILE MD   1  88 ILE QG   2.000     . 2.700 1.868 1.846 1.887     .  0 0 "[    .    1    ]" 1 
       1706 1  88 ILE MD   1  88 ILE MG   1.800     . 2.400 2.015 1.722 2.271     .  0 0 "[    .    1    ]" 1 
       1707 1  88 ILE QG   1  88 ILE MG   2.400     . 3.200 2.294 2.139 2.378     .  0 0 "[    .    1    ]" 1 
       1708 1  88 ILE QG   1  89 VAL H    3.100     . 4.200 3.628 3.483 3.765     .  0 0 "[    .    1    ]" 1 
       1709 1  88 ILE MG   1  89 VAL H    3.100     . 5.000 3.603 3.197 4.060     .  0 0 "[    .    1    ]" 1 
       1710 1  89 VAL H    1  89 VAL HA   2.800     . 3.800 2.940 2.918 2.947     .  0 0 "[    .    1    ]" 1 
       1711 1  89 VAL H    1  89 VAL HB   2.700     . 3.600 2.728 2.604 3.008     .  0 0 "[    .    1    ]" 1 
       1712 1  89 VAL H    1  89 VAL QG   2.800     . 3.800 2.557 2.330 2.806     .  0 0 "[    .    1    ]" 1 
       1713 1  89 VAL H    1  90 ASP H    3.200     . 5.200 3.779 2.962 4.439     .  0 0 "[    .    1    ]" 1 
       1714 1  89 VAL HA   1  89 VAL HB   2.800     . 4.400 3.017 3.005 3.023     .  0 0 "[    .    1    ]" 1 
       1715 1  89 VAL HA   1  89 VAL QG   2.200     . 3.000 2.100 2.042 2.171     .  0 0 "[    .    1    ]" 1 
       1716 1  89 VAL HA   1  90 ASP H    2.000     . 2.700 2.319 2.149 2.560     .  0 0 "[    .    1    ]" 1 
       1717 1  89 VAL HB   1  89 VAL QG   2.100     . 2.800 1.883 1.860 1.897     .  0 0 "[    .    1    ]" 1 
       1718 1  89 VAL MG1  1  89 VAL MG2  1.800     . 2.400 2.048 1.898 2.097     .  0 0 "[    .    1    ]" 1 
       1719 1  89 VAL QG   1  91 GLN H    2.800     . 3.800 2.874 2.367 3.387     .  0 0 "[    .    1    ]" 1 
       1720 1  89 VAL QG   1  91 GLN H    3.000     . 4.800 2.740 2.350 3.190     .  0 0 "[    .    1    ]" 1 
       1721 1  89 VAL QG   1 118 THR MG   2.900     . 4.600 4.207 3.961 4.274     .  0 0 "[    .    1    ]" 1 
       1722 1  89 VAL QG   1 124 HIS HB2  2.900     . 4.600 4.125 3.553 4.295     .  0 0 "[    .    1    ]" 1 
       1723 1  89 VAL QG   1 124 HIS HE1  2.700     . 3.600 2.412 1.892 2.846     .  0 0 "[    .    1    ]" 1 
       1724 1  90 ASP H    1  90 ASP HA   2.700     . 3.600 2.899 2.837 2.944     .  0 0 "[    .    1    ]" 1 
       1725 1  90 ASP H    1  90 ASP HB2  2.700     . 3.600 3.329 2.766 3.652 0.052 10 0 "[    .    1    ]" 1 
       1726 1  90 ASP H    1  90 ASP HB3  3.000     . 4.000 2.644 2.354 3.231     .  0 0 "[    .    1    ]" 1 
       1727 1  90 ASP H    1  91 GLN H    3.300     . 5.500 3.683 2.923 4.041     .  0 0 "[    .    1    ]" 1 
       1728 1  90 ASP HA   1  91 GLN H    2.300     . 3.100 2.435 2.209 2.566     .  0 0 "[    .    1    ]" 1 
       1729 1  90 ASP HB2  1  91 GLN H    3.500     . 5.500 4.427 4.009 4.657     .  0 0 "[    .    1    ]" 1 
       1730 1  91 GLN H    1  91 GLN HA   2.700     . 3.600 2.935 2.919 2.948     .  0 0 "[    .    1    ]" 1 
       1731 1  91 GLN H    1  92 THR MG   3.400     . 5.500 4.937 4.217 5.309     .  0 0 "[    .    1    ]" 1 
       1732 1  91 GLN HA   1  92 THR H    2.100     . 2.800 2.415 2.159 2.792     .  0 0 "[    .    1    ]" 1 
       1733 1  92 THR H    1  92 THR HA   2.800     . 3.800 2.885 2.775 2.936     .  0 0 "[    .    1    ]" 1 
       1734 1  92 THR H    1  92 THR MG   2.500     . 3.800 3.444 2.306 3.835 0.035 11 0 "[    .    1    ]" 1 
       1735 1  92 THR H    1  93 ILE H    3.800     . 5.500 4.040 1.943 4.602     .  0 0 "[    .    1    ]" 1 
       1736 1  92 THR HA   1  92 THR HB   2.100     . 3.000 2.911 2.529 3.024 0.024  9 0 "[    .    1    ]" 1 
       1737 1  92 THR HA   1  92 THR MG   2.300     . 3.100 2.478 2.108 3.200 0.100 14 0 "[    .    1    ]" 1 
       1738 1  92 THR HA   1  93 ILE H    2.200     . 3.000 2.534 2.126 3.191 0.191 10 0 "[    .    1    ]" 1 
       1739 1  92 THR HA   1  94 GLU H    3.300     . 5.500 4.118 3.795 4.360     .  0 0 "[    .    1    ]" 1 
       1740 1  92 THR HB   1  92 THR MG   2.000     . 2.700 2.085 2.068 2.110     .  0 0 "[    .    1    ]" 1 
       1741 1  92 THR HB   1  93 ILE H    3.100     . 4.200 3.697 2.720 4.329 0.129 12 0 "[    .    1    ]" 1 
       1742 1  92 THR HB   1  94 GLU H    3.200     . 5.200 3.559 2.609 4.603     .  0 0 "[    .    1    ]" 1 
       1743 1  92 THR HB   1  95 LYS H    2.900     . 4.600 2.404 1.998 2.883     .  0 0 "[    .    1    ]" 1 
       1744 1  92 THR MG   1  93 ILE H    3.000     . 4.000 2.319 1.936 3.170 0.064  3 0 "[    .    1    ]" 1 
       1745 1  92 THR MG   1  93 ILE MG   2.600     . 4.000 2.699 2.367 2.995     .  0 0 "[    .    1    ]" 1 
       1746 1  92 THR MG   1  94 GLU H    2.900     . 3.900 1.960 1.858 2.115 0.042  9 0 "[    .    1    ]" 1 
       1747 1  92 THR MG   1  94 GLU QB   2.700     . 4.200 2.709 1.861 3.511     .  0 0 "[    .    1    ]" 1 
       1748 1  92 THR MG   1  94 GLU HG2  2.700     . 3.600 2.909 1.907 4.122 0.522 11 1 "[    .    1+   ]" 1 
       1749 1  92 THR MG   1  94 GLU QG   2.700     . 4.200 2.505 1.718 3.497     .  0 0 "[    .    1    ]" 1 
       1750 1  92 THR MG   1  95 LYS H    2.500     . 3.400 2.453 1.896 2.997     .  0 0 "[    .    1    ]" 1 
       1751 1  92 THR MG   1  95 LYS QB   2.500     . 3.400 2.974 2.017 3.417 0.017  7 0 "[    .    1    ]" 1 
       1752 1  92 THR MG   1  96 VAL H    2.900     . 3.900 2.057 1.859 2.234 0.041 14 0 "[    .    1    ]" 1 
       1753 1  92 THR MG   1  96 VAL QG   2.700     . 4.200 4.113 3.845 4.186     .  0 0 "[    .    1    ]" 1 
       1754 1  93 ILE H    1  93 ILE HA   2.800     . 3.800 2.742 2.247 2.946     .  0 0 "[    .    1    ]" 1 
       1755 1  93 ILE H    1  93 ILE HB   2.500     . 3.400 2.710 2.220 3.239     .  0 0 "[    .    1    ]" 1 
       1756 1  93 ILE H    1  93 ILE MD   3.200     . 5.200 3.355 2.462 3.585     .  0 0 "[    .    1    ]" 1 
       1757 1  93 ILE H    1  93 ILE MG   2.800     . 3.800 2.562 2.056 3.811 0.011 14 0 "[    .    1    ]" 1 
       1758 1  93 ILE HA   1  93 ILE HB   2.300     . 3.100 2.408 2.349 2.443     .  0 0 "[    .    1    ]" 1 
       1759 1  93 ILE HA   1  93 ILE HG13 2.800     . 4.400 2.265 2.132 2.362     .  0 0 "[    .    1    ]" 1 
       1760 1  93 ILE HA   1  93 ILE MG   2.700     . 3.600 3.196 3.168 3.204     .  0 0 "[    .    1    ]" 1 
       1761 1  93 ILE HA   1  93 ILE MG   2.500     . 3.800 2.921 2.840 2.982     .  0 0 "[    .    1    ]" 1 
       1762 1  93 ILE HA   1  94 GLU H    2.600     . 3.500 2.749 2.719 2.772     .  0 0 "[    .    1    ]" 1 
       1763 1  93 ILE HA   1  95 LYS H    2.900     . 3.900 3.350 3.258 3.440     .  0 0 "[    .    1    ]" 1 
       1764 1  93 ILE HA   1  96 VAL H    3.200 2.100 4.300 3.446 3.222 3.771     .  0 0 "[    .    1    ]" 1 
       1765 1  93 ILE HA   1  98 PHE HA   3.200     . 5.200 4.878 4.384 5.238 0.038  5 0 "[    .    1    ]" 1 
       1766 1  93 ILE HA   1  96 VAL QG   2.400     . 3.200 1.872 1.768 2.110     .  0 0 "[    .    1    ]" 1 
       1767 1  93 ILE HA   1  98 PHE H    3.400     . 5.500 5.289 4.818 5.628 0.128 13 0 "[    .    1    ]" 1 
       1768 1  93 ILE HB   1  93 ILE MD   2.300     . 3.100 1.929 1.848 1.995     .  0 0 "[    .    1    ]" 1 
       1769 1  93 ILE HB   1  93 ILE MG   2.100     . 2.800 1.906 1.836 1.963     .  0 0 "[    .    1    ]" 1 
       1770 1  93 ILE HB   1  94 GLU H    3.300 2.100 4.500 3.746 3.547 4.061     .  0 0 "[    .    1    ]" 1 
       1771 1  93 ILE HB   1  95 LYS H    3.600     . 5.500 5.276 4.935 5.527 0.027 12 0 "[    .    1    ]" 1 
       1772 1  93 ILE HB   1 143 ALA MB   2.700     . 4.500 3.985 3.545 4.443     .  0 0 "[    .    1    ]" 1 
       1773 1  93 ILE HB   1  98 PHE H    3.300     . 5.500 5.413 4.901 5.566 0.066  4 0 "[    .    1    ]" 1 
       1774 1  93 ILE MD   1  93 ILE MG   2.400     . 3.200 2.237 1.813 2.577     .  0 0 "[    .    1    ]" 1 
       1775 1  93 ILE MD   1 143 ALA HA   2.900     . 4.600 4.220 3.579 4.613 0.013  2 0 "[    .    1    ]" 1 
       1776 1  93 ILE MD   1 143 ALA MB   2.200     . 3.000 2.173 1.784 2.630     .  0 0 "[    .    1    ]" 1 
       1777 1  93 ILE MD   1 144 PHE H    3.500     . 5.500 3.158 2.633 3.642     .  0 0 "[    .    1    ]" 1 
       1778 1  93 ILE MD   1 144 PHE QR   2.700     . 3.600 2.552 2.103 3.140     .  0 0 "[    .    1    ]" 1 
       1779 1  93 ILE HG12 1 148 LEU QD   2.500     . 4.500 4.041 3.851 4.263     .  0 0 "[    .    1    ]" 1 
       1780 1  93 ILE HG13 1  93 ILE MG   2.700     . 3.600 3.170 3.107 3.199     .  0 0 "[    .    1    ]" 1 
       1781 1  93 ILE MG   1  94 GLU H    2.700     . 3.600 2.311 1.920 3.189     .  0 0 "[    .    1    ]" 1 
       1782 1  93 ILE MG   1  94 GLU QB   2.800     . 4.400 3.131 2.688 3.848     .  0 0 "[    .    1    ]" 1 
       1783 1  93 ILE MG   1  94 GLU QB   2.600     . 4.500 3.080 2.672 3.620     .  0 0 "[    .    1    ]" 1 
       1784 1  93 ILE MG   1  94 GLU QG   2.900     . 4.600 3.625 1.894 4.701 0.101 10 0 "[    .    1    ]" 1 
       1785 1  93 ILE MG   1  95 LYS H    3.000     . 4.800 4.326 4.086 4.862 0.062 12 0 "[    .    1    ]" 1 
       1786 1  93 ILE MG   1  96 VAL H    3.500     . 5.500 5.128 4.878 5.330     .  0 0 "[    .    1    ]" 1 
       1787 1  93 ILE MG   1 144 PHE QR   2.600     . 4.000 3.519 3.349 3.645     .  0 0 "[    .    1    ]" 1 
       1788 1  93 ILE MG   1 146 VAL QG   2.600     . 4.500 4.307 3.582 4.566 0.066  9 0 "[    .    1    ]" 1 
       1789 1  93 ILE MG   1 147 CYS H    3.300     . 5.500 4.120 3.761 4.446     .  0 0 "[    .    1    ]" 1 
       1790 1  93 ILE MG   1 147 CYS HA   2.900     . 4.600 4.013 3.107 4.618 0.018 11 0 "[    .    1    ]" 1 
       1791 1  93 ILE MG   1 147 CYS QB   2.500     . 3.800 2.570 1.946 3.459     .  0 0 "[    .    1    ]" 1 
       1792 1  94 GLU H    1  94 GLU QB   2.800     . 3.600 2.517 2.202 2.705     .  0 0 "[    .    1    ]" 1 
       1793 1  94 GLU H    1  94 GLU QG   2.900     . 3.900 2.687 1.969 3.923 0.023 13 0 "[    .    1    ]" 1 
       1794 1  94 GLU H    1  95 LYS H    2.800     . 3.800 2.291 1.937 2.510     .  0 0 "[    .    1    ]" 1 
       1795 1  94 GLU QB   1  95 LYS H    3.300     . 5.200 3.156 2.525 3.640     .  0 0 "[    .    1    ]" 1 
       1796 1  94 GLU QB   1  96 VAL H    3.500     . 5.500 4.802 4.543 4.947     .  0 0 "[    .    1    ]" 1 
       1797 1  94 GLU QB   1 147 CYS HA   2.800     . 4.400 3.953 3.371 4.331     .  0 0 "[    .    1    ]" 1 
       1798 1  94 GLU QG   1  95 LYS H    3.000     . 4.000 2.891 1.980 3.984 0.020  8 0 "[    .    1    ]" 1 
       1799 1  95 LYS H    1  95 LYS HA   3.000     . 4.000 2.897 2.857 2.925     .  0 0 "[    .    1    ]" 1 
       1800 1  95 LYS H    1  95 LYS QB   3.000     . 4.800 2.221 2.067 2.304     .  0 0 "[    .    1    ]" 1 
       1801 1  95 LYS H    1  96 VAL H    2.500     . 3.400 2.443 2.197 2.781     .  0 0 "[    .    1    ]" 1 
       1802 1  95 LYS H    1  96 VAL HB   3.500     . 5.500 4.885 4.426 5.501 0.001  2 0 "[    .    1    ]" 1 
       1803 1  95 LYS H    1  96 VAL QG   3.400 2.200 4.600 3.333 2.844 3.611     .  0 0 "[    .    1    ]" 1 
       1804 1  95 LYS HA   1  96 VAL H    2.700     . 3.600 2.684 2.637 2.738     .  0 0 "[    .    1    ]" 1 
       1805 1  95 LYS QB   1  96 VAL HA   3.200     . 5.200 3.993 3.774 4.231     .  0 0 "[    .    1    ]" 1 
       1806 1  96 VAL H    1  96 VAL HB   2.400     . 3.200 2.738 2.425 3.215 0.015  7 0 "[    .    1    ]" 1 
       1807 1  96 VAL H    1  96 VAL QG   2.500     . 3.400 2.064 1.863 2.250     .  0 0 "[    .    1    ]" 1 
       1808 1  96 VAL H    1  97 SER H    3.400     . 5.500 4.582 4.388 4.657     .  0 0 "[    .    1    ]" 1 
       1809 1  96 VAL H    1 113 CYS QB   3.400     . 5.500 5.405 4.303 5.534 0.034  7 0 "[    .    1    ]" 1 
       1810 1  96 VAL H    1 144 PHE QR   3.400     . 5.500 5.332 4.915 5.515 0.015 12 0 "[    .    1    ]" 1 
       1811 1  96 VAL HA   1  96 VAL QG   2.400     . 3.200 2.122 1.886 2.282     .  0 0 "[    .    1    ]" 1 
       1812 1  96 VAL HA   1  97 SER H    2.500     . 3.400 2.326 2.151 2.502     .  0 0 "[    .    1    ]" 1 
       1813 1  96 VAL HA   1  98 PHE H    3.100     . 5.000 3.150 2.964 3.453     .  0 0 "[    .    1    ]" 1 
       1814 1  96 VAL HA   1 113 CYS H    3.700     . 5.500 5.341 5.137 5.551 0.051  9 0 "[    .    1    ]" 1 
       1815 1  96 VAL HA   1 113 CYS HA   2.600     . 3.500 3.134 2.782 3.539 0.039 13 0 "[    .    1    ]" 1 
       1816 1  96 VAL HA   1 113 CYS QB   2.900     . 4.600 3.106 1.920 3.421     .  0 0 "[    .    1    ]" 1 
       1817 1  96 VAL HB   1  97 SER H    3.600     . 5.500 3.377 2.222 3.835     .  0 0 "[    .    1    ]" 1 
       1818 1  96 VAL HB   1  98 PHE H    3.400 2.200 4.600 3.451 2.118 4.715 0.115 10 0 "[    .    1    ]" 1 
       1819 1  96 VAL QG   1  98 PHE QE   2.800     . 4.400 3.504 3.156 3.903     .  0 0 "[    .    1    ]" 1 
       1820 1  96 VAL MG1  1  96 VAL MG2  2.300     . 3.100 2.063 1.926 2.105     .  0 0 "[    .    1    ]" 1 
       1821 1  96 VAL QG   1  97 SER H    3.000     . 4.800 1.929 1.818 2.252     .  0 0 "[    .    1    ]" 1 
       1822 1  96 VAL QG   1  98 PHE H    3.200     . 3.500 2.246 1.698 3.140 0.002  1 0 "[    .    1    ]" 1 
       1823 1  96 VAL QG   1 111 TYR HB3  2.800     . 4.400 3.040 2.395 3.674     .  0 0 "[    .    1    ]" 1 
       1824 1  96 VAL QG   1 112 ILE H    3.500 2.300 4.700 2.767 2.303 3.264     .  0 0 "[    .    1    ]" 1 
       1825 1  96 VAL QG   1 113 CYS H    3.400     . 5.500 3.854 3.484 4.118     .  0 0 "[    .    1    ]" 1 
       1826 1  96 VAL QG   1 122 MET H    3.200     . 5.200 5.149 4.921 5.263 0.063 12 0 "[    .    1    ]" 1 
       1827 1  96 VAL QG   1 144 PHE QE   2.700     . 4.200 3.070 2.619 3.609     .  0 0 "[    .    1    ]" 1 
       1828 1  96 VAL MG1  1  96 VAL MG2  2.100     . 2.800 1.816 1.630 2.085     .  0 0 "[    .    1    ]" 1 
       1829 1  97 SER H    1  98 PHE H    2.600     . 3.500 2.728 2.546 2.857     .  0 0 "[    .    1    ]" 1 
       1830 1  97 SER H    1  98 PHE HA   3.400     . 5.500 4.458 4.237 4.652     .  0 0 "[    .    1    ]" 1 
       1831 1  97 SER H    1  98 PHE QB   3.800     . 5.500 5.470 5.260 5.597 0.097 10 0 "[    .    1    ]" 1 
       1832 1  97 SER H    1 112 ILE H    3.600     . 5.500 4.067 3.467 4.689     .  0 0 "[    .    1    ]" 1 
       1833 1  97 SER H    1 113 CYS HA   3.000     . 4.000 2.237 1.974 2.662 0.026  8 0 "[    .    1    ]" 1 
       1834 1  97 SER H    1 113 CYS QB   3.800     . 5.500 3.412 2.337 3.883     .  0 0 "[    .    1    ]" 1 
       1835 1  97 SER H    1 114 ARG H    3.500     . 5.500 3.899 3.205 4.763     .  0 0 "[    .    1    ]" 1 
       1836 1  98 PHE H    1  98 PHE HA   2.900     . 3.900 2.360 2.275 2.652     .  0 0 "[    .    1    ]" 1 
       1837 1  98 PHE H    1  98 PHE QB   3.200 2.100 4.300 3.501 3.455 3.544     .  0 0 "[    .    1    ]" 1 
       1838 1  98 PHE H    1  99 CYS H    3.700     . 5.500 4.269 1.908 4.602     .  0 0 "[    .    1    ]" 1 
       1839 1  98 PHE H    1 112 ILE H    3.200 2.100 4.300 3.746 3.329 3.876     .  0 0 "[    .    1    ]" 1 
       1840 1  98 PHE H    1 112 ILE H    3.100     . 4.200 4.056 3.447 4.248 0.048 14 0 "[    .    1    ]" 1 
       1841 1  98 PHE H    1 112 ILE HB   3.300 2.100 4.500 3.821 2.985 4.326     .  0 0 "[    .    1    ]" 1 
       1842 1  98 PHE H    1 112 ILE MD   3.700     . 5.500 4.669 3.394 5.221     .  0 0 "[    .    1    ]" 1 
       1843 1  98 PHE H    1 144 PHE QE   3.400     . 5.500 3.940 3.408 4.625     .  0 0 "[    .    1    ]" 1 
       1844 1  98 PHE HA   1  99 CYS H    2.500     . 3.400 2.639 2.191 3.402 0.002 10 0 "[    .    1    ]" 1 
       1845 1  98 PHE QB   1  99 CYS H    3.600     . 5.500 2.154 1.766 3.211     .  0 0 "[    .    1    ]" 1 
       1846 1  98 PHE QB   1 112 ILE MD   2.800     . 4.400 3.993 2.835 4.453 0.053 10 0 "[    .    1    ]" 1 
       1847 1  99 CYS H    1  99 CYS HB2  3.600     . 5.500 2.632 2.059 3.319     .  0 0 "[    .    1    ]" 1 
       1848 1  99 CYS H    1 100 ALA H    3.100     . 4.500 4.461 4.357 4.521 0.021  2 0 "[    .    1    ]" 1 
       1849 1  99 CYS H    1 100 ALA MB   3.700     . 5.500 4.656 4.191 5.161     .  0 0 "[    .    1    ]" 1 
       1850 1  99 CYS H    1 110 SER H    3.400     . 5.500 4.974 4.238 5.594 0.094 10 0 "[    .    1    ]" 1 
       1851 1  99 CYS H    1 144 PHE QE   3.200     . 5.200 3.406 2.857 4.624     .  0 0 "[    .    1    ]" 1 
       1852 1  99 CYS HA   1 100 ALA H    2.500     . 3.400 2.495 2.204 2.699     .  0 0 "[    .    1    ]" 1 
       1853 1  99 CYS HA   1 111 TYR HA   2.700     . 4.200 2.086 1.912 2.707     .  0 0 "[    .    1    ]" 1 
       1854 1  99 CYS HA   1 112 ILE H    3.100     . 5.000 3.793 3.526 4.394     .  0 0 "[    .    1    ]" 1 
       1855 1  99 CYS HB2  1 100 ALA H    3.100     . 4.200 2.483 1.937 3.942 0.063  8 0 "[    .    1    ]" 1 
       1856 1  99 CYS HB2  1 110 SER H    2.900     . 3.900 3.585 2.985 4.348 0.448  1 0 "[    .    1    ]" 1 
       1857 1  99 CYS HB2  1 140 VAL QG   3.200     . 5.200 2.612 2.043 3.269     .  0 0 "[    .    1    ]" 1 
       1858 1  99 CYS HB3  1 100 ALA H    2.900     . 4.600 3.592 2.535 4.147     .  0 0 "[    .    1    ]" 1 
       1859 1  99 CYS HB3  1 140 VAL HB   2.900     . 4.600 2.932 2.663 3.150     .  0 0 "[    .    1    ]" 1 
       1860 1 100 ALA H    1 100 ALA HA   3.000     . 4.000 2.813 2.719 2.889     .  0 0 "[    .    1    ]" 1 
       1861 1 100 ALA H    1 100 ALA MB   2.800     . 3.800 2.853 2.745 2.998     .  0 0 "[    .    1    ]" 1 
       1862 1 100 ALA H    1 109 PHE HA   3.500     . 5.500 5.116 4.764 5.506 0.006  9 0 "[    .    1    ]" 1 
       1863 1 100 ALA H    1 110 SER H    3.000     . 4.000 3.250 2.919 3.527     .  0 0 "[    .    1    ]" 1 
       1864 1 100 ALA H    1 111 TYR HA   2.900     . 4.600 3.457 3.083 3.923     .  0 0 "[    .    1    ]" 1 
       1865 1 100 ALA H    2   4 GLY QA   3.300     . 5.500 4.797 4.072 5.322     .  0 0 "[    .    1    ]" 1 
       1866 1 100 ALA HA   1 100 ALA MB   2.400     . 3.200 2.089 2.078 2.118     .  0 0 "[    .    1    ]" 1 
       1867 1 100 ALA HA   1 102 ASP H    3.700     . 5.500 5.527 5.388 5.605 0.105  7 0 "[    .    1    ]" 1 
       1868 1 100 ALA HA   1 110 SER H    3.600     . 5.500 4.614 4.430 4.895     .  0 0 "[    .    1    ]" 1 
       1869 1 100 ALA MB   1 101 PRO QB   3.300     . 5.500 5.073 4.835 5.202     .  0 0 "[    .    1    ]" 1 
       1870 1 100 ALA MB   1 112 ILE HG12 3.000     . 4.800 2.309 1.919 3.679     .  0 0 "[    .    1    ]" 1 
       1871 1 100 ALA MB   2   1 ALA MB   3.200     . 5.200 4.625 4.351 4.904     .  0 0 "[    .    1    ]" 1 
       1872 1 100 ALA MB   2   5 PRO HB2  2.700     . 4.200 4.072 3.517 4.237 0.037  3 0 "[    .    1    ]" 1 
       1873 1 100 ALA MB   2   5 PRO HD3  2.500     . 3.400 3.246 2.908 3.420 0.020 13 0 "[    .    1    ]" 1 
       1874 1 101 PRO HA   1 102 ASP H    2.500     . 3.400 2.292 2.134 3.469 0.069 13 0 "[    .    1    ]" 1 
       1875 1 101 PRO HA   1 102 ASP H    2.600     . 4.000 2.214 1.887 3.383     .  0 0 "[    .    1    ]" 1 
       1876 1 101 PRO HA   1 109 PHE HB3  2.700     . 4.200 3.351 2.207 4.238 0.038 14 0 "[    .    1    ]" 1 
       1877 1 101 PRO HA   1 110 SER H    2.900     . 4.600 3.077 2.602 3.800     .  0 0 "[    .    1    ]" 1 
       1878 1 102 ASP H    1 102 ASP QB   2.700     . 3.600 2.603 2.266 2.936     .  0 0 "[    .    1    ]" 1 
       1879 1 102 ASP H    1 108 GLY H    3.800     . 5.500 5.302 4.603 5.579 0.079  4 0 "[    .    1    ]" 1 
       1880 1 102 ASP H    1 111 TYR QD   3.600     . 5.500 4.913 4.664 5.519 0.019  4 0 "[    .    1    ]" 1 
       1881 1 102 ASP QB   1 103 ARG H    3.600     . 5.500 2.758 1.921 4.032     .  0 0 "[    .    1    ]" 1 
       1882 1 102 ASP QB   1 104 ASN H    3.600     . 5.500 3.689 2.442 4.449     .  0 0 "[    .    1    ]" 1 
       1883 1 102 ASP QB   1 108 GLY H    3.400     . 5.500 4.790 3.707 5.302     .  0 0 "[    .    1    ]" 1 
       1884 1 103 ARG H    1 103 ARG HA   2.900     . 3.900 2.791 2.298 2.939     .  0 0 "[    .    1    ]" 1 
       1885 1 103 ARG H    1 103 ARG QB   2.500     . 3.400 2.930 2.371 3.501 0.101 14 0 "[    .    1    ]" 1 
       1886 1 103 ARG H    1 103 ARG QB   2.600     . 4.000 2.767 2.023 3.350     .  0 0 "[    .    1    ]" 1 
       1887 1 103 ARG H    1 103 ARG HD2  3.700     . 5.500 4.910 3.595 5.820 0.320 13 0 "[    .    1    ]" 1 
       1888 1 103 ARG H    1 104 ASN H    2.700     . 3.600 2.335 1.924 3.659 0.059  8 0 "[    .    1    ]" 1 
       1889 1 103 ARG H    1 104 ASN HA   2.600     . 4.500 4.198 3.862 4.655 0.155  7 0 "[    .    1    ]" 1 
       1890 1 103 ARG H    1 105 HIS H    3.400     . 5.500 3.911 3.034 5.090     .  0 0 "[    .    1    ]" 1 
       1891 1 103 ARG HA   1 103 ARG QB   2.200     . 3.000 2.136 1.949 2.435     .  0 0 "[    .    1    ]" 1 
       1892 1 103 ARG HA   1 103 ARG HD2  2.900     . 4.600 3.937 2.422 4.866 0.266  3 0 "[    .    1    ]" 1 
       1893 1 103 ARG HA   1 103 ARG HD3  3.100     . 5.000 4.089 2.552 5.072 0.072  8 0 "[    .    1    ]" 1 
       1894 1 103 ARG HA   1 104 ASN H    2.900     . 4.600 2.914 2.125 3.543     .  0 0 "[    .    1    ]" 1 
       1895 1 103 ARG HA   1 105 HIS H    3.700     . 5.500 3.974 3.011 4.875     .  0 0 "[    .    1    ]" 1 
       1896 1 103 ARG HA   1 105 HIS QB   3.200     . 5.200 4.764 4.054 5.062     .  0 0 "[    .    1    ]" 1 
       1897 1 103 ARG QB   1 103 ARG HD2  2.800     . 4.400 2.491 1.938 3.293     .  0 0 "[    .    1    ]" 1 
       1898 1 103 ARG QB   1 103 ARG HD3  2.300     . 3.100 2.515 1.944 3.210 0.110 12 0 "[    .    1    ]" 1 
       1899 1 103 ARG QB   1 105 HIS H    3.600     . 5.500 3.169 2.455 3.857     .  0 0 "[    .    1    ]" 1 
       1900 1 103 ARG QB   1 104 ASN H    3.400 2.200 4.600 3.512 2.561 3.710     .  0 0 "[    .    1    ]" 1 
       1901 1 103 ARG QB   1 105 HIS HA   3.100     . 5.000 4.855 4.355 5.071 0.071  6 0 "[    .    1    ]" 1 
       1902 1 103 ARG HD2  1 104 ASN H    3.800     . 5.500 4.477 4.192 4.866     .  0 0 "[    .    1    ]" 1 
       1903 1 104 ASN H    1 104 ASN HA   2.700     . 3.600 2.468 2.268 2.851     .  0 0 "[    .    1    ]" 1 
       1904 1 104 ASN H    1 104 ASN HB2  2.600     . 3.500 2.789 2.109 3.524 0.024 10 0 "[    .    1    ]" 1 
       1905 1 104 ASN H    1 104 ASN HB3  2.900     . 3.900 3.636 3.389 3.939 0.039  9 0 "[    .    1    ]" 1 
       1906 1 104 ASN H    1 105 HIS H    2.400     . 3.200 2.821 2.637 2.992     .  0 0 "[    .    1    ]" 1 
       1907 1 104 ASN HA   1 105 HIS H    3.100     . 4.200 3.078 2.703 3.442     .  0 0 "[    .    1    ]" 1 
       1908 1 104 ASN HA   1 106 GLU H    3.100     . 4.200 3.495 3.082 4.106     .  0 0 "[    .    1    ]" 1 
       1909 1 104 ASN HA   1 106 GLU HA   3.100     . 5.000 4.612 4.241 5.014 0.014  3 0 "[    .    1    ]" 1 
       1910 1 104 ASN HA   1 107 ARG HE   2.200     . 4.500 3.767 2.774 4.519 0.019  3 0 "[    .    1    ]" 1 
       1911 1 104 ASN HA   1 107 ARG QG   3.300     . 5.500 5.151 4.007 5.540 0.040 14 0 "[    .    1    ]" 1 
       1912 1 104 ASN HB2  1 105 HIS HA   2.500     . 4.500 4.427 4.009 4.862 0.362 13 0 "[    .    1    ]" 1 
       1913 1 105 HIS H    1 105 HIS HA   2.800     . 3.800 2.753 2.283 2.941     .  0 0 "[    .    1    ]" 1 
       1914 1 105 HIS H    1 105 HIS QB   3.200 2.100 4.300 2.521 2.066 3.150 0.034 14 0 "[    .    1    ]" 1 
       1915 1 105 HIS H    1 106 GLU H    3.300     . 5.500 2.649 1.929 3.402     .  0 0 "[    .    1    ]" 1 
       1916 1 105 HIS H    1 108 GLY H    3.700     . 5.500 4.501 3.963 5.351     .  0 0 "[    .    1    ]" 1 
       1917 1 105 HIS HA   1 105 HIS QB   2.600     . 3.500 2.439 2.183 2.538     .  0 0 "[    .    1    ]" 1 
       1918 1 105 HIS HA   1 105 HIS HD2  2.900     . 4.600 3.381 2.059 4.607 0.007  1 0 "[    .    1    ]" 1 
       1919 1 105 HIS HA   1 106 GLU H    2.800     . 4.400 3.345 2.483 3.571     .  0 0 "[    .    1    ]" 1 
       1920 1 105 HIS HA   1 106 GLU HA   2.700     . 4.200 4.339 4.235 4.479 0.279  8 0 "[    .    1    ]" 1 
       1921 1 105 HIS HA   1 106 GLU QG   2.800     . 4.400 4.128 3.686 4.800 0.400  5 0 "[    .    1    ]" 1 
       1922 1 105 HIS HA   1 107 ARG H    3.600     . 5.500 4.432 3.989 4.946     .  0 0 "[    .    1    ]" 1 
       1923 1 106 GLU H    1 106 GLU QG   3.300     . 5.500 3.492 1.991 4.298     .  0 0 "[    .    1    ]" 1 
       1924 1 106 GLU H    1 107 ARG H    3.600     . 5.500 2.208 1.900 3.045     .  0 0 "[    .    1    ]" 1 
       1925 1 106 GLU H    1 107 ARG QD   3.000     . 4.800 4.352 2.749 4.824 0.024  8 0 "[    .    1    ]" 1 
       1926 1 106 GLU H    1 107 ARG HE   3.200 2.100 4.300 3.700 3.118 4.300     .  0 0 "[    .    1    ]" 1 
       1927 1 106 GLU HA   1 106 GLU QB   2.300     . 3.100 2.412 2.144 2.537     .  0 0 "[    .    1    ]" 1 
       1928 1 106 GLU HA   1 106 GLU QG   2.300     . 3.100 2.492 2.015 3.238 0.138  6 0 "[    .    1    ]" 1 
       1929 1 106 GLU HA   1 107 ARG H    3.300 2.100 4.500 2.925 2.384 3.440     .  0 0 "[    .    1    ]" 1 
       1930 1 106 GLU HA   1 107 ARG HA   3.100     . 5.000 4.817 4.283 5.178 0.178  3 0 "[    .    1    ]" 1 
       1931 1 106 GLU HA   1 108 GLY H    3.200     . 5.200 4.767 4.126 5.245 0.045  4 0 "[    .    1    ]" 1 
       1932 1 106 GLU HA   1 133 GLY H    3.100     . 4.200 3.766 3.621 3.929     .  0 0 "[    .    1    ]" 1 
       1933 1 106 GLU QB   1 107 ARG H    3.300     . 5.500 3.747 2.989 3.972     .  0 0 "[    .    1    ]" 1 
       1934 1 106 GLU QB   1 107 ARG QB   2.800     . 4.400 4.202 4.046 4.295     .  0 0 "[    .    1    ]" 1 
       1935 1 106 GLU QB   1 107 ARG QB   2.700     . 4.200 3.834 3.510 4.085     .  0 0 "[    .    1    ]" 1 
       1936 1 106 GLU QG   1 107 ARG H    3.400     . 5.500 4.350 3.395 4.898     .  0 0 "[    .    1    ]" 1 
       1937 1 107 ARG H    1 107 ARG HA   2.900     . 3.900 2.373 2.271 2.719     .  0 0 "[    .    1    ]" 1 
       1938 1 107 ARG H    1 107 ARG QB   3.000     . 4.000 2.771 2.611 3.029     .  0 0 "[    .    1    ]" 1 
       1939 1 107 ARG H    1 107 ARG QD   3.600     . 5.500 3.331 2.018 4.803     .  0 0 "[    .    1    ]" 1 
       1940 1 107 ARG H    1 108 GLY H    2.500     . 3.400 2.557 1.942 2.929     .  0 0 "[    .    1    ]" 1 
       1941 1 107 ARG HA   1 107 ARG QB   2.500     . 3.400 2.195 2.101 2.274     .  0 0 "[    .    1    ]" 1 
       1942 1 107 ARG HA   1 108 GLY H    2.900     . 4.600 2.918 2.521 3.501     .  0 0 "[    .    1    ]" 1 
       1943 1 107 ARG HA   1 128 ALA H    3.400     . 5.500 5.092 3.519 5.547 0.047  4 0 "[    .    1    ]" 1 
       1944 1 107 ARG HA   1 128 ALA MB   2.900     . 4.600 4.022 2.214 4.631 0.031  4 0 "[    .    1    ]" 1 
       1945 1 107 ARG HA   1 132 SER H    3.000     . 4.800 4.470 3.075 4.831 0.031  8 0 "[    .    1    ]" 1 
       1946 1 107 ARG HA   1 133 GLY H    2.700     . 3.600 3.313 2.314 3.646 0.046  8 0 "[    .    1    ]" 1 
       1947 1 107 ARG QB   1 107 ARG HE   3.400     . 5.500 2.533 2.085 2.954     .  0 0 "[    .    1    ]" 1 
       1948 1 107 ARG QB   1 108 GLY H    3.200     . 5.200 3.405 2.295 3.766     .  0 0 "[    .    1    ]" 1 
       1949 1 107 ARG QB   1 128 ALA MB   2.400     . 3.200 2.884 2.462 3.232 0.032  5 0 "[    .    1    ]" 1 
       1950 1 107 ARG QB   1 132 SER HA   2.700     . 4.200 2.342 1.844 3.525     .  0 0 "[    .    1    ]" 1 
       1951 1 107 ARG QB   1 132 SER HA   2.700     . 3.600 2.349 1.844 3.577     .  0 0 "[    .    1    ]" 1 
       1952 1 107 ARG QB   1 133 GLY H    3.200     . 5.200 2.403 1.832 3.762     .  0 0 "[    .    1    ]" 1 
       1953 1 107 ARG QB   1 128 ALA H    3.500 2.300 4.700 4.015 3.713 4.396     .  0 0 "[    .    1    ]" 1 
       1954 1 107 ARG QB   1 128 ALA MB   2.600     . 4.000 2.807 2.455 3.055     .  0 0 "[    .    1    ]" 1 
       1955 1 107 ARG QB   1 128 ALA MB   2.500     . 3.400 2.824 2.462 3.073     .  0 0 "[    .    1    ]" 1 
       1956 1 107 ARG QD   1 132 SER HA   2.800     . 4.400 3.036 2.039 4.318     .  0 0 "[    .    1    ]" 1 
       1957 1 107 ARG HD2  1 128 ALA H    3.400     . 5.500 5.374 5.150 5.595 0.095  8 0 "[    .    1    ]" 1 
       1958 1 107 ARG HD2  1 128 ALA MB   2.700     . 4.200 4.392 4.152 4.738 0.538  4 2 "[   +.  - 1    ]" 1 
       1959 1 107 ARG HD2  1 131 ASP H    3.200     . 5.200 4.514 4.099 4.767     .  0 0 "[    .    1    ]" 1 
       1960 1 107 ARG QG   1 132 SER HA   3.100     . 5.000 2.690 1.850 5.015 0.015  6 0 "[    .    1    ]" 1 
       1961 1 108 GLY H    1 108 GLY QA   2.500     . 3.400 2.350 2.228 2.425     .  0 0 "[    .    1    ]" 1 
       1962 1 108 GLY H    1 109 PHE H    3.300 2.100 4.500 4.392 4.116 4.531 0.031  9 0 "[    .    1    ]" 1 
       1963 1 108 GLY H    1 127 LEU QD   3.400 2.200 4.600 3.772 3.317 4.448     .  0 0 "[    .    1    ]" 1 
       1964 1 108 GLY QA   1 109 PHE H    2.700     . 3.600 2.140 2.098 2.201     .  0 0 "[    .    1    ]" 1 
       1965 1 108 GLY QA   1 127 LEU QD   2.800     . 4.400 2.079 1.715 2.439     .  0 0 "[    .    1    ]" 1 
       1966 1 108 GLY QA   1 127 LEU HG   2.800     . 4.400 3.734 2.643 4.426 0.026 10 0 "[    .    1    ]" 1 
       1967 1 108 GLY HA2  1 126 PHE H    3.600     . 5.500 3.413 2.660 4.469     .  0 0 "[    .    1    ]" 1 
       1968 1 109 PHE H    1 109 PHE HA   3.000     . 4.000 2.934 2.913 2.949     .  0 0 "[    .    1    ]" 1 
       1969 1 109 PHE H    1 109 PHE HB2  3.400 2.200 4.600 2.809 2.304 3.247     .  0 0 "[    .    1    ]" 1 
       1970 1 109 PHE H    1 109 PHE HB3  2.900     . 3.900 3.688 3.214 3.925 0.025  1 0 "[    .    1    ]" 1 
       1971 1 109 PHE H    1 110 SER H    3.600     . 5.500 4.431 4.321 4.551     .  0 0 "[    .    1    ]" 1 
       1972 1 109 PHE H    1 125 GLY HA3  3.400     . 5.500 4.678 3.156 5.468     .  0 0 "[    .    1    ]" 1 
       1973 1 109 PHE H    1 126 PHE H    3.100     . 4.200 3.964 3.530 4.224 0.024  2 0 "[    .    1    ]" 1 
       1974 1 109 PHE H    1 127 LEU QD   3.200 2.100 4.300 3.694 2.586 4.128     .  0 0 "[    .    1    ]" 1 
       1975 1 109 PHE H    1 128 ALA H    3.500     . 5.500 3.869 3.539 4.258     .  0 0 "[    .    1    ]" 1 
       1976 1 109 PHE HA   1 109 PHE HB2  3.000     . 4.800 2.955 2.825 3.012     .  0 0 "[    .    1    ]" 1 
       1977 1 109 PHE HA   1 110 SER H    2.300     . 3.100 2.566 2.318 2.791     .  0 0 "[    .    1    ]" 1 
       1978 1 109 PHE HB2  1 110 SER H    3.300 2.100 4.500 3.181 2.465 3.988     .  0 0 "[    .    1    ]" 1 
       1979 1 109 PHE HB3  1 110 SER H    3.200     . 5.200 2.389 1.944 2.930     .  0 0 "[    .    1    ]" 1 
       1980 1 109 PHE HB3  1 126 PHE H    3.900     . 5.500 5.328 4.030 6.217 0.717  6 2 "[   -.+   1    ]" 1 
       1981 1 110 SER H    1 110 SER HA   2.900     . 3.900 2.840 2.743 2.934     .  0 0 "[    .    1    ]" 1 
       1982 1 110 SER H    1 110 SER QB   3.100     . 5.000 3.017 2.555 3.452     .  0 0 "[    .    1    ]" 1 
       1983 1 110 SER H    1 111 TYR H    3.300     . 5.500 4.020 3.702 4.256     .  0 0 "[    .    1    ]" 1 
       1984 1 110 SER H    1 111 TYR QD   3.400     . 5.500 3.845 3.055 5.158     .  0 0 "[    .    1    ]" 1 
       1985 1 110 SER H    1 126 PHE QD   3.500     . 5.500 4.464 3.833 5.431     .  0 0 "[    .    1    ]" 1 
       1986 1 110 SER HA   1 111 TYR H    2.300     . 3.100 2.153 2.135 2.181     .  0 0 "[    .    1    ]" 1 
       1987 1 110 SER HA   1 125 GLY HA2  3.200     . 5.200 2.758 2.116 3.014     .  0 0 "[    .    1    ]" 1 
       1988 1 110 SER HA   1 126 PHE QD   2.800     . 4.400 2.626 1.943 3.571     .  0 0 "[    .    1    ]" 1 
       1989 1 110 SER QB   1 111 TYR H    2.700     . 3.600 3.442 3.038 3.655 0.055 13 0 "[    .    1    ]" 1 
       1990 1 111 TYR C    1 124 HIS N    4.100 3.800 4.400 3.902 3.794 4.024 0.006 12 0 "[    .    1    ]" 1 
       1991 1 111 TYR H    1 111 TYR HA   2.900     . 3.900 2.924 2.896 2.944     .  0 0 "[    .    1    ]" 1 
       1992 1 111 TYR H    1 111 TYR QD   2.900     . 4.600 2.904 2.262 3.270     .  0 0 "[    .    1    ]" 1 
       1993 1 111 TYR H    1 112 ILE H    3.100     . 5.000 4.438 4.306 4.506     .  0 0 "[    .    1    ]" 1 
       1994 1 111 TYR H    1 112 ILE H    3.300     . 5.500 3.914 3.535 4.206     .  0 0 "[    .    1    ]" 1 
       1995 1 111 TYR H    1 124 HIS H    3.000     . 4.000 3.610 3.257 3.892     .  0 0 "[    .    1    ]" 1 
       1996 1 111 TYR H    1 124 HIS HB2  3.400 2.200 4.600 2.341 2.149 2.621 0.051  4 0 "[    .    1    ]" 1 
       1997 1 111 TYR H    1 124 HIS HB3  3.500 2.300 4.700 3.435 3.095 3.769     .  0 0 "[    .    1    ]" 1 
       1998 1 111 TYR H    1 125 GLY HA2  3.500     . 5.500 4.090 3.356 4.431     .  0 0 "[    .    1    ]" 1 
       1999 1 111 TYR H    1 126 PHE QD   3.400 2.200 4.600 3.108 2.378 3.631     .  0 0 "[    .    1    ]" 1 
       2000 1 111 TYR HA   1 112 ILE H    2.600     . 3.500 2.455 2.389 2.533     .  0 0 "[    .    1    ]" 1 
       2001 1 111 TYR HA   1 112 ILE H    2.700     . 3.600 2.468 2.402 2.551     .  0 0 "[    .    1    ]" 1 
       2002 1 111 TYR HB2  1 112 ILE H    2.900     . 3.900 2.950 2.543 3.228     .  0 0 "[    .    1    ]" 1 
       2003 1 111 TYR HB3  1 112 ILE H    3.100     . 5.000 2.079 1.945 2.319     .  0 0 "[    .    1    ]" 1 
       2004 1 111 TYR HB3  1 112 ILE MG   2.600     . 4.500 3.919 3.831 4.079     .  0 0 "[    .    1    ]" 1 
       2005 1 111 TYR HB3  1 112 ILE MG   2.700     . 4.200 3.980 3.911 4.104     .  0 0 "[    .    1    ]" 1 
       2006 1 111 TYR HB3  1 113 CYS H    3.800     . 5.500 5.158 4.980 5.427     .  0 0 "[    .    1    ]" 1 
       2007 1 111 TYR QD   1 112 ILE H    3.100     . 4.200 4.071 3.592 4.228 0.028 14 0 "[    .    1    ]" 1 
       2008 1 111 TYR QD   1 113 CYS H    3.500     . 5.500 5.433 5.311 5.530 0.030 12 0 "[    .    1    ]" 1 
       2009 1 111 TYR QD   1 113 CYS H    3.800     . 5.500 5.518 5.331 5.601 0.101 10 0 "[    .    1    ]" 1 
       2010 1 111 TYR QE   1 141 GLY H    3.600     . 5.500 4.742 4.047 5.426     .  0 0 "[    .    1    ]" 1 
       2011 1 111 TYR N    1 124 HIS C    4.100 3.800 4.400 3.863 3.773 4.033 0.027  1 0 "[    .    1    ]" 1 
       2012 1 111 TYR N    1 124 HIS O    3.000 2.800 3.200 2.887 2.783 3.188 0.017  9 0 "[    .    1    ]" 1 
       2013 1 111 TYR O    1 124 HIS N    3.000 2.800 3.200 3.031 2.895 3.181     .  0 0 "[    .    1    ]" 1 
       2014 1 112 ILE H    1 112 ILE MD   2.800     . 4.400 4.129 3.983 4.219     .  0 0 "[    .    1    ]" 1 
       2015 1 112 ILE H    1 112 ILE QG   2.800     . 3.800 2.454 2.298 2.554     .  0 0 "[    .    1    ]" 1 
       2016 1 112 ILE H    1 112 ILE MG   2.700     . 4.200 3.485 3.410 3.580     .  0 0 "[    .    1    ]" 1 
       2017 1 112 ILE H    1 113 CYS H    3.000     . 4.000 3.558 3.349 3.639     .  0 0 "[    .    1    ]" 1 
       2018 1 112 ILE HA   1 112 ILE MG   2.700     . 3.600 2.036 1.991 2.117     .  0 0 "[    .    1    ]" 1 
       2019 1 112 ILE HA   1 113 CYS H    2.300     . 3.100 2.244 2.176 2.351     .  0 0 "[    .    1    ]" 1 
       2020 1 112 ILE HA   1 124 HIS H    2.500     . 3.800 2.343 2.123 2.473     .  0 0 "[    .    1    ]" 1 
       2021 1 112 ILE HA   1 124 HIS H    3.300     . 5.500 3.305 2.689 3.613     .  0 0 "[    .    1    ]" 1 
       2022 1 112 ILE HB   1 113 CYS H    3.400     . 5.500 2.953 2.522 3.313     .  0 0 "[    .    1    ]" 1 
       2023 1 112 ILE HB   1 113 CYS H    3.200     . 5.200 2.879 2.507 3.184     .  0 0 "[    .    1    ]" 1 
       2024 1 112 ILE MD   1 112 ILE MG   2.000     . 2.700 2.199 1.920 2.565     .  0 0 "[    .    1    ]" 1 
       2025 1 112 ILE HG12 1 112 ILE MG   2.100     . 2.800 2.251 2.015 2.404     .  0 0 "[    .    1    ]" 1 
       2026 1 112 ILE MG   1 113 CYS H    2.600     . 3.500 3.219 2.855 3.555 0.055 13 0 "[    .    1    ]" 1 
       2027 1 112 ILE MG   1 122 MET H    3.500     . 5.500 4.964 4.482 5.230     .  0 0 "[    .    1    ]" 1 
       2028 1 112 ILE MG   1 123 CYS HA   2.800     . 4.400 1.982 1.866 2.248     .  0 0 "[    .    1    ]" 1 
       2029 1 112 ILE MG   1 123 CYS QB   2.900     . 4.600 3.186 2.755 3.446     .  0 0 "[    .    1    ]" 1 
       2030 1 112 ILE MG   1 124 HIS H    3.400     . 5.500 2.840 2.648 3.088     .  0 0 "[    .    1    ]" 1 
       2031 1 112 ILE MG   1 124 HIS HB2  2.700     . 4.500 4.519 4.471 4.571 0.071 12 0 "[    .    1    ]" 1 
       2032 1 112 ILE MG   1 124 HIS HD2  2.400     . 3.600 3.513 3.253 3.624 0.024 12 0 "[    .    1    ]" 1 
       2033 1 113 CYS H    1 115 ASP H    3.300     . 5.500 4.620 4.342 4.847     .  0 0 "[    .    1    ]" 1 
       2034 1 113 CYS H    1 121 TRP HA   3.500     . 5.500 4.318 4.172 4.551     .  0 0 "[    .    1    ]" 1 
       2035 1 113 CYS H    1 122 MET H    2.900     . 3.900 3.820 3.524 3.934 0.034 13 0 "[    .    1    ]" 1 
       2036 1 113 CYS H    1 123 CYS QB   3.700     . 5.500 5.513 5.427 5.539 0.039  5 0 "[    .    1    ]" 1 
       2037 1 113 CYS H    1 124 HIS HD2  3.500     . 5.500 3.193 2.838 3.728     .  0 0 "[    .    1    ]" 1 
       2038 1 113 CYS HA   1 114 ARG H    2.700     . 3.600 2.279 2.137 2.446     .  0 0 "[    .    1    ]" 1 
       2039 1 113 CYS QB   1 114 ARG H    2.900     . 3.900 2.975 2.427 3.756     .  0 0 "[    .    1    ]" 1 
       2040 1 113 CYS N    1 122 MET C    4.100 3.800 4.400 4.287 4.101 4.412 0.012 13 0 "[    .    1    ]" 1 
       2041 1 113 CYS N    1 122 MET O    3.000 2.800 3.200 3.144 2.929 3.218 0.018  3 0 "[    .    1    ]" 1 
       2042 1 114 ARG H    1 114 ARG QB   3.200     . 5.200 2.802 2.092 3.074     .  0 0 "[    .    1    ]" 1 
       2043 1 114 ARG H    1 114 ARG QG   2.800     . 4.400 2.426 1.926 4.130     .  0 0 "[    .    1    ]" 1 
       2044 1 114 ARG H    1 114 ARG QG   2.600     . 3.500 2.262 1.913 3.127     .  0 0 "[    .    1    ]" 1 
       2045 1 114 ARG H    1 115 ASP H    3.500     . 5.500 3.855 3.594 4.069     .  0 0 "[    .    1    ]" 1 
       2046 1 114 ARG HA   1 114 ARG QG   2.500     . 3.400 3.002 2.067 3.372     .  0 0 "[    .    1    ]" 1 
       2047 1 114 ARG HA   1 115 ASP H    2.300     . 3.100 2.299 2.204 2.348     .  0 0 "[    .    1    ]" 1 
       2048 1 114 ARG HA   1 116 GLY H    3.700     . 5.500 4.139 3.347 4.361     .  0 0 "[    .    1    ]" 1 
       2049 1 114 ARG HA   1 122 MET H    3.200     . 5.200 3.437 3.080 3.630     .  0 0 "[    .    1    ]" 1 
       2050 1 114 ARG QB   1 114 ARG HE   3.100     . 4.200 3.237 2.011 4.233 0.033 13 0 "[    .    1    ]" 1 
       2051 1 114 ARG QD   1 114 ARG HE   3.200 2.100 4.300 2.304 2.180 2.489     .  0 0 "[    .    1    ]" 1 
       2052 1 114 ARG HD3  1 115 ASP H    3.100     . 4.200 4.050 3.739 4.287 0.087  2 0 "[    .    1    ]" 1 
       2053 1 115 ASP H    1 115 ASP HA   2.800     . 3.800 2.318 2.269 2.796     .  0 0 "[    .    1    ]" 1 
       2054 1 115 ASP H    1 115 ASP QB   2.800     . 3.600 2.890 2.347 3.354     .  0 0 "[    .    1    ]" 1 
       2055 1 115 ASP H    1 118 THR HB   2.900     . 4.600 4.346 3.708 4.679 0.079 13 0 "[    .    1    ]" 1 
       2056 1 115 ASP H    1 118 THR MG   3.600     . 5.500 5.127 4.345 5.533 0.033 13 0 "[    .    1    ]" 1 
       2057 1 115 ASP H    1 120 ARG H    3.400     . 5.500 4.168 3.474 4.706     .  0 0 "[    .    1    ]" 1 
       2058 1 115 ASP H    1 120 ARG H    3.100     . 4.200 3.700 3.314 3.983     .  0 0 "[    .    1    ]" 1 
       2059 1 115 ASP H    1 120 ARG QB   3.500     . 5.500 4.150 3.891 4.461     .  0 0 "[    .    1    ]" 1 
       2060 1 115 ASP H    1 122 MET H    3.400     . 5.500 2.961 2.284 3.330     .  0 0 "[    .    1    ]" 1 
       2061 1 115 ASP H    1 121 TRP HA   3.400     . 5.500 3.177 2.177 3.958     .  0 0 "[    .    1    ]" 1 
       2062 1 115 ASP HA   1 116 GLY H    2.800     . 3.800 2.925 2.127 3.528     .  0 0 "[    .    1    ]" 1 
       2063 1 115 ASP HA   1 120 ARG H    2.800     . 4.400 3.629 3.113 4.608 0.208 13 0 "[    .    1    ]" 1 
       2064 1 115 ASP QB   1 116 GLY H    3.600     . 5.500 2.205 1.896 4.042     .  0 0 "[    .    1    ]" 1 
       2065 1 115 ASP QB   1 120 ARG H    3.300 2.100 4.500 4.014 1.920 4.329 0.180 13 0 "[    .    1    ]" 1 
       2066 1 116 GLY H    1 116 GLY HA2  2.800     . 3.800 2.434 2.290 2.906     .  0 0 "[    .    1    ]" 1 
       2067 1 116 GLY H    1 116 GLY HA3  2.500     . 3.400 2.812 2.296 2.954     .  0 0 "[    .    1    ]" 1 
       2068 1 116 GLY H    1 117 THR H    3.000     . 4.000 3.489 2.298 4.115 0.115 12 0 "[    .    1    ]" 1 
       2069 1 116 GLY HA2  1 117 THR H    3.400 2.200 4.600 3.432 2.356 3.566     .  0 0 "[    .    1    ]" 1 
       2070 1 116 GLY HA2  1 117 THR HA   2.900     . 4.600 4.552 4.508 4.607 0.007  1 0 "[    .    1    ]" 1 
       2071 1 116 GLY HA3  1 117 THR H    3.000     . 4.000 2.643 2.251 3.532     .  0 0 "[    .    1    ]" 1 
       2072 1 117 THR H    1 117 THR HA   2.600     . 3.500 2.665 2.263 2.814     .  0 0 "[    .    1    ]" 1 
       2073 1 117 THR H    1 117 THR MG   2.900     . 3.900 3.659 2.588 3.981 0.081  6 0 "[    .    1    ]" 1 
       2074 1 117 THR H    1 118 THR H    2.600     . 3.500 2.207 1.933 2.732     .  0 0 "[    .    1    ]" 1 
       2075 1 117 THR H    1 119 ARG H    3.800     . 5.500 4.399 3.635 5.104     .  0 0 "[    .    1    ]" 1 
       2076 1 117 THR HA   1 117 THR MG   1.800     . 2.400 1.772 1.715 1.833     .  0 0 "[    .    1    ]" 1 
       2077 1 117 THR HA   1 117 THR MG   2.100     . 2.800 2.216 2.006 2.560     .  0 0 "[    .    1    ]" 1 
       2078 1 117 THR HB   1 117 THR MG   1.900     . 2.600 2.095 2.069 2.117     .  0 0 "[    .    1    ]" 1 
       2079 1 118 THR H    1 118 THR MG   2.500     . 3.800 3.760 3.412 3.901 0.101  4 0 "[    .    1    ]" 1 
       2080 1 118 THR H    1 119 ARG H    2.700     . 3.600 2.824 2.250 3.281     .  0 0 "[    .    1    ]" 1 
       2081 1 118 THR H    1 119 ARG HA   3.400     . 5.500 4.577 4.139 5.197     .  0 0 "[    .    1    ]" 1 
       2082 1 118 THR HA   1 118 THR MG   2.100     . 2.800 2.294 2.025 2.546     .  0 0 "[    .    1    ]" 1 
       2083 1 118 THR HA   1 119 ARG H    2.700     . 3.600 3.468 2.999 3.572     .  0 0 "[    .    1    ]" 1 
       2084 1 118 THR HA   1 119 ARG HA   3.100     . 5.000 4.763 4.669 4.828     .  0 0 "[    .    1    ]" 1 
       2085 1 118 THR HA   1 119 ARG QG   3.000     . 4.800 3.563 3.172 3.929     .  0 0 "[    .    1    ]" 1 
       2086 1 118 THR HB   1 118 THR MG   2.100     . 2.800 2.092 2.066 2.115     .  0 0 "[    .    1    ]" 1 
       2087 1 118 THR HB   1 119 ARG H    2.800     . 3.800 2.237 1.911 3.933 0.133  1 0 "[    .    1    ]" 1 
       2088 1 118 THR HB   1 120 ARG H    2.600     . 3.500 2.779 2.504 2.893     .  0 0 "[    .    1    ]" 1 
       2089 1 118 THR HB   1 122 MET QB   2.900     . 4.600 3.371 2.856 4.236     .  0 0 "[    .    1    ]" 1 
       2090 1 118 THR MG   1 119 ARG H    3.400 2.200 4.600 3.272 2.261 4.223     .  0 0 "[    .    1    ]" 1 
       2091 1 118 THR MG   1 119 ARG QD   2.900     . 4.600 4.043 3.085 4.501     .  0 0 "[    .    1    ]" 1 
       2092 1 118 THR MG   1 119 ARG QG   2.200     . 3.000 2.829 2.393 3.046 0.046  4 0 "[    .    1    ]" 1 
       2093 1 118 THR MG   1 120 ARG H    3.200     . 5.200 4.055 3.265 4.897     .  0 0 "[    .    1    ]" 1 
       2094 1 118 THR MG   1 122 MET QB   2.400     . 3.200 2.522 1.893 3.289 0.089 13 0 "[    .    1    ]" 1 
       2095 1 118 THR MG   1 122 MET ME   3.100     . 5.000 3.798 3.267 4.050     .  0 0 "[    .    1    ]" 1 
       2096 1 118 THR MG   1 124 HIS HE1  2.900     . 4.600 3.416 2.889 3.973     .  0 0 "[    .    1    ]" 1 
       2097 1 119 ARG H    1 119 ARG HA   2.300     . 3.100 2.757 2.295 2.889     .  0 0 "[    .    1    ]" 1 
       2098 1 119 ARG H    1 119 ARG QB   3.000     . 4.800 3.194 2.748 3.517     .  0 0 "[    .    1    ]" 1 
       2099 1 119 ARG H    1 119 ARG QD   3.100     . 5.000 4.511 2.394 5.068 0.068  7 0 "[    .    1    ]" 1 
       2100 1 119 ARG H    1 119 ARG QG   2.700     . 3.600 3.086 2.535 3.627 0.027  9 0 "[    .    1    ]" 1 
       2101 1 119 ARG H    1 120 ARG H    2.800     . 3.800 2.833 2.054 3.800     .  1 0 "[    .    1    ]" 1 
       2102 1 119 ARG HA   1 119 ARG QB   2.500     . 3.400 2.294 2.149 2.474     .  0 0 "[    .    1    ]" 1 
       2103 1 119 ARG HA   1 119 ARG QD   2.700     . 4.500 3.702 1.933 4.560 0.060 10 0 "[    .    1    ]" 1 
       2104 1 119 ARG HA   1 119 ARG QG   2.400     . 3.200 2.844 2.185 3.293 0.093  2 0 "[    .    1    ]" 1 
       2105 1 119 ARG HA   1 120 ARG H    2.500     . 3.800 3.542 3.525 3.574     .  0 0 "[    .    1    ]" 1 
       2106 1 119 ARG QB   1 120 ARG H    3.200     . 4.500 2.246 1.913 3.100     .  0 0 "[    .    1    ]" 1 
       2107 1 119 ARG QB   1 122 MET ME   2.800     . 4.400 4.212 2.747 4.491 0.091 14 0 "[    .    1    ]" 1 
       2108 1 119 ARG QD   1 120 ARG H    3.200     . 5.200 3.705 2.797 4.227     .  0 0 "[    .    1    ]" 1 
       2109 1 119 ARG HE   1 120 ARG H    3.400     . 5.500 4.939 3.974 5.470     .  0 0 "[    .    1    ]" 1 
       2110 1 119 ARG HE   1 120 ARG H    3.100     . 5.000 4.512 3.820 5.016 0.016 10 0 "[    .    1    ]" 1 
       2111 1 120 ARG H    1 120 ARG QB   2.700     . 3.600 2.976 2.853 3.132     .  0 0 "[    .    1    ]" 1 
       2112 1 120 ARG H    1 120 ARG QG   2.500     . 3.400 2.591 2.449 2.873     .  0 0 "[    .    1    ]" 1 
       2113 1 120 ARG H    1 121 TRP H    3.500     . 5.500 4.196 4.130 4.300     .  0 0 "[    .    1    ]" 1 
       2114 1 120 ARG H    1 122 MET ME   3.200     . 5.200 4.395 4.093 4.685     .  0 0 "[    .    1    ]" 1 
       2115 1 120 ARG H    1 122 MET QG   3.400     . 5.500 2.708 1.915 5.197     .  0 0 "[    .    1    ]" 1 
       2116 1 120 ARG HA   1 120 ARG QG   2.700     . 4.200 3.349 3.339 3.363     .  0 0 "[    .    1    ]" 1 
       2117 1 120 ARG HA   1 121 TRP H    2.400     . 3.200 2.972 2.807 3.109     .  0 0 "[    .    1    ]" 1 
       2118 1 120 ARG QB   1 121 TRP H    2.900     . 3.900 1.935 1.854 1.997 0.046 13 0 "[    .    1    ]" 1 
       2119 1 120 ARG QD   1 122 MET H    3.500     . 5.500 4.962 4.390 5.510 0.010  8 0 "[    .    1    ]" 1 
       2120 1 120 ARG HD3  1 121 TRP H    2.900     . 3.900 2.498 1.987 3.366     .  0 0 "[    .    1    ]" 1 
       2121 1 120 ARG HE   1 120 ARG QG   2.700     . 3.600 2.554 2.067 3.301     .  0 0 "[    .    1    ]" 1 
       2122 1 120 ARG QG   1 122 MET ME   2.400     . 3.600 3.602 3.412 3.648 0.048 13 0 "[    .    1    ]" 1 
       2123 1 120 ARG HG3  1 121 TRP H    3.300 2.100 4.500 2.541 2.233 2.895     .  0 0 "[    .    1    ]" 1 
       2124 1 120 ARG HG3  1 122 MET H    3.200 2.100 4.300 3.912 3.478 4.288     .  0 0 "[    .    1    ]" 1 
       2125 1 121 TRP H    1 121 TRP HB2  3.300 2.100 4.500 2.675 2.125 2.877     .  0 0 "[    .    1    ]" 1 
       2126 1 121 TRP H    1 121 TRP HD1  3.000     . 4.800 2.726 2.022 3.147     .  0 0 "[    .    1    ]" 1 
       2127 1 121 TRP HA   1 122 MET H    2.500     . 3.400 2.337 2.210 2.449     .  0 0 "[    .    1    ]" 1 
       2128 1 121 TRP HA   1 122 MET H    2.400     . 3.200 2.244 2.150 2.326     .  0 0 "[    .    1    ]" 1 
       2129 1 121 TRP QB   1 122 MET H    3.400 2.200 4.600 3.827 3.730 3.884     .  0 0 "[    .    1    ]" 1 
       2130 1 122 MET H    1 122 MET HB2  3.600     . 5.500 2.514 2.275 2.901     .  0 0 "[    .    1    ]" 1 
       2131 1 122 MET H    1 122 MET QG   2.700     . 3.600 2.798 2.170 3.868 0.268 13 0 "[    .    1    ]" 1 
       2132 1 122 MET HA   1 122 MET ME   2.700     . 3.600 2.243 1.899 2.654     .  0 0 "[    .    1    ]" 1 
       2133 1 122 MET HA   1 123 CYS H    2.400     . 3.200 2.138 2.088 2.308     .  0 0 "[    .    1    ]" 1 
       2134 1 122 MET HB3  1 122 MET ME   2.300     . 3.400 2.471 1.890 3.517 0.117 13 0 "[    .    1    ]" 1 
       2135 1 122 MET ME   1 122 MET QG   2.400     . 3.200 2.423 2.168 2.627     .  0 0 "[    .    1    ]" 1 
       2136 1 122 MET ME   1 123 CYS H    2.800     . 4.400 3.123 2.889 3.377     .  0 0 "[    .    1    ]" 1 
       2137 1 122 MET ME   1 123 CYS QB   2.700     . 4.500 4.510 4.330 4.603 0.103 14 0 "[    .    1    ]" 1 
       2138 1 122 MET QG   1 123 CYS H    3.300     . 5.500 4.161 2.290 4.794     .  0 0 "[    .    1    ]" 1 
       2139 1 123 CYS H    1 123 CYS QB   3.100     . 5.000 2.193 2.065 2.376     .  0 0 "[    .    1    ]" 1 
       2140 1 123 CYS HA   1 124 HIS H    2.400     . 3.200 2.399 2.223 2.540     .  0 0 "[    .    1    ]" 1 
       2141 1 124 HIS H    1 124 HIS HB2  3.300 2.100 4.500 2.733 2.564 2.875     .  0 0 "[    .    1    ]" 1 
       2142 1 124 HIS H    1 124 HIS HB3  2.800     . 3.800 3.827 3.728 3.897 0.097 13 0 "[    .    1    ]" 1 
       2143 1 124 HIS H    1 124 HIS HD2  3.100     . 4.200 2.985 2.662 3.314     .  0 0 "[    .    1    ]" 1 
       2144 1 124 HIS HA   1 125 GLY H    2.300     . 3.100 2.195 2.131 2.384     .  0 0 "[    .    1    ]" 1 
       2145 1 124 HIS HB2  1 125 GLY H    3.400 2.200 4.600 4.313 3.658 4.492     .  0 0 "[    .    1    ]" 1 
       2146 1 124 HIS HB3  1 125 GLY H    3.300     . 5.500 3.620 2.552 4.227     .  0 0 "[    .    1    ]" 1 
       2147 1 125 GLY H    1 125 GLY HA2  3.000     . 4.000 2.923 2.856 2.955     .  0 0 "[    .    1    ]" 1 
       2148 1 125 GLY H    1 125 GLY HA3  2.700     . 3.600 2.397 2.307 2.626     .  0 0 "[    .    1    ]" 1 
       2149 1 125 GLY H    1 126 PHE H    3.500     . 5.500 4.392 4.217 4.536     .  0 0 "[    .    1    ]" 1 
       2150 1 125 GLY HA2  1 126 PHE H    2.600     . 3.500 2.167 2.130 2.288     .  0 0 "[    .    1    ]" 1 
       2151 1 125 GLY HA3  1 126 PHE H    2.700     . 4.200 3.236 2.922 3.399     .  0 0 "[    .    1    ]" 1 
       2152 1 125 GLY HA3  1 126 PHE H    2.700     . 3.600 2.725 2.249 3.177     .  0 0 "[    .    1    ]" 1 
       2153 1 126 PHE H    1 126 PHE HB3  3.300 2.100 4.500 3.381 2.866 3.568     .  0 0 "[    .    1    ]" 1 
       2154 1 126 PHE H    1 126 PHE QD   2.800     . 3.800 2.621 1.920 3.639     .  0 0 "[    .    1    ]" 1 
       2155 1 126 PHE HA   1 126 PHE QD   3.000     . 4.800 3.281 2.644 3.713     .  0 0 "[    .    1    ]" 1 
       2156 1 126 PHE HA   1 127 LEU H    2.400     . 3.200 2.253 2.111 2.525     .  0 0 "[    .    1    ]" 1 
       2157 1 126 PHE HB2  1 127 LEU H    3.200     . 5.200 3.433 2.104 4.577     .  0 0 "[    .    1    ]" 1 
       2158 1 126 PHE QD   1 127 LEU H    3.100     . 5.000 3.660 2.998 4.633     .  0 0 "[    .    1    ]" 1 
       2159 1 126 PHE QD   1 128 ALA H    3.500     . 5.500 5.258 4.846 5.510 0.010  3 0 "[    .    1    ]" 1 
       2160 1 126 PHE QD   1 136 LEU QD   2.900     . 4.600 3.103 2.233 4.121     .  0 0 "[    .    1    ]" 1 
       2161 1 127 LEU H    1 127 LEU HB2  2.800     . 3.800 2.743 2.166 3.242     .  0 0 "[    .    1    ]" 1 
       2162 1 127 LEU H    1 127 LEU HB3  2.700     . 3.600 3.017 2.505 3.898 0.298 10 0 "[    .    1    ]" 1 
       2163 1 127 LEU H    1 127 LEU QD   3.400     . 4.600 3.715 3.262 3.986     .  0 0 "[    .    1    ]" 1 
       2164 1 127 LEU HA   1 127 LEU QD   2.300     . 3.100 2.265 1.827 2.805     .  0 0 "[    .    1    ]" 1 
       2165 1 127 LEU HA   1 128 ALA H    2.300     . 3.100 2.177 2.135 2.261     .  0 0 "[    .    1    ]" 1 
       2166 1 127 LEU HB3  1 127 LEU QD   2.500     . 3.800 2.065 1.895 2.373     .  0 0 "[    .    1    ]" 1 
       2167 1 127 LEU HB3  1 128 ALA H    3.300     . 5.500 3.977 3.319 4.362     .  0 0 "[    .    1    ]" 1 
       2168 1 127 LEU MD1  1 127 LEU MD2  1.900     . 2.600 1.999 1.873 2.093     .  0 0 "[    .    1    ]" 1 
       2169 1 127 LEU QD   1 128 ALA H    3.400 2.100 4.500 2.987 2.028 4.072 0.072  1 0 "[    .    1    ]" 1 
       2170 1 128 ALA H    1 128 ALA MB   2.500     . 3.400 2.161 2.039 2.242     .  0 0 "[    .    1    ]" 1 
       2171 1 128 ALA HA   1 128 ALA MB   2.100     . 2.800 2.107 2.081 2.125     .  0 0 "[    .    1    ]" 1 
       2172 1 128 ALA HA   1 129 CYS H    2.400     . 3.200 2.197 2.164 2.234     .  0 0 "[    .    1    ]" 1 
       2173 1 128 ALA HA   1 131 ASP H    2.800     . 3.800 3.332 3.284 3.361     .  0 0 "[    .    1    ]" 1 
       2174 1 128 ALA MB   1 129 CYS H    3.000     . 4.000 2.886 2.699 3.013     .  0 0 "[    .    1    ]" 1 
       2175 1 128 ALA MB   1 129 CYS HB3  2.700     . 4.500 4.712 4.402 5.234 0.734  8 4 "[-  *.  + *    ]" 1 
       2176 1 128 ALA MB   1 130 LYS H    3.300     . 5.500 3.342 2.644 3.894     .  0 0 "[    .    1    ]" 1 
       2177 1 128 ALA MB   1 131 ASP H    2.500     . 3.400 2.174 1.923 2.437     .  0 0 "[    .    1    ]" 1 
       2178 1 128 ALA MB   1 131 ASP HA   3.000     . 4.800 2.212 1.957 2.686     .  0 0 "[    .    1    ]" 1 
       2179 1 128 ALA MB   1 131 ASP HB2  2.800     . 4.400 4.219 3.669 4.747 0.347  5 0 "[    .    1    ]" 1 
       2180 1 128 ALA MB   1 132 SER H    3.700     . 5.500 2.920 2.758 3.085     .  0 0 "[    .    1    ]" 1 
       2181 1 128 ALA MB   1 132 SER HA   3.200     . 5.200 5.175 5.027 5.258 0.058 11 0 "[    .    1    ]" 1 
       2182 1 128 ALA MB   1 133 GLY H    3.500     . 5.500 3.442 3.144 3.626     .  0 0 "[    .    1    ]" 1 
       2183 1 128 ALA MB   1 136 LEU H    3.600     . 5.500 3.663 2.795 4.810     .  0 0 "[    .    1    ]" 1 
       2184 1 128 ALA MB   1 136 LEU QD   2.200     . 3.000 2.355 1.755 2.720     .  0 0 "[    .    1    ]" 1 
       2185 1 129 CYS H    1 129 CYS HA   2.800     . 3.800 2.812 2.770 2.853     .  0 0 "[    .    1    ]" 1 
       2186 1 129 CYS H    1 129 CYS HB2  2.900     . 4.600 2.376 2.040 2.682     .  0 0 "[    .    1    ]" 1 
       2187 1 129 CYS H    1 129 CYS HB3  2.900     . 4.600 2.787 2.371 3.332     .  0 0 "[    .    1    ]" 1 
       2188 1 129 CYS H    1 130 LYS H    2.900     . 3.900 2.832 2.546 3.252     .  0 0 "[    .    1    ]" 1 
       2189 1 129 CYS H    1 131 ASP H    3.300 2.100 4.500 3.744 3.595 3.904     .  0 0 "[    .    1    ]" 1 
       2190 1 129 CYS HA   1 129 CYS HB2  2.600     . 3.500 2.602 2.404 2.886     .  0 0 "[    .    1    ]" 1 
       2191 1 129 CYS HA   1 129 CYS HB3  2.700     . 3.600 2.955 2.811 3.028     .  0 0 "[    .    1    ]" 1 
       2192 1 129 CYS HA   1 130 LYS H    3.300     . 5.500 3.559 3.511 3.572     .  0 0 "[    .    1    ]" 1 
       2193 1 129 CYS HA   1 131 ASP H    3.600     . 5.500 4.286 4.066 4.619     .  0 0 "[    .    1    ]" 1 
       2194 1 129 CYS HB2  1 130 LYS H    3.200     . 5.200 3.394 2.771 4.003     .  0 0 "[    .    1    ]" 1 
       2195 1 129 CYS HB3  1 130 LYS H    3.300     . 5.500 2.363 1.943 2.727     .  0 0 "[    .    1    ]" 1 
       2196 1 129 CYS HB3  1 130 LYS QG   3.000     . 4.800 3.053 2.734 3.578     .  0 0 "[    .    1    ]" 1 
       2197 1 130 LYS H    1 130 LYS HB2  3.100     . 4.200 2.676 2.563 2.770     .  0 0 "[    .    1    ]" 1 
       2198 1 130 LYS H    1 130 LYS HG2  3.000     . 4.800 2.111 1.936 3.765     .  0 0 "[    .    1    ]" 1 
       2199 1 130 LYS H    1 131 ASP H    2.300     . 3.100 2.542 2.388 2.693     .  0 0 "[    .    1    ]" 1 
       2200 1 130 LYS HA   1 130 LYS HB2  2.300     . 3.100 3.017 3.003 3.028     .  0 0 "[    .    1    ]" 1 
       2201 1 130 LYS HA   1 130 LYS HB3  2.200     . 3.000 2.390 2.341 2.453     .  0 0 "[    .    1    ]" 1 
       2202 1 130 LYS HA   1 130 LYS QD   2.600     . 4.000 2.461 1.926 3.889     .  0 0 "[    .    1    ]" 1 
       2203 1 130 LYS HA   1 130 LYS QG   2.400     . 3.200 2.989 2.401 3.199     .  0 0 "[    .    1    ]" 1 
       2204 1 130 LYS QB   1 132 SER HA   3.300     . 5.500 5.351 4.961 5.507 0.007  8 0 "[    .    1    ]" 1 
       2205 1 130 LYS QB   1 134 GLU H    3.300     . 5.500 4.523 3.298 4.868     .  0 0 "[    .    1    ]" 1 
       2206 1 130 LYS HB2  1 130 LYS QG   2.300     . 3.100 2.186 2.133 2.509     .  0 0 "[    .    1    ]" 1 
       2207 1 130 LYS HB2  1 131 ASP H    3.100     . 4.200 2.865 2.709 3.075     .  0 0 "[    .    1    ]" 1 
       2208 1 130 LYS HB3  1 130 LYS QG   2.400     . 3.600 2.343 2.132 2.525     .  0 0 "[    .    1    ]" 1 
       2209 1 130 LYS HD2  1 130 LYS HE2  2.100     . 2.800 1.880 1.811 1.943     .  0 0 "[    .    1    ]" 1 
       2210 1 130 LYS QD   1 130 LYS QG   1.900     . 2.600 2.045 2.013 2.091     .  0 0 "[    .    1    ]" 1 
       2211 1 130 LYS HE2  1 130 LYS HG2  2.400     . 3.600 2.212 1.951 2.992     .  0 0 "[    .    1    ]" 1 
       2212 1 130 LYS QG   1 131 ASP H    3.300     . 5.500 3.901 3.777 4.341     .  0 0 "[    .    1    ]" 1 
       2213 1 130 LYS QG   1 134 GLU H    3.500     . 5.500 5.236 4.163 5.508 0.008  2 0 "[    .    1    ]" 1 
       2214 1 130 LYS HG3  1 135 ARG H    2.700     . 4.200 4.163 3.740 4.280 0.080  7 0 "[    .    1    ]" 1 
       2215 1 131 ASP H    1 131 ASP HA   2.700     . 3.600 2.273 2.269 2.276     .  0 0 "[    .    1    ]" 1 
       2216 1 131 ASP H    1 131 ASP HB2  2.700     . 3.600 3.198 3.034 3.942 0.342  5 0 "[    .    1    ]" 1 
       2217 1 131 ASP H    1 131 ASP HB3  3.200 2.100 4.300 3.931 3.639 4.097     .  0 0 "[    .    1    ]" 1 
       2218 1 131 ASP H    1 132 SER H    3.200     . 5.200 3.067 2.729 3.262     .  0 0 "[    .    1    ]" 1 
       2219 1 131 ASP H    1 134 GLU H    3.600     . 5.500 5.421 5.110 5.516 0.016 11 0 "[    .    1    ]" 1 
       2220 1 131 ASP H    1 136 LEU QD   3.300     . 5.500 4.437 3.321 4.830     .  0 0 "[    .    1    ]" 1 
       2221 1 131 ASP HA   1 132 SER H    2.200     . 3.000 2.429 2.320 2.859     .  0 0 "[    .    1    ]" 1 
       2222 1 131 ASP HA   1 132 SER QB   3.200     . 5.200 4.509 4.304 4.948     .  0 0 "[    .    1    ]" 1 
       2223 1 131 ASP HB3  1 132 SER H    2.600     . 4.500 4.284 4.173 4.446     .  0 0 "[    .    1    ]" 1 
       2224 1 131 ASP HB3  1 132 SER QB   3.100     . 5.000 4.598 4.233 5.691 0.691  5 1 "[    +    1    ]" 1 
       2225 1 132 SER H    1 132 SER HA   2.800     . 3.800 2.851 2.805 2.909     .  0 0 "[    .    1    ]" 1 
       2226 1 132 SER H    1 132 SER QB   2.900     . 3.600 3.016 2.788 3.356     .  0 0 "[    .    1    ]" 1 
       2227 1 132 SER H    1 133 GLY H    3.400     . 5.500 1.921 1.876 1.942     .  0 0 "[    .    1    ]" 1 
       2228 1 132 SER H    1 135 ARG H    3.700     . 5.500 5.168 4.287 5.515 0.015  8 0 "[    .    1    ]" 1 
       2229 1 132 SER H    1 135 ARG H    3.600     . 5.500 4.835 4.152 5.239     .  0 0 "[    .    1    ]" 1 
       2230 1 132 SER H    1 137 SER H    3.500     . 5.500 5.044 4.818 5.340     .  0 0 "[    .    1    ]" 1 
       2231 1 132 SER HA   1 132 SER QB   2.300     . 3.000 2.405 2.173 2.541     .  0 0 "[    .    1    ]" 1 
       2232 1 132 SER HA   1 133 GLY H    2.500     . 3.400 2.977 2.891 3.092     .  0 0 "[    .    1    ]" 1 
       2233 1 132 SER HA   1 134 GLU H    3.000     . 4.800 4.448 4.343 4.629     .  0 0 "[    .    1    ]" 1 
       2234 1 132 SER HA   1 134 GLU QB   3.000     . 4.800 4.792 4.690 4.828 0.028  9 0 "[    .    1    ]" 1 
       2235 1 132 SER QB   1 133 GLY H    3.100     . 5.000 3.497 2.847 3.714     .  0 0 "[    .    1    ]" 1 
       2236 1 132 SER QB   1 134 GLU H    2.800     . 3.800 3.370 3.107 3.685     .  0 0 "[    .    1    ]" 1 
       2237 1 132 SER QB   1 134 GLU H    3.000     . 4.800 3.219 3.019 3.563     .  0 0 "[    .    1    ]" 1 
       2238 1 132 SER QB   1 134 GLU QB   2.600     . 4.000 2.700 2.489 2.944     .  0 0 "[    .    1    ]" 1 
       2239 1 133 GLY H    1 133 GLY HA2  3.000     . 4.000 2.314 2.306 2.325     .  0 0 "[    .    1    ]" 1 
       2240 1 133 GLY H    1 133 GLY HA3  2.700     . 3.600 2.697 2.650 2.731     .  0 0 "[    .    1    ]" 1 
       2241 1 133 GLY H    1 134 GLU H    2.700     . 3.600 2.977 2.905 3.115     .  0 0 "[    .    1    ]" 1 
       2242 1 133 GLY H    1 134 GLU QB   3.300     . 5.500 4.756 4.538 4.842     .  0 0 "[    .    1    ]" 1 
       2243 1 133 GLY HA2  1 134 GLU H    3.400 2.200 4.600 2.933 2.838 3.003     .  0 0 "[    .    1    ]" 1 
       2244 1 133 GLY HA2  1 136 LEU H    3.400     . 5.500 4.176 3.557 4.563     .  0 0 "[    .    1    ]" 1 
       2245 1 133 GLY HA2  1 137 SER H    3.400     . 5.500 3.215 2.445 3.885     .  0 0 "[    .    1    ]" 1 
       2246 1 133 GLY HA3  1 134 GLU H    3.100     . 4.200 3.509 3.484 3.543     .  0 0 "[    .    1    ]" 1 
       2247 1 134 GLU H    1 134 GLU HA   2.600     . 3.500 2.932 2.911 2.945     .  0 0 "[    .    1    ]" 1 
       2248 1 134 GLU H    1 134 GLU QB   2.300     . 3.100 2.537 2.300 2.664     .  0 0 "[    .    1    ]" 1 
       2249 1 134 GLU H    1 134 GLU QG   3.000     . 4.000 3.779 3.560 4.064 0.064  3 0 "[    .    1    ]" 1 
       2250 1 134 GLU H    1 135 ARG H    3.000     . 4.000 2.588 1.969 2.957 0.031 14 0 "[    .    1    ]" 1 
       2251 1 134 GLU HA   1 134 GLU QB   2.400     . 3.200 2.507 2.461 2.536     .  0 0 "[    .    1    ]" 1 
       2252 1 134 GLU HA   1 134 GLU QG   2.700     . 3.600 2.166 2.020 2.285     .  0 0 "[    .    1    ]" 1 
       2253 1 134 GLU HA   1 135 ARG H    3.500     . 5.500 2.820 2.604 3.350     .  0 0 "[    .    1    ]" 1 
       2254 1 134 GLU HA   1 136 LEU H    3.600     . 5.500 4.576 3.984 5.362     .  0 0 "[    .    1    ]" 1 
       2255 1 134 GLU HA   1 137 SER H    3.100     . 5.000 4.802 4.468 5.007 0.007  6 0 "[    .    1    ]" 1 
       2256 1 134 GLU HA   1 138 HIS QB   2.700     . 3.600 3.127 2.640 3.448     .  0 0 "[    .    1    ]" 1 
       2257 1 134 GLU QB   1 134 GLU QG   2.100     . 2.800 2.056 2.020 2.086     .  0 0 "[    .    1    ]" 1 
       2258 1 134 GLU QB   1 135 ARG H    3.000     . 4.000 3.793 3.293 3.909     .  0 0 "[    .    1    ]" 1 
       2259 1 134 GLU QB   1 135 ARG HA   3.200     . 5.200 3.615 2.964 4.257     .  0 0 "[    .    1    ]" 1 
       2260 1 134 GLU QB   1 136 LEU H    3.400     . 5.500 5.374 4.883 5.633 0.133 13 0 "[    .    1    ]" 1 
       2261 1 135 ARG H    1 136 LEU H    2.800     . 3.800 1.999 1.913 2.407     .  0 0 "[    .    1    ]" 1 
       2262 1 135 ARG H    1 136 LEU H    2.500     . 3.400 1.773 1.718 1.864     .  0 0 "[    .    1    ]" 1 
       2263 1 135 ARG H    1 136 LEU HA   3.600     . 5.500 3.773 3.271 4.154     .  0 0 "[    .    1    ]" 1 
       2264 1 135 ARG H    1 136 LEU QD   3.000     . 4.800 3.712 3.139 4.315     .  0 0 "[    .    1    ]" 1 
       2265 1 135 ARG H    1 138 HIS H    2.900     . 3.900 2.667 2.076 2.842     .  0 0 "[    .    1    ]" 1 
       2266 1 135 ARG H    1 137 SER QB   3.400     . 5.500 3.848 3.447 4.484     .  0 0 "[    .    1    ]" 1 
       2267 1 135 ARG H    1 139 ALA MB   2.600     . 4.500 4.264 3.747 4.492     .  0 0 "[    .    1    ]" 1 
       2268 1 135 ARG HA   1 138 HIS H    3.500     . 5.500 5.143 4.903 5.481     .  0 0 "[    .    1    ]" 1 
       2269 1 135 ARG HA   1 136 LEU H    3.500     . 5.500 3.439 2.806 3.567     .  0 0 "[    .    1    ]" 1 
       2270 1 135 ARG HA   1 139 ALA H    3.500 2.300 4.700 4.385 3.987 4.726 0.026 14 0 "[    .    1    ]" 1 
       2271 1 135 ARG HA   1 139 ALA MB   2.900     . 4.600 3.556 2.842 3.964     .  0 0 "[    .    1    ]" 1 
       2272 1 136 LEU H    1 136 LEU HA   2.900     . 3.900 2.924 2.787 2.949     .  0 0 "[    .    1    ]" 1 
       2273 1 136 LEU H    1 136 LEU QB   2.700     . 3.600 2.595 2.319 3.253     .  0 0 "[    .    1    ]" 1 
       2274 1 136 LEU H    1 136 LEU QD   3.300     . 3.500 2.577 1.723 3.558 0.058 10 0 "[    .    1    ]" 1 
       2275 1 136 LEU H    1 137 SER H    2.800     . 3.800 2.007 1.919 2.198     .  0 0 "[    .    1    ]" 1 
       2276 1 136 LEU H    1 139 ALA MB   3.000     . 4.000 3.766 2.912 4.031 0.031 14 0 "[    .    1    ]" 1 
       2277 1 136 LEU H    1 140 VAL QG   3.300     . 5.500 4.696 4.246 5.093     .  0 0 "[    .    1    ]" 1 
       2278 1 136 LEU HA   1 136 LEU QD   2.700     . 4.000 2.563 1.890 3.200     .  0 0 "[    .    1    ]" 1 
       2279 1 136 LEU HA   1 137 SER H    3.100     . 5.000 3.482 3.086 3.561     .  0 0 "[    .    1    ]" 1 
       2280 1 136 LEU HA   1 139 ALA H    2.700     . 3.600 2.787 2.651 3.148     .  0 0 "[    .    1    ]" 1 
       2281 1 136 LEU HA   1 139 ALA MB   2.600     . 3.500 2.292 1.910 3.059     .  0 0 "[    .    1    ]" 1 
       2282 1 136 LEU HA   1 140 VAL H    3.600     . 5.500 2.982 2.335 4.092     .  0 0 "[    .    1    ]" 1 
       2283 1 136 LEU HA   1 140 VAL QG   2.600     . 3.500 2.748 2.050 3.532 0.032 10 0 "[    .    1    ]" 1 
       2284 1 136 LEU QB   1 137 SER H    2.900     . 3.900 2.795 2.380 3.962 0.062 14 0 "[    .    1    ]" 1 
       2285 1 136 LEU MD1  1 136 LEU MD2  2.000     . 2.700 2.015 1.865 2.087     .  0 0 "[    .    1    ]" 1 
       2286 1 136 LEU QD   1 137 SER H    3.400     . 4.000 3.447 2.265 3.895     .  0 0 "[    .    1    ]" 1 
       2287 1 136 LEU QD   1 140 VAL QG   2.100     . 4.500 3.255 2.707 3.765     .  0 0 "[    .    1    ]" 1 
       2288 1 136 LEU HG   1 140 VAL H    3.600     . 5.500 4.053 3.729 4.406     .  0 0 "[    .    1    ]" 1 
       2289 1 136 LEU HG   1 140 VAL QG   2.700     . 3.600 2.438 1.833 2.924     .  0 0 "[    .    1    ]" 1 
       2290 1 137 SER H    1 138 HIS H    2.900     . 3.900 2.813 2.087 3.055     .  0 0 "[    .    1    ]" 1 
       2291 1 137 SER H    1 139 ALA H    2.900     . 3.900 3.659 3.064 3.866     .  0 0 "[    .    1    ]" 1 
       2292 1 137 SER H    1 139 ALA H    2.500     . 3.400 2.731 2.514 2.898     .  0 0 "[    .    1    ]" 1 
       2293 1 137 SER HA   1 138 HIS H    3.100     . 5.000 3.559 3.486 3.571     .  0 0 "[    .    1    ]" 1 
       2294 1 137 SER HA   1 139 ALA H    2.600     . 4.500 4.346 4.108 4.521 0.021 14 0 "[    .    1    ]" 1 
       2295 1 137 SER QB   1 138 HIS H    2.700     . 3.600 2.248 1.949 2.635     .  0 0 "[    .    1    ]" 1 
       2296 1 137 SER QB   1 141 GLY H    3.300     . 5.500 4.688 4.496 5.020     .  0 0 "[    .    1    ]" 1 
       2297 1 137 SER HB3  1 139 ALA H    3.300     . 5.500 3.385 3.321 3.433     .  0 0 "[    .    1    ]" 1 
       2298 1 137 SER HB3  1 141 GLY H    3.300 2.100 4.500 3.831 3.188 4.100     .  0 0 "[    .    1    ]" 1 
       2299 1 138 HIS H    1 138 HIS QB   2.700     . 3.600 2.234 2.092 2.457     .  0 0 "[    .    1    ]" 1 
       2300 1 138 HIS H    1 139 ALA H    2.700     . 3.600 2.472 1.941 2.745     .  0 0 "[    .    1    ]" 1 
       2301 1 138 HIS H    1 139 ALA MB   3.400     . 5.500 4.107 3.559 4.406     .  0 0 "[    .    1    ]" 1 
       2302 1 138 HIS HA   2   2 TYR QE   2.400     . 4.500 4.311 3.552 4.509 0.009 14 0 "[    .    1    ]" 1 
       2303 1 138 HIS QB   1 139 ALA H    3.200     . 5.200 2.965 2.682 3.470     .  0 0 "[    .    1    ]" 1 
       2304 1 139 ALA H    1 139 ALA HA   2.800     . 3.800 2.850 2.799 2.904     .  0 0 "[    .    1    ]" 1 
       2305 1 139 ALA H    1 139 ALA MB   2.300     . 3.100 2.140 2.043 2.242     .  0 0 "[    .    1    ]" 1 
       2306 1 139 ALA H    1 140 VAL H    2.900     . 3.900 2.825 2.651 3.002     .  0 0 "[    .    1    ]" 1 
       2307 1 139 ALA H    1 140 VAL HB   3.700     . 5.500 5.106 4.792 5.489     .  0 0 "[    .    1    ]" 1 
       2308 1 139 ALA H    1 140 VAL QG   3.600     . 5.500 4.058 3.833 4.277     .  0 0 "[    .    1    ]" 1 
       2309 1 139 ALA H    1 141 GLY H    3.300     . 5.500 3.841 3.366 4.227     .  0 0 "[    .    1    ]" 1 
       2310 1 139 ALA HA   1 139 ALA MB   2.200     . 3.000 2.101 2.077 2.128     .  0 0 "[    .    1    ]" 1 
       2311 1 139 ALA HA   1 140 VAL H    3.500 2.300 4.700 3.567 3.557 3.584     .  0 0 "[    .    1    ]" 1 
       2312 1 139 ALA HA   1 141 GLY H    3.700     . 5.500 4.567 4.136 4.974     .  0 0 "[    .    1    ]" 1 
       2313 1 139 ALA HA   1 142 CYS QB   3.000     . 4.800 3.198 2.321 4.064     .  0 0 "[    .    1    ]" 1 
       2314 1 139 ALA HA   1 142 CYS QB   2.800     . 4.400 3.046 2.304 3.615     .  0 0 "[    .    1    ]" 1 
       2315 1 139 ALA MB   1 140 VAL H    2.700     . 3.600 2.145 1.914 2.450     .  0 0 "[    .    1    ]" 1 
       2316 1 139 ALA MB   1 140 VAL QG   3.200     . 5.200 2.755 2.536 3.745     .  0 0 "[    .    1    ]" 1 
       2317 1 139 ALA MB   1 141 GLY H    3.500     . 5.500 4.245 3.940 4.483     .  0 0 "[    .    1    ]" 1 
       2318 1 139 ALA MB   1 142 CYS H    3.200     . 5.200 4.572 4.223 4.885     .  0 0 "[    .    1    ]" 1 
       2319 1 140 VAL H    1 140 VAL HA   2.900     . 3.900 2.791 2.741 2.872     .  0 0 "[    .    1    ]" 1 
       2320 1 140 VAL H    1 140 VAL HB   2.500     . 3.400 2.740 2.312 2.941     .  0 0 "[    .    1    ]" 1 
       2321 1 140 VAL H    1 140 VAL QG   2.900     . 4.000 1.955 1.880 2.623     .  0 0 "[    .    1    ]" 1 
       2322 1 140 VAL H    1 141 GLY H    2.700     . 3.600 2.735 2.417 2.923     .  0 0 "[    .    1    ]" 1 
       2323 1 140 VAL HA   1 140 VAL QG   2.600     . 3.200 2.057 1.951 2.139     .  0 0 "[    .    1    ]" 1 
       2324 1 140 VAL HA   1 141 GLY H    3.300 2.100 4.500 3.534 3.464 3.574     .  0 0 "[    .    1    ]" 1 
       2325 1 140 VAL HA   1 143 ALA H    2.800     . 4.400 2.995 2.586 3.429     .  0 0 "[    .    1    ]" 1 
       2326 1 140 VAL HA   1 143 ALA MB   2.700     . 3.600 2.078 1.792 2.436 0.008 12 0 "[    .    1    ]" 1 
       2327 1 140 VAL HA   1 144 PHE H    3.500     . 5.500 4.510 4.058 5.080     .  0 0 "[    .    1    ]" 1 
       2328 1 140 VAL HB   1 141 GLY H    2.800     . 3.800 2.700 2.287 3.868 0.068  7 0 "[    .    1    ]" 1 
       2329 1 140 VAL QG   1 141 GLY H    3.100 2.100 4.500 3.158 2.051 3.356 0.049  7 0 "[    .    1    ]" 1 
       2330 1 140 VAL QG   1 143 ALA H    3.400     . 5.500 3.892 3.516 4.340     .  0 0 "[    .    1    ]" 1 
       2331 1 140 VAL QG   1 143 ALA MB   2.900     . 4.600 2.546 1.847 3.126     .  0 0 "[    .    1    ]" 1 
       2332 1 140 VAL QG   1 144 PHE QR   2.600     . 4.500 2.279 1.892 3.669     .  0 0 "[    .    1    ]" 1 
       2333 1 140 VAL QG   1 144 PHE QE   2.900     . 4.600 2.352 1.934 3.949     .  0 0 "[    .    1    ]" 1 
       2334 1 141 GLY H    1 141 GLY HA2  2.600     . 3.500 2.786 2.746 2.880     .  0 0 "[    .    1    ]" 1 
       2335 1 141 GLY H    1 141 GLY HA3  2.800     . 3.800 2.302 2.298 2.317     .  0 0 "[    .    1    ]" 1 
       2336 1 141 GLY H    1 142 CYS H    2.800     . 3.800 2.724 2.380 2.924     .  0 0 "[    .    1    ]" 1 
       2337 1 141 GLY H    1 144 PHE QR   3.100     . 5.000 4.401 3.864 4.944     .  0 0 "[    .    1    ]" 1 
       2338 1 141 GLY HA2  1 142 CYS H    3.000     . 4.000 3.498 3.459 3.553     .  0 0 "[    .    1    ]" 1 
       2339 1 141 GLY HA2  1 144 PHE H    3.700     . 5.500 4.006 3.655 4.457     .  0 0 "[    .    1    ]" 1 
       2340 1 141 GLY HA3  1 142 CYS H    3.200     . 5.200 2.897 2.761 3.015     .  0 0 "[    .    1    ]" 1 
       2341 1 141 GLY HA3  1 144 PHE H    3.400     . 5.500 5.132 4.773 5.486     .  0 0 "[    .    1    ]" 1 
       2342 1 142 CYS H    1 144 PHE QD   2.900     . 4.600 4.050 3.688 4.362     .  0 0 "[    .    1    ]" 1 
       2343 1 142 CYS H    1 142 CYS HA   2.600     . 3.500 2.688 2.553 2.748     .  0 0 "[    .    1    ]" 1 
       2344 1 142 CYS H    1 142 CYS QB   2.600     . 3.500 2.246 2.089 2.413     .  0 0 "[    .    1    ]" 1 
       2345 1 142 CYS H    1 143 ALA HA   2.600     . 3.500 3.368 3.233 3.527 0.027  1 0 "[    .    1    ]" 1 
       2346 1 142 CYS H    1 143 ALA MB   3.000     . 4.800 3.639 3.565 3.740     .  0 0 "[    .    1    ]" 1 
       2347 1 142 CYS HA   1 142 CYS QB   2.600     . 3.500 2.436 2.181 2.531     .  0 0 "[    .    1    ]" 1 
       2348 1 142 CYS HA   1 143 ALA H    3.000     . 4.800 3.471 3.436 3.496     .  0 0 "[    .    1    ]" 1 
       2349 1 142 CYS HA   1 144 PHE HB2  3.000     . 4.800 4.708 4.291 4.815 0.015 14 0 "[    .    1    ]" 1 
       2350 1 142 CYS HA   1 145 ALA MB   2.400     . 3.200 2.681 1.982 3.190     .  0 0 "[    .    1    ]" 1 
       2351 1 142 CYS QB   1 143 ALA H    2.800     . 3.800 2.923 2.711 3.477     .  0 0 "[    .    1    ]" 1 
       2352 1 142 CYS QB   1 145 ALA MB   3.000     . 4.800 3.641 3.301 4.071     .  0 0 "[    .    1    ]" 1 
       2353 1 143 ALA H    1 143 ALA HA   2.700     . 3.600 2.764 2.720 2.807     .  0 0 "[    .    1    ]" 1 
       2354 1 143 ALA H    1 143 ALA MB   2.300     . 3.100 2.142 2.025 2.233     .  0 0 "[    .    1    ]" 1 
       2355 1 143 ALA H    1 144 PHE H    2.600     . 3.500 2.793 2.674 2.874     .  0 0 "[    .    1    ]" 1 
       2356 1 143 ALA H    1 144 PHE H    2.600     . 3.500 2.382 2.233 2.498     .  0 0 "[    .    1    ]" 1 
       2357 1 143 ALA H    1 144 PHE QR   3.500     . 5.500 4.102 3.622 4.783     .  0 0 "[    .    1    ]" 1 
       2358 1 143 ALA HA   1 143 ALA MB   2.200     . 3.000 2.109 2.080 2.127     .  0 0 "[    .    1    ]" 1 
       2359 1 143 ALA HA   1 144 PHE H    2.700     . 3.600 3.157 3.128 3.178     .  0 0 "[    .    1    ]" 1 
       2360 1 143 ALA HA   1 146 VAL H    2.600     . 3.500 2.782 2.685 2.871     .  0 0 "[    .    1    ]" 1 
       2361 1 143 ALA MB   1 144 PHE H    2.700     . 3.600 2.592 2.316 2.877     .  0 0 "[    .    1    ]" 1 
       2362 1 144 PHE H    1 144 PHE HA   2.800     . 3.800 2.815 2.757 2.892     .  0 0 "[    .    1    ]" 1 
       2363 1 144 PHE H    1 144 PHE HB2  3.200 2.100 4.300 2.342 2.172 2.554     .  0 0 "[    .    1    ]" 1 
       2364 1 144 PHE H    1 144 PHE QD   2.800     . 3.800 2.416 1.964 3.133     .  0 0 "[    .    1    ]" 1 
       2365 1 144 PHE H    1 145 ALA H    2.600     . 4.000 2.595 2.346 2.753     .  0 0 "[    .    1    ]" 1 
       2366 1 144 PHE H    1 145 ALA H    2.400     . 3.200 2.408 2.223 2.531     .  0 0 "[    .    1    ]" 1 
       2367 1 144 PHE H    1 145 ALA MB   3.200     . 5.200 4.245 3.923 4.412     .  0 0 "[    .    1    ]" 1 
       2368 1 144 PHE HA   1 144 PHE QD   2.600     . 3.500 2.872 2.296 3.086     .  0 0 "[    .    1    ]" 1 
       2369 1 144 PHE HA   1 145 ALA H    3.200     . 5.200 3.459 3.430 3.509     .  0 0 "[    .    1    ]" 1 
       2370 1 144 PHE HA   1 147 CYS QB   2.900     . 4.600 2.448 2.041 3.059     .  0 0 "[    .    1    ]" 1 
       2371 1 144 PHE HA   1 148 LEU QD   2.400     . 3.600 2.690 1.982 2.974     .  0 0 "[    .    1    ]" 1 
       2372 1 144 PHE HB2  1 145 ALA H    3.000     . 4.000 3.064 2.834 3.227     .  0 0 "[    .    1    ]" 1 
       2373 1 145 ALA H    1 145 ALA HA   2.600     . 3.500 2.742 2.705 2.804     .  0 0 "[    .    1    ]" 1 
       2374 1 145 ALA H    1 145 ALA MB   2.300     . 3.100 2.183 2.031 2.242     .  0 0 "[    .    1    ]" 1 
       2375 1 145 ALA H    1 146 VAL H    2.700     . 3.600 2.876 2.749 3.122     .  0 0 "[    .    1    ]" 1 
       2376 1 145 ALA HA   1 145 ALA MB   2.000     . 2.700 2.119 2.082 2.128     .  0 0 "[    .    1    ]" 1 
       2377 1 145 ALA HA   1 146 VAL H    3.400     . 5.500 3.529 3.470 3.585     .  0 0 "[    .    1    ]" 1 
       2378 1 145 ALA HA   1 148 LEU QD   2.500     . 3.400 3.139 2.633 3.385     .  0 0 "[    .    1    ]" 1 
       2379 1 145 ALA HA   1 148 LEU QD   2.700     . 3.600 2.153 1.759 2.659 0.041  2 0 "[    .    1    ]" 1 
       2380 1 145 ALA MB   1 146 VAL H    2.700     . 3.600 2.563 2.209 2.859     .  0 0 "[    .    1    ]" 1 
       2381 1 145 ALA MB   1 146 VAL QG   2.500     . 3.400 3.020 2.922 3.213     .  0 0 "[    .    1    ]" 1 
       2382 1 146 VAL H    1 146 VAL HB   2.900     . 4.600 2.514 2.306 3.152     .  0 0 "[    .    1    ]" 1 
       2383 1 146 VAL H    1 146 VAL QG   2.400     . 3.200 2.213 1.828 2.569     .  0 0 "[    .    1    ]" 1 
       2384 1 146 VAL HA   1 146 VAL HB   2.400     . 3.600 2.916 2.433 3.023     .  0 0 "[    .    1    ]" 1 
       2385 1 146 VAL HA   1 146 VAL QG   2.100     . 2.800 2.096 2.051 2.205     .  0 0 "[    .    1    ]" 1 
       2386 1 146 VAL HA   1 149 GLU H    3.500     . 5.500 3.381 2.934 3.868     .  0 0 "[    .    1    ]" 1 
       2387 1 146 VAL HA   1 149 GLU QB   2.500     . 3.400 3.016 2.679 3.334     .  0 0 "[    .    1    ]" 1 
       2388 1 146 VAL HB   1 146 VAL QG   2.200     . 3.000 1.879 1.864 1.896     .  0 0 "[    .    1    ]" 1 
       2389 1 146 VAL HB   1 147 CYS H    2.600     . 3.500 2.964 2.689 3.550 0.050 11 0 "[    .    1    ]" 1 
       2390 1 146 VAL QG   1 147 CYS H    2.800     . 4.400 3.027 1.836 3.396     .  0 0 "[    .    1    ]" 1 
       2391 1 146 VAL QG   1 147 CYS HA   3.100     . 5.000 3.522 3.103 3.721     .  0 0 "[    .    1    ]" 1 
       2392 1 146 VAL QG   1 149 GLU H    3.000     . 4.800 4.340 4.048 4.527     .  0 0 "[    .    1    ]" 1 
       2393 1 146 VAL QG   1 149 GLU QB   2.900     . 4.600 3.647 3.238 4.205     .  0 0 "[    .    1    ]" 1 
       2394 1 147 CYS H    1 147 CYS HA   2.700     . 4.200 2.777 2.717 2.832     .  0 0 "[    .    1    ]" 1 
       2395 1 147 CYS H    1 147 CYS QB   2.400     . 3.200 2.216 2.086 2.258     .  0 0 "[    .    1    ]" 1 
       2396 1 147 CYS H    1 148 LEU HG   3.500     . 5.500 4.937 4.280 5.512 0.012 12 0 "[    .    1    ]" 1 
       2397 1 147 CYS HA   1 147 CYS QB   2.300     . 3.100 2.388 2.317 2.515     .  0 0 "[    .    1    ]" 1 
       2398 1 147 CYS HA   1 148 LEU H    2.900     . 4.600 2.799 2.785 2.813     .  0 0 "[    .    1    ]" 1 
       2399 1 147 CYS HA   1 148 LEU QD   2.600     . 3.500 2.149 1.756 2.561     .  0 0 "[    .    1    ]" 1 
       2400 1 147 CYS HA   1 148 LEU QD   2.800     . 4.400 4.131 3.953 4.292     .  0 0 "[    .    1    ]" 1 
       2401 1 147 CYS QB   1 148 LEU H    3.100     . 4.200 2.595 2.148 2.951     .  0 0 "[    .    1    ]" 1 
       2402 1 148 LEU H    1 148 LEU QB   3.100     . 4.200 2.901 2.515 3.127     .  0 0 "[    .    1    ]" 1 
       2403 1 148 LEU H    1 148 LEU QD   3.000     . 4.800 2.120 1.881 2.631     .  0 0 "[    .    1    ]" 1 
       2404 1 148 LEU H    1 148 LEU HG   3.100     . 5.000 2.694 2.016 3.578     .  0 0 "[    .    1    ]" 1 
       2405 1 148 LEU H    1 152 GLN H    2.900     . 4.500 4.461 4.144 4.590 0.090 10 0 "[    .    1    ]" 1 
       2406 1 148 LEU HA   1 148 LEU MD1  2.500     . 3.800 2.946 2.532 3.259     .  0 0 "[    .    1    ]" 1 
       2407 1 148 LEU HA   1 148 LEU QB   2.400     . 3.200 2.211 2.149 2.366     .  0 0 "[    .    1    ]" 1 
       2408 1 148 LEU HA   1 148 LEU QD   2.100     . 4.500 3.194 3.070 3.359     .  0 0 "[    .    1    ]" 1 
       2409 1 148 LEU HA   1 149 GLU H    2.700     . 3.600 2.289 2.229 2.446     .  0 0 "[    .    1    ]" 1 
       2410 1 148 LEU QB   1 148 LEU QD   2.400     . 3.100 1.845 1.779 1.908     .  0 0 "[    .    1    ]" 1 
       2411 1 148 LEU QB   1 149 GLU H    3.200     . 5.200 3.426 2.423 4.024     .  0 0 "[    .    1    ]" 1 
       2412 1 148 LEU QB   1 151 LYS H    3.100     . 4.200 2.329 2.078 2.757     .  0 0 "[    .    1    ]" 1 
       2413 1 148 LEU QB   1 152 GLN HA   2.900     . 4.600 3.716 2.777 4.285     .  0 0 "[    .    1    ]" 1 
       2414 1 148 LEU QB   1 153 ARG H    3.000     . 4.000 2.808 2.231 3.774     .  0 0 "[    .    1    ]" 1 
       2415 1 148 LEU HB3  1 152 GLN HA   2.700     . 3.600 2.498 2.012 3.311     .  0 0 "[    .    1    ]" 1 
       2416 1 148 LEU QD   1 148 LEU HG   2.200     . 2.800 1.879 1.855 1.894     .  0 0 "[    .    1    ]" 1 
       2417 1 148 LEU QD   1 150 ARG HB3  2.400     . 4.500 3.606 3.185 4.197     .  0 0 "[    .    1    ]" 1 
       2418 1 148 LEU QD   1 151 LYS HA   2.100     . 2.800 2.226 1.767 2.780     .  0 0 "[    .    1    ]" 1 
       2419 1 148 LEU QD   1 151 LYS QD   2.600     . 3.500 3.111 2.695 3.484     .  0 0 "[    .    1    ]" 1 
       2420 1 148 LEU QD   1 151 LYS HD2  2.300     . 3.100 2.603 1.882 3.088     .  0 0 "[    .    1    ]" 1 
       2421 1 148 LEU QD   1 153 ARG HA   2.300     . 3.100 2.802 2.015 3.215 0.115  1 0 "[    .    1    ]" 1 
       2422 1 148 LEU QD   1 153 ARG QB   2.300     . 3.400 2.622 1.814 3.050     .  0 0 "[    .    1    ]" 1 
       2423 1 148 LEU QD   2   3 ILE HA   3.600     . 5.500 4.031 3.669 4.319     .  0 0 "[    .    1    ]" 1 
       2424 1 148 LEU QD   2   3 ILE HB   2.300     . 3.400 3.187 2.903 3.316     .  0 0 "[    .    1    ]" 1 
       2425 1 148 LEU QD   2   3 ILE MD   3.600     . 5.500 2.278 1.693 2.997     .  0 0 "[    .    1    ]" 1 
       2426 1 148 LEU QD   2   3 ILE HG12 2.400     . 3.200 2.458 1.700 4.177 0.977  9 2 "[-   .   +1    ]" 1 
       2427 1 148 LEU QD   2   3 ILE HG13 4.100     . 5.500 2.669 1.855 3.256     .  0 0 "[    .    1    ]" 1 
       2428 1 148 LEU QD   2   7 LEU QD   3.700     . 5.500 3.458 2.357 4.360     .  0 0 "[    .    1    ]" 1 
       2429 1 149 GLU H    1 149 GLU QB   2.800     . 3.500 2.755 2.129 3.323     .  0 0 "[    .    1    ]" 1 
       2430 1 149 GLU H    1 150 ARG H    2.900     . 3.900 3.320 2.725 3.922 0.022  2 0 "[    .    1    ]" 1 
       2431 1 149 GLU H    1 151 LYS H    3.000     . 4.800 4.024 3.463 4.526     .  0 0 "[    .    1    ]" 1 
       2432 1 149 GLU HA   1 149 GLU QB   2.300     . 3.100 2.341 2.137 2.494     .  0 0 "[    .    1    ]" 1 
       2433 1 149 GLU HA   1 149 GLU QG   2.500     . 3.800 2.638 2.129 3.346     .  0 0 "[    .    1    ]" 1 
       2434 1 149 GLU HA   1 150 ARG H    2.600     . 4.000 2.226 1.910 2.515     .  0 0 "[    .    1    ]" 1 
       2435 1 149 GLU HA   1 151 LYS QD   2.800     . 4.400 3.998 3.136 4.407 0.007 14 0 "[    .    1    ]" 1 
       2436 1 150 ARG H    1 150 ARG HB2  2.500     . 3.400 2.671 2.104 3.101     .  0 0 "[    .    1    ]" 1 
       2437 1 150 ARG H    1 150 ARG QD   3.300     . 5.500 4.712 3.938 5.421     .  0 0 "[    .    1    ]" 1 
       2438 1 150 ARG HA   1 150 ARG QB   2.600     . 3.500 2.464 2.266 2.539     .  0 0 "[    .    1    ]" 1 
       2439 1 150 ARG HA   1 150 ARG QG   2.600     . 3.500 2.293 2.060 2.674     .  0 0 "[    .    1    ]" 1 
       2440 1 150 ARG HA   1 151 LYS H    2.700     . 3.600 2.212 2.190 2.227     .  0 0 "[    .    1    ]" 1 
       2441 1 150 ARG QB   1 150 ARG QD   3.100     . 5.000 2.090 1.928 2.361     .  0 0 "[    .    1    ]" 1 
       2442 1 150 ARG QB   1 150 ARG HE   3.100     . 4.200 3.290 2.367 4.052     .  0 0 "[    .    1    ]" 1 
       2443 1 150 ARG QB   1 152 GLN HA   2.300     . 4.500 3.822 3.681 3.921     .  0 0 "[    .    1    ]" 1 
       2444 1 150 ARG QB   1 152 GLN HA   2.300     . 4.500 4.251 3.926 4.532 0.032 13 0 "[    .    1    ]" 1 
       2445 1 150 ARG HB3  1 151 LYS H    2.500     . 3.400 3.073 2.803 3.201     .  0 0 "[    .    1    ]" 1 
       2446 1 150 ARG HB3  1 152 GLN H    2.500     . 3.400 3.446 3.168 3.776 0.376 11 0 "[    .    1    ]" 1 
       2447 1 150 ARG QD   1 150 ARG HE   3.100     . 4.200 2.401 2.186 2.489     .  0 0 "[    .    1    ]" 1 
       2448 1 150 ARG HE   1 150 ARG QG   3.000     . 4.000 2.430 2.095 3.051     .  0 0 "[    .    1    ]" 1 
       2449 1 151 LYS HA   1 151 LYS QD   2.300     . 3.100 2.114 1.906 2.828     .  0 0 "[    .    1    ]" 1 
       2450 1 151 LYS HA   1 151 LYS QG   2.700     . 3.600 2.852 2.341 3.198     .  0 0 "[    .    1    ]" 1 
       2451 1 151 LYS HA   1 152 GLN H    2.600     . 4.000 2.786 2.644 2.940     .  0 0 "[    .    1    ]" 1 
       2452 1 151 LYS HA   1 152 GLN H    2.800     . 3.800 2.501 2.434 2.592     .  0 0 "[    .    1    ]" 1 
       2453 1 151 LYS HA   1 153 ARG QD   2.900     . 4.600 4.091 2.734 4.695 0.095  8 0 "[    .    1    ]" 1 
       2454 1 151 LYS HA   1 153 ARG HG3  2.800     . 4.400 3.159 2.146 4.170     .  0 0 "[    .    1    ]" 1 
       2455 1 151 LYS QB   1 151 LYS QD   2.100     . 2.800 2.432 2.202 2.707     .  0 0 "[    .    1    ]" 1 
       2456 1 151 LYS QB   1 153 ARG H    2.300     . 4.500 4.049 3.570 4.590 0.090  2 0 "[    .    1    ]" 1 
       2457 1 151 LYS QD   1 151 LYS QG   1.900     . 2.600 2.055 2.023 2.089     .  0 0 "[    .    1    ]" 1 
       2458 1 151 LYS QE   1 151 LYS QG   2.700     . 3.600 2.188 2.002 2.468     .  0 0 "[    .    1    ]" 1 
       2459 1 151 LYS QE   2   2 TYR HB3  3.400     . 5.500 5.073 4.349 5.510 0.010  1 0 "[    .    1    ]" 1 
       2460 1 152 GLN H    1 152 GLN HB2  2.600     . 3.500 2.343 2.077 3.595 0.095 12 0 "[    .    1    ]" 1 
       2461 1 152 GLN H    1 152 GLN QG   3.200 2.100 4.300 3.200 2.117 4.054     .  0 0 "[    .    1    ]" 1 
       2462 1 152 GLN HA   1 152 GLN QB   2.400     . 3.200 2.455 2.181 2.537     .  0 0 "[    .    1    ]" 1 
       2463 1 152 GLN HA   1 153 ARG H    2.500     . 3.800 2.351 2.231 2.624     .  0 0 "[    .    1    ]" 1 
       2464 1 152 GLN QB   1 153 ARG H    2.800     . 4.400 3.472 2.413 3.993     .  0 0 "[    .    1    ]" 1 
       2465 1 152 GLN QB   1 153 ARG QB   2.900     . 4.600 4.645 3.651 5.193 0.593 12 1 "[    .    1 +  ]" 1 
       2466 1 152 GLN HE21 1 152 GLN QG   3.000     . 4.800 2.191 2.091 2.479     .  0 0 "[    .    1    ]" 1 
       2467 1 152 GLN HE22 1 152 GLN QG   3.300     . 5.500 3.260 3.216 3.383     .  0 0 "[    .    1    ]" 1 
       2468 1 153 ARG H    1 153 ARG QB   2.600     . 3.500 2.512 2.039 3.124     .  0 0 "[    .    1    ]" 1 
       2469 1 153 ARG H    1 153 ARG QG   2.900     . 4.600 3.303 2.248 4.229     .  0 0 "[    .    1    ]" 1 
       2470 1 153 ARG HA   1 153 ARG QB   2.400     . 3.200 2.439 2.178 2.536     .  0 0 "[    .    1    ]" 1 
       2471 1 153 ARG HA   1 153 ARG QD   2.900     . 4.600 3.259 1.904 4.113     .  0 0 "[    .    1    ]" 1 
       2472 1 153 ARG HA   1 154 ARG H    2.900     . 3.900 2.569 2.134 3.557     .  0 0 "[    .    1    ]" 1 
       2473 1 153 ARG HA   2   7 LEU HA   3.800     . 5.500 5.428 4.854 5.580 0.080  8 0 "[    .    1    ]" 1 
       2474 1 153 ARG HB2  1 153 ARG HD2  2.400     . 3.200 2.014 1.759 2.409     .  0 0 "[    .    1    ]" 1 
       2475 1 153 ARG QB   1 153 ARG HG2  1.700     . 2.300 1.849 1.777 1.953     .  0 0 "[    .    1    ]" 1 
       2476 1 153 ARG QB   1 154 ARG H    2.700     . 3.600 2.252 1.883 2.788     .  0 0 "[    .    1    ]" 1 
       2477 1 153 ARG QB   1 155 THR H    3.000     . 4.800 3.144 2.180 3.635     .  0 0 "[    .    1    ]" 1 
       2478 1 153 ARG QB   2   7 LEU HA   2.700     . 4.500 3.681 2.853 4.483     .  0 0 "[    .    1    ]" 1 
       2479 1 153 ARG QB   1 155 THR MG   2.500     . 3.400 2.426 1.794 3.412 0.012 10 0 "[    .    1    ]" 1 
       2480 1 153 ARG QB   2   3 ILE MD   3.100     . 5.000 4.320 3.222 5.047 0.047  2 0 "[    .    1    ]" 1 
       2481 1 153 ARG QG   1 154 ARG H    3.100     . 5.000 3.184 1.874 3.716     .  0 0 "[    .    1    ]" 1 
       2482 1 153 ARG QG   2   3 ILE HA   2.400     . 3.200 2.329 1.990 3.078     .  0 0 "[    .    1    ]" 1 
       2483 1 153 ARG QG   1 155 THR MG   2.600     . 4.000 2.846 2.027 3.563     .  0 0 "[    .    1    ]" 1 
       2484 1 153 ARG QG   1 155 THR MG   2.900     . 4.600 3.044 2.061 3.702     .  0 0 "[    .    1    ]" 1 
       2485 1 153 ARG QG   1 155 THR MG   2.000     . 4.500 2.870 2.028 3.665     .  0 0 "[    .    1    ]" 1 
       2486 1 153 ARG QG   2   7 LEU HA   2.800     . 4.200 3.296 2.147 4.203 0.003  6 0 "[    .    1    ]" 1 
       2487 1 153 ARG QG   2   7 LEU HG   2.400     . 4.500 3.178 1.930 4.391     .  0 0 "[    .    1    ]" 1 
       2488 1 154 ARG HA   1 154 ARG QB   2.400     . 3.200 2.432 2.175 2.535     .  0 0 "[    .    1    ]" 1 
       2489 1 154 ARG HA   1 154 ARG QG   2.700     . 3.600 2.386 2.018 3.330     .  0 0 "[    .    1    ]" 1 
       2490 1 154 ARG HA   1 157 ALA MB   3.000     . 4.800 4.194 2.161 4.835 0.035 14 0 "[    .    1    ]" 1 
       2491 1 154 ARG QB   1 154 ARG HD2  2.300     . 3.400 1.990 1.796 2.268     .  0 0 "[    .    1    ]" 1 
       2492 1 154 ARG QB   1 154 ARG QG   1.800     . 2.400 1.853 1.823 1.875     .  0 0 "[    .    1    ]" 1 
       2493 1 155 THR H    1 155 THR HA   2.700     . 3.600 2.894 2.737 2.948     .  0 0 "[    .    1    ]" 1 
       2494 1 155 THR H    1 155 THR HA   2.500     . 3.800 2.741 2.342 2.837     .  0 0 "[    .    1    ]" 1 
       2495 1 155 THR H    1 155 THR MG   3.100     . 5.000 2.339 1.885 3.205     .  0 0 "[    .    1    ]" 1 
       2496 1 155 THR H    1 156 ARG H    3.100     . 5.000 3.196 1.989 4.637     .  0 0 "[    .    1    ]" 1 
       2497 1 155 THR HA   1 155 THR MG   2.500     . 3.400 2.835 2.335 3.219     .  0 0 "[    .    1    ]" 1 
       2498 1 155 THR HA   1 156 ARG H    2.500     . 3.400 2.041 1.869 2.214     .  0 0 "[    .    1    ]" 1 
       2499 1 155 THR HB   1 155 THR MG   2.100     . 2.800 2.103 2.082 2.116     .  0 0 "[    .    1    ]" 1 
       2500 1 155 THR MG   2   3 ILE HA   4.200     . 5.500 5.408 4.952 5.588 0.088  8 0 "[    .    1    ]" 1 
       2501 1 155 THR MG   2   3 ILE MG   3.500     . 5.500 4.836 3.349 5.540 0.040  8 0 "[    .    1    ]" 1 
       2502 1 155 THR MG   2   7 LEU QD   2.100     . 2.800 1.992 1.621 2.564     .  0 0 "[    .    1    ]" 1 
       2503 1 156 ARG H    1 156 ARG QG   3.100     . 5.000 3.194 1.948 4.175     .  0 0 "[    .    1    ]" 1 
       2504 1 156 ARG HA   1 157 ALA H    2.600     . 3.500 2.439 1.959 2.808     .  0 0 "[    .    1    ]" 1 
       2505 1 156 ARG QB   1 156 ARG QG   1.600     . 2.200 2.056 1.982 2.087     .  0 0 "[    .    1    ]" 1 
       2506 1 156 ARG QB   1 157 ALA MB   2.400     . 3.200 3.162 3.044 3.238 0.038  2 0 "[    .    1    ]" 1 
       2507 1 157 ALA H    1 157 ALA MB   2.800     . 3.800 2.540 2.186 2.907     .  0 0 "[    .    1    ]" 1 
       2508 1 157 ALA HA   1 157 ALA MB   2.100     . 2.800 1.876 1.858 1.890     .  0 0 "[    .    1    ]" 1 
       2509 1 157 ALA MB   1 158 ALA H    2.800     . 3.800 2.312 1.907 2.771     .  0 0 "[    .    1    ]" 1 
       2510 1 158 ALA HA   1 159 ALA H    3.200     . 5.200 2.650 2.177 3.561     .  0 0 "[    .    1    ]" 1 
       2511 1 158 ALA MB   1 159 ALA H    3.000     . 4.800 2.271 1.822 2.795     .  0 0 "[    .    1    ]" 1 
       2512 1 159 ALA H    1 159 ALA HA   3.000     . 4.800 2.638 2.276 2.945     .  0 0 "[    .    1    ]" 1 
       2513 1 159 ALA HA   1 159 ALA MB   2.200     . 3.000 2.104 2.083 2.125     .  0 0 "[    .    1    ]" 1 
       2514 2   1 ALA HA   2   2 TYR H    2.900     . 4.600 3.365 2.625 3.575     .  0 0 "[    .    1    ]" 1 
       2515 2   1 ALA MB   2   2 TYR H    2.400     . 3.600 1.975 1.893 2.098     .  0 0 "[    .    1    ]" 1 
       2516 2   1 ALA MB   2   2 TYR HB2  3.000     . 4.800 4.611 4.343 4.813 0.013  9 0 "[    .    1    ]" 1 
       2517 2   1 ALA MB   2   2 TYR HB2  3.000     . 4.800 3.612 2.204 4.548     .  0 0 "[    .    1    ]" 1 
       2518 2   1 ALA MB   2   3 ILE H    2.900     . 4.600 3.362 2.268 4.056     .  0 0 "[    .    1    ]" 1 
       2519 2   1 ALA MB   2   5 PRO HA   2.800     . 4.400 3.307 3.061 3.557     .  0 0 "[    .    1    ]" 1 
       2520 2   1 ALA MB   2   4 GLY H    3.100     . 5.000 3.819 3.370 4.480     .  0 0 "[    .    1    ]" 1 
       2521 2   1 ALA MB   2   5 PRO HB2  2.400     . 3.600 2.329 1.930 3.021     .  0 0 "[    .    1    ]" 1 
       2522 2   1 ALA MB   2   5 PRO HB3  2.300     . 3.400 3.375 3.241 3.435 0.035 14 0 "[    .    1    ]" 1 
       2523 2   1 ALA MB   2   5 PRO HD2  2.600     . 4.000 2.324 1.833 3.451     .  0 0 "[    .    1    ]" 1 
       2524 2   1 ALA MB   2   5 PRO HD3  2.800     . 4.400 3.351 3.098 4.017     .  0 0 "[    .    1    ]" 1 
       2525 2   2 TYR H    2   2 TYR HB2  3.000     . 4.800 3.759 3.386 4.068     .  0 0 "[    .    1    ]" 1 
       2526 2   2 TYR H    2   2 TYR QD   2.600     . 4.000 2.180 1.940 2.553     .  0 0 "[    .    1    ]" 1 
       2527 2   2 TYR HA   2   2 TYR QD   2.900     . 4.600 3.568 3.464 3.607     .  0 0 "[    .    1    ]" 1 
       2528 2   2 TYR HB2  2   2 TYR QD   2.500     . 3.800 2.734 2.660 2.772     .  0 0 "[    .    1    ]" 1 
       2529 2   2 TYR HB2  2   2 TYR QE   3.000     . 4.800 4.503 4.485 4.514     .  0 0 "[    .    1    ]" 1 
       2530 2   2 TYR HB2  2   3 ILE H    3.200     . 5.200 2.584 1.934 4.261     .  0 0 "[    .    1    ]" 1 
       2531 2   2 TYR HB2  2   3 ILE HB   3.000     . 4.800 3.926 3.427 4.545     .  0 0 "[    .    1    ]" 1 
       2532 2   2 TYR HB2  2   3 ILE MD   2.400     . 3.600 2.811 1.892 3.635 0.035  3 0 "[    .    1    ]" 1 
       2533 2   2 TYR HB3  2   2 TYR QD   2.900     . 4.600 2.350 2.266 2.540     .  0 0 "[    .    1    ]" 1 
       2534 2   2 TYR HB3  2   3 ILE H    3.100     . 5.000 3.731 3.230 4.555     .  0 0 "[    .    1    ]" 1 
       2535 2   2 TYR QD   2   3 ILE HB   3.000     . 4.800 4.562 4.014 4.843 0.043  5 0 "[    .    1    ]" 1 
       2536 2   2 TYR QD   2   4 GLY QA   2.900     . 4.600 3.607 2.653 4.091     .  0 0 "[    .    1    ]" 1 
       2537 2   2 TYR QD   2   5 PRO HB2  3.000     . 4.800 4.689 4.494 5.046 0.246 13 0 "[    .    1    ]" 1 
       2538 2   2 TYR QD   2   5 PRO HB2  2.800     . 4.400 4.462 4.114 4.929 0.529 13 1 "[    .    1  + ]" 1 
       2539 2   3 ILE H    2   3 ILE HB   2.800     . 4.400 3.009 2.520 3.841     .  0 0 "[    .    1    ]" 1 
       2540 2   3 ILE H    2   3 ILE MG   3.000     . 4.800 3.887 3.753 4.071     .  0 0 "[    .    1    ]" 1 
       2541 2   3 ILE HA   2   3 ILE HB   2.700     . 4.200 3.011 2.987 3.022     .  0 0 "[    .    1    ]" 1 
       2542 2   3 ILE HA   2   3 ILE MD   2.400     . 3.600 2.940 2.049 3.637 0.037  2 0 "[    .    1    ]" 1 
       2543 2   3 ILE HA   2   3 ILE HG12 2.600     . 4.000 3.421 3.109 3.649     .  0 0 "[    .    1    ]" 1 
       2544 2   3 ILE HA   2   3 ILE HG13 2.600     . 4.000 2.890 2.265 3.882     .  0 0 "[    .    1    ]" 1 
       2545 2   3 ILE HA   2   3 ILE MG   2.300     . 3.400 2.297 2.093 2.478     .  0 0 "[    .    1    ]" 1 
       2546 2   3 ILE HA   2   4 GLY H    2.900     . 4.600 3.285 2.503 3.581     .  0 0 "[    .    1    ]" 1 
       2547 2   3 ILE HA   2   4 GLY QA   3.100     . 5.000 3.543 2.065 3.810     .  0 0 "[    .    1    ]" 1 
       2548 2   3 ILE HA   2   4 GLY QA   2.900     . 4.600 4.048 3.527 4.287     .  0 0 "[    .    1    ]" 1 
       2549 2   3 ILE HA   2   6 PTR HD1  3.100     . 5.000 4.678 3.316 5.043 0.043  4 0 "[    .    1    ]" 1 
       2550 2   3 ILE HA   2   7 LEU H    3.200     . 5.200 3.759 1.948 5.279 0.079  5 0 "[    .    1    ]" 1 
       2551 2   3 ILE HA   2   7 LEU QB   2.800     . 4.400 3.472 1.896 4.343     .  0 0 "[    .    1    ]" 1 
       2552 2   3 ILE HA   2   7 LEU QD   2.800     . 4.400 2.665 1.873 4.093     .  0 0 "[    .    1    ]" 1 
       2553 2   3 ILE HA   2   7 LEU HG   2.900     . 4.600 3.597 1.945 4.667 0.067 11 0 "[    .    1    ]" 1 
       2554 2   3 ILE HB   2   3 ILE MD   2.300     . 3.400 2.528 2.031 3.229     .  0 0 "[    .    1    ]" 1 
       2555 2   3 ILE HB   2   3 ILE MG   2.000     . 2.800 2.100 2.080 2.127     .  0 0 "[    .    1    ]" 1 
       2556 2   3 ILE HB   2   4 GLY H    3.200     . 5.200 3.035 2.053 4.355     .  0 0 "[    .    1    ]" 1 
       2557 2   3 ILE MD   2   3 ILE HG12 2.100     . 3.000 2.090 2.073 2.115     .  0 0 "[    .    1    ]" 1 
       2558 2   3 ILE MD   2   3 ILE HG13 2.000     . 2.800 2.091 2.073 2.115     .  0 0 "[    .    1    ]" 1 
       2559 2   3 ILE MD   2   4 GLY H    2.900     . 4.600 4.167 3.610 4.609 0.009  8 0 "[    .    1    ]" 1 
       2560 2   3 ILE HG13 2   3 ILE MG   2.300     . 3.400 2.561 2.175 2.949     .  0 0 "[    .    1    ]" 1 
       2561 2   3 ILE HG13 2   4 GLY H    3.200     . 5.200 4.771 4.426 5.987 0.787  7 1 "[    . +  1    ]" 1 
       2562 2   3 ILE HG13 2   4 GLY H    3.100     . 5.000 4.447 4.226 4.989     .  0 0 "[    .    1    ]" 1 
       2563 2   3 ILE MG   2   4 GLY H    2.500     . 3.800 3.600 2.843 3.962 0.162  8 0 "[    .    1    ]" 1 
       2564 2   4 GLY H    2   5 PRO HG3  3.300     . 5.500 5.409 4.906 5.697 0.197  8 0 "[    .    1    ]" 1 
       2565 2   4 GLY H    2   7 LEU QD   3.200     . 5.200 4.567 2.100 5.243 0.043  2 0 "[    .    1    ]" 1 
       2566 2   4 GLY QA   2   5 PRO HA   3.100     . 5.000 3.819 2.072 4.105     .  0 0 "[    .    1    ]" 1 
       2567 2   4 GLY QA   2   5 PRO HA   3.000     . 4.800 3.379 2.065 3.634     .  0 0 "[    .    1    ]" 1 
       2568 2   4 GLY QA   2   5 PRO HD3  2.700     . 4.200 2.361 1.910 4.004     .  0 0 "[    .    1    ]" 1 
       2569 2   5 PRO HA   2   5 PRO HB2  2.300     . 3.400 2.923 2.650 3.005     .  0 0 "[    .    1    ]" 1 
       2570 2   5 PRO HA   2   5 PRO HD2  2.900     . 4.600 3.937 3.890 4.095     .  0 0 "[    .    1    ]" 1 
       2571 2   5 PRO HA   2   5 PRO HG2  2.700     . 4.200 3.931 3.809 4.058     .  0 0 "[    .    1    ]" 1 
       2572 2   5 PRO HA   2   5 PRO HG3  2.600     . 4.000 3.164 2.735 4.060 0.060 14 0 "[    .    1    ]" 1 
       2573 2   5 PRO HB2  2   5 PRO HD3  3.100     . 5.000 3.870 3.799 3.973     .  0 0 "[    .    1    ]" 1 
       2574 2   5 PRO HB3  2   5 PRO HD2  2.900     . 4.600 3.867 3.808 3.943     .  0 0 "[    .    1    ]" 1 
       2575 2   5 PRO HB3  2   5 PRO HD3  3.000     . 4.800 3.909 2.948 4.094     .  0 0 "[    .    1    ]" 1 
       2576 2   5 PRO HB3  2   5 PRO HG3  2.400     . 3.600 2.323 2.297 2.347     .  0 0 "[    .    1    ]" 1 
       2577 2   5 PRO HD2  2   5 PRO HG2  2.900     . 4.600 2.322 2.285 2.362     .  0 0 "[    .    1    ]" 1 
       2578 2   5 PRO HD2  2   5 PRO HG3  2.800     . 4.400 2.958 2.717 3.006     .  0 0 "[    .    1    ]" 1 
       2579 2   5 PRO HD3  2   5 PRO HG2  2.700     . 4.200 2.720 2.640 2.981     .  0 0 "[    .    1    ]" 1 
       2580 2   5 PRO HD3  2   5 PRO HG3  2.700     . 4.200 2.315 2.282 2.339     .  0 0 "[    .    1    ]" 1 
       2581 2   6 PTR HD1  2   7 LEU MD2  3.000     . 4.800 3.564 2.230 4.461     .  0 0 "[    .    1    ]" 1 
       2582 2   6 PTR HD1  2   6 PTR HE1  1.900     . 2.600 2.201 2.194 2.209     .  0 0 "[    .    1    ]" 1 
       2583 2   6 PTR HE1  2   7 LEU MD2  2.800     . 4.400 4.029 2.723 4.444 0.044 11 0 "[    .    1    ]" 1 
       2584 2   7 LEU H    2   7 LEU QB   2.200     . 3.200 2.880 2.047 3.413 0.213 11 0 "[    .    1    ]" 1 
       2585 2   7 LEU H    2   7 LEU QB   2.900     . 4.600 2.675 1.915 3.305     .  0 0 "[    .    1    ]" 1 
       2586 2   7 LEU H    2   7 LEU QD   2.500     . 3.800 2.882 1.921 3.878 0.078  8 0 "[    .    1    ]" 1 
       2587 2   7 LEU H    2   7 LEU HG   2.800     . 4.400 3.705 1.955 4.463 0.063  2 0 "[    .    1    ]" 1 
       2588 2   7 LEU HA   2   7 LEU QB   1.900     . 2.600 2.433 2.198 2.534     .  0 0 "[    .    1    ]" 1 
       2589 2   7 LEU HA   2   7 LEU QD   1.900     . 2.600 2.157 1.917 2.655 0.055  2 0 "[    .    1    ]" 1 
       2590 2   7 LEU QB   2   7 LEU QD   1.800     . 2.400 1.922 1.801 1.975     .  0 0 "[    .    1    ]" 1 
       2591 2   7 LEU QD   2   7 LEU HG   1.900     . 2.600 1.874 1.854 1.891     .  0 0 "[    .    1    ]" 1 
    stop_

save_



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