5 TYR  HA      5 TYR  QE      7.27            #peak    45
  5 TYR  QE     69 LYS+ HA      6.40            #peak    47
  5 TYR  QD     69 LYS+ HA      6.77            #peak    48
  5 TYR  HA      5 TYR  QD      5.55            #peak    49
  5 TYR  QD     24 ALA  HA      6.99            #peak    50
  5 TYR  QD     74 ARG+ HA      7.10            #peak    51
  5 TYR  HB2     5 TYR  QD      6.02            #peak    52
  5 TYR  QD     75 ASP- HB3     5.73            #peak    53
  5 TYR  QD     68 LEU  HB2     7.10            #peak    54
  3 GLU- HG3     5 TYR  QD      8.14            #peak    55
  5 TYR  QD     73 VAL  HB      6.95            #peak    56
  5 TYR  QD     68 LEU  HB3     7.71            #peak    57
  5 TYR  QE      5 TYR  QD      7.61            #peak    60
  5 TYR  QD      5 TYR  QE      7.64            #peak    61
  5 TYR  HN      5 TYR  QD      8.03            #peak    63
  5 TYR  QD      6 ASP- HN      7.10            #peak    67
  5 TYR  QE     72 GLY  HN      7.99            #peak    68
  5 TYR  QE     69 LYS+ HN      7.48            #peak    69
 16 PHE  QE     16 PHE  QD      6.72            #peak    70
 15 ASP- HN     16 PHE  QD      8.12            #peak    72
 16 PHE  QD     16 PHE  QE      6.93            #peak    73
 22 TYR  QE     22 TYR  QD      7.10            #peak    74
 22 TYR  QD     22 TYR  QE      7.28            #peak    75
 22 TYR  HN     22 TYR  QD      7.24            #peak    76
 51 PHE  QE     51 PHE  QD      7.69            #peak    77
 51 PHE  QD     51 PHE  QE      7.94            #peak    78
 51 PHE  HN     51 PHE  QD      7.94            #peak    79
 51 PHE  QD     56 GLN  HN      8.12            #peak    80
 77 TYR  QE     77 TYR  QD      7.32            #peak    81
 77 TYR  QD     77 TYR  QE      7.36            #peak    82
 77 TYR  HN     77 TYR  QE      7.88            #peak    83
 53 GLY  HN     77 TYR  QE      7.27            #peak    84
 77 TYR  HN     77 TYR  QD      6.59            #peak    85
 77 TYR  QD     78 ARG+ HN      7.49            #peak    86
 80 HIS  HE1    80 HIS  HD2     4.27            #peak    88
  5 TYR  QE     24 ALA  HA      6.40            #peak    96
  5 TYR  QE     74 ARG+ HA      6.62            #peak    97
  5 TYR  HB2     5 TYR  QE      7.81            #peak    98
  5 TYR  QE     75 ASP- HB3     7.38            #peak    99
  5 TYR  QE     68 LEU  HB2     6.58            #peak   100
  3 GLU- HG3     5 TYR  QE      6.94            #peak   101
  5 TYR  QE     73 VAL  HB      6.69            #peak   102
  5 TYR  QE     68 LEU  HB3     7.05            #peak   103
 16 PHE  HA     16 PHE  QD      6.79            #peak   106
 16 PHE  QD     17 PRO  HA      8.12            #peak   107
 16 PHE  QD     17 PRO  HD3     7.58            #peak   110
 16 PHE  QD     17 PRO  HD2     7.29            #peak   111
 16 PHE  HB2    16 PHE  QD      6.00            #peak   112
 16 PHE  HB3    16 PHE  QD      5.93            #peak   113
 16 PHE  QD     18 MET  QG      9.00            #peak   114
 15 ASP- QB     16 PHE  QD      9.00            #peak   115
 16 PHE  QD     18 MET  QB      9.00            #peak   116
 16 PHE  QE     18 MET  QG      9.00            #peak   120
 22 TYR  HA     22 TYR  QD      5.58            #peak   121
 22 TYR  QD     23 PRO  HD2     6.41            #peak   122
 22 TYR  QD     23 PRO  HD3     6.59            #peak   123
 22 TYR  HB2    22 TYR  QD      5.87            #peak   124
 22 TYR  HA     22 TYR  QE      7.92            #peak   125
 20 LYS+ HA     22 TYR  QE      8.13            #peak   127
 22 TYR  QE     34 LYS+ HA      8.13            #peak   128
 22 TYR  HB2    22 TYR  QE      8.13            #peak   129
 22 TYR  HB3    22 TYR  QD      5.66            #peak   130
  7 LEU  HB2    22 TYR  QD      6.41            #peak   133
 20 LYS+ HB2    22 TYR  QD      6.63            #peak   134
 20 LYS+ HB3    22 TYR  QD      7.67            #peak   135
 22 TYR  HB3    22 TYR  QE      7.77            #peak   138
 22 TYR  QE     34 LYS+ HB3     6.98            #peak   139
 20 LYS+ HD2    22 TYR  QE      6.98            #peak   140
 22 TYR  QE     34 LYS+ HD3     6.55            #peak   141
 20 LYS+ HB2    22 TYR  QE      6.15            #peak   142
 20 LYS+ HB3    22 TYR  QE      6.66            #peak   143
 51 PHE  HA     51 PHE  QE      7.87            #peak   149
 51 PHE  HA     51 PHE  QD      7.37            #peak   150
 51 PHE  QD     56 GLN  HA      7.73            #peak   151
 51 PHE  QE     80 HIS  HB2     6.68            #peak   152
 51 PHE  HB2    51 PHE  QE      7.40            #peak   153
 51 PHE  HB3    51 PHE  QE      7.40            #peak   154
 51 PHE  QE     80 HIS  HB3     7.01            #peak   155
 49 GLN  HB2    51 PHE  QE      7.69            #peak   156
 51 PHE  QE     57 LEU  HB2     7.33            #peak   157
 51 PHE  QE     57 LEU  HB3     7.47            #peak   158
 51 PHE  QD     57 LEU  HA      7.62            #peak   160
 51 PHE  QD     80 HIS  HB2     7.40            #peak   161
 51 PHE  QE     57 LEU  HA      7.44            #peak   162
 51 PHE  HB2    51 PHE  QD      6.90            #peak   163
 51 PHE  HB3    51 PHE  QD      6.50            #peak   164
 51 PHE  QD     80 HIS  HB3     6.93            #peak   165
 49 GLN  HB2    51 PHE  QD      8.12            #peak   166
 51 PHE  QD     57 LEU  HB3     7.58            #peak   168
 51 PHE  QD     58 LYS+ HB3     8.12            #peak   169
 77 TYR  HA     77 TYR  QD      5.84            #peak   171
 77 TYR  HA     77 TYR  QE      7.66            #peak   173
 77 TYR  QB     77 TYR  QD      7.18            #peak   174
 73 VAL  HA     77 TYR  QD      6.23            #peak   175
 52 ASP- HA     77 TYR  QD      6.70            #peak   176
 50 LEU  HG     77 TYR  QD      5.44            #peak   178
 74 ARG+ HB3    77 TYR  QD      7.35            #peak   179
 53 GLY  HA1    77 TYR  QE      8.13            #peak   182
 53 GLY  HA2    77 TYR  QE      8.13            #peak   183
 77 TYR  QB     77 TYR  QE      8.76            #peak   184
 73 VAL  HA     77 TYR  QE      7.20            #peak   185
 52 ASP- HA     77 TYR  QE      6.51            #peak   186
 52 ASP- HB2    77 TYR  QE      6.94            #peak   187
 58 LYS+ QD     77 TYR  QE      8.61            #peak   189
 74 ARG+ HB2    77 TYR  QE      6.08            #peak   190
 74 ARG+ HB3    77 TYR  QE      6.69            #peak   193
 52 ASP- HB2    77 TYR  QD      7.96            #peak   195
 80 HIS  HB2    80 HIS  HD2     3.48            #peak   196
 12 ASN  HB3    80 HIS  HE1     5.03            #peak   197
 80 HIS  HB3    80 HIS  HD2     3.88            #peak   198
 49 GLN  HB2    80 HIS  HD2     4.24            #peak   199
 49 GLN  HB3    80 HIS  HD2     4.70            #peak   200
 49 GLN  HA     80 HIS  HD2     4.96            #peak   202
 80 HIS  HA     80 HIS  HD2     4.67            #peak   203
 12 ASN  HB2    80 HIS  HE1     5.10            #peak   204
 12 ASN  HA     80 HIS  HE1     3.44            #peak   208
 11 THR  HA     80 HIS  HE1     3.70            #peak   209
 80 HIS  HA     80 HIS  HE1     5.17            #peak   210
 80 HIS  HD2    80 HIS  HE1     3.80            #peak   211
 22 TYR  QE     34 LYS+ HD2     7.12            #peak   239
 52 ASP- HB3    77 TYR  QE      7.27            #peak   240
 52 ASP- HB3    77 TYR  QD      7.85            #peak   241
  5 TYR  QD     68 LEU  QD1     7.12            #peak    58
  5 TYR  QD     73 VAL  QG2     7.08            #peak    59
  5 TYR  QE     68 LEU  QD1     7.61            #peak   104
 14 THR  QG2    16 PHE  QD      9.15            #peak   118
  7 LEU  QD1    22 TYR  QD      6.58            #peak   136
 22 TYR  QD     31 LEU  QD2     7.40            #peak   137
  7 LEU  QD1    22 TYR  QE      6.71            #peak   144
 22 TYR  QE     35 LEU  QD2     7.76            #peak   145
 22 TYR  QE     31 LEU  QD2     7.36            #peak   146
 51 PHE  QE     57 LEU  QD2     8.43            #peak   147
 51 PHE  QD     57 LEU  QD2     8.86            #peak   148
 51 PHE  QE     57 LEU  QD1     8.65            #peak   159
 51 PHE  QD     57 LEU  QD1     9.15            #peak   167
 50 LEU  QD1    77 TYR  QD      6.68            #peak   181
 50 LEU  QD1    77 TYR  QE      7.11            #peak   191
 80 HIS  HD2    82 VAL  QG1     3.75            #peak   201
 80 HIS  HE1    82 VAL  QG1     5.19            #peak   205
 10 THR  QG2    80 HIS  HE1     5.70            #peak   206
 14 THR  QG2    16 PHE  QE      9.15            #peak   238