NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
644449 6qk6 34356 cing 1-original 3 DYANA/DIANA distance NOE simple


# Restraints file 4: final_consensus.upl
 16 SER  H      16 SER  HB2     3.63  #peak 2
 16 SER  H      16 SER  HB3     0.00
 16 SER  H      16 SER  QB      0.00
 14 CYSS HB3    16 SER  H       4.90  #peak 3
 16 SER  H      20 GLN  HG3     5.30  #peak 4
 15 ARG  HB2    16 SER  H       4.18  #peak 5
 16 SER  H      20 GLN  HB2     5.24  #peak 6
 15 ARG  HG3    16 SER  H       5.50  #peak 7
 15 ARG  HB3    16 SER  H       0.00
 15 ARG  QG     16 SER  H       0.00
 15 ARG  QB     16 SER  H       0.00
 13 ALA  QB     16 SER  H       5.00  #peak 8
 14 CYSS HA     16 SER  H       4.22  #peak 9
 13 ALA  H      16 SER  H       5.50  #peak 12
 15 ARG  H      16 SER  H       3.17  #peak 13
 18 PRO  HD3    19 CYSS H       5.50  #peak 15
 18 PRO  HD2    19 CYSS H       0.00
 19 CYSS H      19 CYSS HB2     2.90  #peak 16
 19 CYSS H      19 CYSS HB3     3.02  #peak 17
 18 PRO  HB2    19 CYSS H       3.20  #peak 19
 19 CYSS H      35 ALA  QB      3.85  #peak 20
 48 CYSS H      49 GLY  HA3     5.15  #peak 24
 48 CYSS H      49 GLY  QA      0.00
 48 CYSS H      49 GLY  HA2     0.00
 48 CYSS H      48 CYSS HB2     4.00  #peak 25
 48 CYSS H      66 CYSS HB3     5.27  #peak 26
 46 CYSS HB3    48 CYSS H       5.29  #peak 27
 46 CYSS QB     48 CYSS H       0.00
 46 CYSS HB2    48 CYSS H       0.00
 48 CYSS H      48 CYSS HB3     3.62  #peak 28
 47 LYS  HB2    48 CYSS H       4.22  #peak 29
 47 LYS  H      48 CYSS H       3.01  #peak 34
 24 LYS  HA     25 CYSS H       3.18  #peak 36
 21 CYSS HA     25 CYSS H       4.83  #peak 39
 25 CYSS H      25 CYSS HB2     3.21  #peak 40
 25 CYSS H      25 CYSS HB3     0.00
 25 CYSS H      25 CYSS QB      0.00
 24 LYS  HB3    25 CYSS H       4.89  #peak 42
 24 LYS  HB2    25 CYSS H       0.00
 24 LYS  QB     25 CYSS H       0.00
 24 LYS  HB2    25 CYSS H       4.89  #peak 43
 24 LYS  HB3    25 CYSS H       0.00
 24 LYS  HG2    25 CYSS H       5.50  #peak 44
 24 LYS  HG3    25 CYSS H       0.00
 24 LYS  QG     25 CYSS H       0.00
 25 CYSS H      26 GLN  H       4.63  #peak 45
 53 THR  HB     54 GLY  H       5.33  #peak 48
 54 GLY  H      58 CYSS HA      0.00
 53 THR  HA     54 GLY  H       3.29  #peak 49
 39 CYSS HB3    54 GLY  H       4.47  #peak 52
 39 CYSS HB2    54 GLY  H       0.00
 53 THR  QG2    54 GLY  H       4.56  #peak 53
 53 THR  H      54 GLY  H       3.58  #peak 55
 42 THR  H      54 GLY  H       5.37  #peak 58
 25 CYSS HB2    26 GLN  H       5.50  #peak 60
 25 CYSS HB3    26 GLN  H       0.00
 26 GLN  H      27 CYSS HB2     0.00
 25 CYSS QB     26 GLN  H       0.00
 21 CYSS HB3    26 GLN  H       5.50  #peak 61
 14 CYSS HB2    26 GLN  H       0.00
 26 GLN  H      26 GLN  HB3     4.33  #peak 62
 26 GLN  H      26 GLN  HG3     0.00
 26 GLN  H      26 GLN  HB2     3.41  #peak 63
 42 THR  HB     44 ASP  H       3.68  #peak 66
 44 ASP  H      53 THR  HB      5.50  #peak 67
 44 ASP  H      45 GLY  HA2     0.00
 44 ASP  H      45 GLY  QA      0.00
 44 ASP  H      44 ASP  HB3     3.65  #peak 69
 44 ASP  H      44 ASP  HB2     3.65  #peak 70
 44 ASP  H      44 ASP  QB      0.00
 42 THR  QG2    44 ASP  H       4.50  #peak 71
 42 THR  H      44 ASP  H       5.08  #peak 72
 43 SER  H      44 ASP  H       4.15  #peak 73
 39 CYSS HA     40 ASN  HD21    4.42  #peak 74
 40 ASN  HD21   66 CYSS HA      5.03  #peak 80
 40 ASN  HD22   66 CYSS HA      0.00
 60 CYSS HB3    61 GLY  H       3.43  #peak 85
 61 GLY  H      64 CYSS HB3     5.50  #peak 86
 60 CYSS HB2    61 GLY  H       3.97  #peak 87
 29 GLU  HB3    61 GLY  H       5.50  #peak 89
 29 GLU  HB2    61 GLY  H       0.00
 60 CYSS H      61 GLY  H       4.89  #peak 91
 38 THR  HA     39 CYSS H       2.54  #peak 96
 39 CYSS H      55 PRO  HD3     3.60  #peak 98
 21 CYSS HA     24 LYS  H       4.85  #peak 99
 22 GLY  HA3    24 LYS  H       0.00
 39 CYSS H      39 CYSS HB2     3.49  #peak 100
 39 CYSS H      39 CYSS HB3     0.00
 21 CYSS HB2    24 LYS  H       5.50  #peak 102
 39 CYSS H      39 CYSS HB3     3.70  #peak 103
 39 CYSS H      55 PRO  HB3     0.00
 39 CYSS H      39 CYSS HB2     0.00
 24 LYS  H      24 LYS  HB2     3.48  #peak 104
 24 LYS  H      24 LYS  HB3     0.00
 38 THR  QG2    39 CYSS H       4.33  #peak 106
 22 GLY  H      24 LYS  H       4.92  #peak 109
 57 SER  H      57 SER  HB2     4.10  #peak 113
 57 SER  H      57 SER  HB3     0.00
 55 PRO  HA     57 SER  H       4.41  #peak 114
 57 SER  H      57 SER  HB3     4.10  #peak 115
 57 SER  H      57 SER  HB2     0.00
 57 SER  H      57 SER  QB      0.00
 57 SER  H      58 CYSS HB2     4.31  #peak 116
 57 SER  H      58 CYSS QB      0.00
 56 ASP  HB2    57 SER  H       4.63  #peak 117
 56 ASP  HB3    57 SER  H       0.00
 56 ASP  QB     57 SER  H       0.00
 57 SER  H      58 CYSS H       3.10  #peak 118
 56 ASP  H      57 SER  H       4.01  #peak 120
 45 GLY  HA3    46 CYSS H       3.16  #peak 123
 45 GLY  HA2    46 CYSS H       0.00
 46 CYSS H      51 GLU  HA      5.50  #peak 124
 46 CYSS H      53 THR  HA      0.00
 45 GLY  HA2    46 CYSS H       3.33  #peak 125
 45 GLY  HA3    46 CYSS H       0.00
 45 GLY  QA     46 CYSS H       0.00
 41 CYSS HB3    46 CYSS H       4.97  #peak 126
 46 CYSS H      46 CYSS HB2     3.40  #peak 127
 46 CYSS H      46 CYSS HB3     0.00
 46 CYSS H      46 CYSS QB      0.00
 46 CYSS H      53 THR  QG2     3.43  #peak 128
 46 CYSS H      47 LYS  H       4.88  #peak 130
 10 CYSS HA     27 CYSS H       5.15  #peak 131
 27 CYSS H      27 CYSS HB2     2.93  #peak 134
 26 GLN  HB3    27 CYSS H       4.52  #peak 136
 26 GLN  HB2    27 CYSS H       4.28  #peak 137
 11 THR  QG2    27 CYSS H       3.79  #peak 138
 27 CYSS H      28 GLY  H       4.89  #peak 139
 11 THR  H      27 CYSS H       5.39  #peak 140
 14 CYSS H      14 CYSS HB3     2.94  #peak 144
 14 CYSS H      14 CYSS HB2     2.93  #peak 145
 14 CYSS H      15 ARG  HG3     4.42  #peak 146
 14 CYSS H      15 ARG  QG      0.00
 13 ALA  QB     14 CYSS H       3.28  #peak 147
 32 THR  HA     33 CYSS H       3.50  #peak 152
 31 CYSS HA     33 CYSS H       4.73  #peak 154
 33 CYSS H      33 CYSS HB3     3.10  #peak 155
 33 CYSS H      33 CYSS HB2     0.00
 33 CYSS H      33 CYSS QB      0.00
 31 CYSS HB2    33 CYSS H       5.28  #peak 156
 31 CYSS HB3    33 CYSS H       0.00
 31 CYSS QB     33 CYSS H       0.00
 33 CYSS H      33 CYSS HB2     2.93  #peak 157
 33 CYSS H      33 CYSS HB3     0.00
 32 THR  QG2    33 CYSS H       4.47  #peak 160
 32 THR  H      33 CYSS H       3.58  #peak 161
 31 CYSS H      33 CYSS H       5.50  #peak 162
 33 CYSS H      36 CYSS H       0.00
 16 SER  HB3    20 GLN  HE21    5.27  #peak 165
 16 SER  HB2    20 GLN  HE21    0.00
 16 SER  QB     20 GLN  HE21    0.00
 16 SER  HB3    20 GLN  HE22    0.00
 16 SER  QB     20 GLN  QE2     0.00
 18 PRO  HD2    20 GLN  HE21    4.69  #peak 166
 18 PRO  HD2    20 GLN  HE22    0.00
 18 PRO  HD2    20 GLN  QE2     0.00
 33 CYSS HB3    35 ALA  H       5.00  #peak 173
 33 CYSS HB2    35 ALA  H       0.00
 33 CYSS QB     35 ALA  H       0.00
 19 CYSS HB2    35 ALA  H       5.50  #peak 174
 33 CYSS HB2    35 ALA  H       5.24  #peak 175
 33 CYSS HB3    35 ALA  H       0.00
 19 CYSS HB3    35 ALA  H       0.00
 35 ALA  H      35 ALA  QB      2.75  #peak 177
 35 ALA  H      36 CYSS H       2.92  #peak 179
 35 ALA  H      36 CYSS HA      5.29  #peak 180
 20 GLN  HA     22 GLY  H       5.09  #peak 182
 22 GLY  H      22 GLY  HA3     2.86  #peak 184
 22 GLY  H      36 CYSS HB3     5.50  #peak 185
 22 GLY  H      25 CYSS HB2     0.00
 22 GLY  H      25 CYSS QB      0.00
 21 CYSS HB2    22 GLY  H       3.95  #peak 186
 21 CYSS H      22 GLY  H       3.47  #peak 189
 10 CYSS HA     11 THR  H       2.85  #peak 190
 11 THR  H      12 SER  HA      5.38  #peak 192
 10 CYSS HB3    11 THR  H       3.53  #peak 193
 11 THR  H      14 CYSS HB3     0.00
 11 THR  H      14 CYSS HB2     3.72  #peak 194
 11 THR  H      15 ARG  HG3     4.93  #peak 195
 11 THR  H      15 ARG  QG      0.00
 11 THR  H      15 ARG  HG2     5.50  #peak 196
 11 THR  H      11 THR  QG2     3.10  #peak 197
 11 THR  H      26 GLN  H       5.50  #peak 200
 11 THR  H      27 CYSS H       0.00
 11 THR  H      28 GLY  H       5.50  #peak 201
 11 THR  H      13 ALA  H       4.96  #peak 202
 11 THR  H      15 ARG  H       4.85  #peak 203
 11 THR  HA     13 ALA  H       4.77  #peak 204
 13 ALA  H      13 ALA  QB      3.05  #peak 207
 13 ALA  H      14 CYSS H       3.72  #peak 208
 53 THR  H      53 THR  HB      4.12  #peak 213
 52 CYSS HB3    53 THR  H       4.67  #peak 215
 52 CYSS HB2    53 THR  H       3.91  #peak 216
 53 THR  H      53 THR  QG2     3.56  #peak 217
 65 SER  HA     67 LYS  H       4.14  #peak 219
 66 CYSS HB3    67 LYS  H       5.26  #peak 221
 64 CYSS HB2    67 LYS  H       0.00
 64 CYSS HB3    67 LYS  H       4.04  #peak 222
 67 LYS  H      67 LYS  HE2     5.50  #peak 223
 67 LYS  H      67 LYS  HE3     0.00
 67 LYS  H      67 LYS  QE      0.00
 67 LYS  H      67 LYS  HB2     2.93  #peak 225
 67 LYS  H      67 LYS  HG2     3.04  #peak 226
 40 ASN  HD21   67 LYS  H       5.50  #peak 230
 40 ASN  HD22   67 LYS  H       0.00
 41 CYSS H      54 GLY  HA2     4.70  #peak 231
 41 CYSS H      41 CYSS HB2     2.87  #peak 235
 39 CYSS HB3    41 CYSS H       4.74  #peak 236
 39 CYSS HB2    41 CYSS H       0.00
 41 CYSS H      42 THR  QG2     4.89  #peak 237
 41 CYSS H      42 THR  H       4.65  #peak 238
 41 CYSS H      54 GLY  H       4.77  #peak 239
 41 CYSS H      66 CYSS HA      4.68  #peak 240
 40 ASN  H      41 CYSS H       3.09  #peak 241
 27 CYSS HA     28 GLY  H       2.77  #peak 245
 28 GLY  H      31 CYSS HA      5.50  #peak 247
 28 GLY  H      61 GLY  QA      0.00
 28 GLY  H      61 GLY  HA2     0.00
 27 CYSS HB3    28 GLY  H       3.36  #peak 249
 28 GLY  H      31 CYSS HB2     4.69  #peak 250
 28 GLY  H      31 CYSS QB      0.00
  9 LYS  HB3    28 GLY  H       3.38  #peak 251
  9 LYS  HB2    28 GLY  H       4.64  #peak 252
  9 LYS  HD3    28 GLY  H       0.00
  9 LYS  HG3    28 GLY  H       5.48  #peak 253
  9 LYS  QG     28 GLY  H       0.00
 10 CYSS H      28 GLY  H       4.58  #peak 255
 16 SER  HB2    20 GLN  H       4.19  #peak 260
 16 SER  HB3    20 GLN  H       0.00
 16 SER  QB     20 GLN  H       0.00
 20 GLN  H      21 CYSS HA      4.79  #peak 261
 20 GLN  H      21 CYSS HB2     4.81  #peak 263
 20 GLN  H      20 GLN  HG2     3.52  #peak 264
 20 GLN  H      20 GLN  HB2     3.12  #peak 265
 13 ALA  QB     20 GLN  H       3.94  #peak 266
 16 SER  H      20 GLN  H       4.96  #peak 267
 14 CYSS H      20 GLN  H       0.00
 14 CYSS HA     20 GLN  H       3.80  #peak 268
 42 THR  HB     43 SER  H       3.04  #peak 275
 43 SER  H      43 SER  HB3     3.68  #peak 276
 43 SER  H      43 SER  QB      0.00
 42 THR  QG2    43 SER  H       3.95  #peak 277
 31 CYSS H      32 THR  HB      5.50  #peak 279
 29 GLU  HB2    31 CYSS H       5.50  #peak 284
 29 GLU  HB3    31 CYSS H       0.00
  9 LYS  HB2    31 CYSS H       5.50  #peak 285
 31 CYSS H      37 LYS  HD3     0.00
 31 CYSS H      37 LYS  QD      0.00
 31 CYSS H      37 LYS  HD2     0.00
 31 CYSS H      67 LYS  HB3     0.00
 30 GLY  H      31 CYSS H       4.14  #peak 286
 59 LYS  H      60 CYSS HA      4.82  #peak 289
 52 CYSS HB3    59 LYS  H       3.70  #peak 290
 59 LYS  H      59 LYS  HB2     3.85  #peak 293
 59 LYS  H      59 LYS  HB3     0.00
 59 LYS  H      59 LYS  HG2     5.14  #peak 295
 59 LYS  H      59 LYS  HG3     0.00
 59 LYS  H      59 LYS  QG      0.00
 20 GLN  HA     21 CYSS H       3.50  #peak 299
 58 CYSS HA     60 CYSS H       4.12  #peak 300
 21 CYSS H      22 GLY  HA2     5.40  #peak 302
 21 CYSS H      22 GLY  HA3     0.00
 21 CYSS H      22 GLY  QA      0.00
 60 CYSS H      60 CYSS HB3     4.25  #peak 304
 21 CYSS H      36 CYSS HB3     0.00
 21 CYSS H      21 CYSS HB2     2.91  #peak 305
 60 CYSS H      60 CYSS HB2     2.90  #peak 306
 59 LYS  HB2    60 CYSS H       4.99  #peak 308
 59 LYS  HB3    60 CYSS H       0.00
 59 LYS  QB     60 CYSS H       0.00
 20 GLN  HB2    21 CYSS H       4.99  #peak 309
 59 LYS  HB3    60 CYSS H       0.00
 59 LYS  HB2    60 CYSS H       0.00
 13 ALA  QB     21 CYSS H       3.94  #peak 311
 20 GLN  H      21 CYSS H       2.92  #peak 313
 21 CYSS H      24 LYS  H       5.50  #peak 314
 19 CYSS H      21 CYSS H       0.00
 14 CYSS H      21 CYSS H       5.50  #peak 315
 58 CYSS H      60 CYSS H       0.00
 59 LYS  H      60 CYSS H       2.87  #peak 317
 43 SER  HA     45 GLY  H       3.99  #peak 321
 44 ASP  HB3    45 GLY  H       4.25  #peak 323
 44 ASP  HB2    45 GLY  H       4.25  #peak 324
 44 ASP  QB     45 GLY  H       0.00
 42 THR  QG2    45 GLY  H       5.40  #peak 325
 45 GLY  H      53 THR  QG2     3.67  #peak 326
 42 THR  H      45 GLY  H       4.01  #peak 327
 50 LYS  H      51 GLU  HA      4.63  #peak 332
 50 LYS  H      50 LYS  HE2     5.50  #peak 335
 50 LYS  H      50 LYS  HE3     0.00
 50 LYS  H      50 LYS  QE      0.00
 46 CYSS HB3    50 LYS  H       5.50  #peak 336
 46 CYSS HB2    50 LYS  H       0.00
 46 CYSS QB     50 LYS  H       0.00
 48 CYSS HB3    50 LYS  H       5.22  #peak 337
 50 LYS  H      50 LYS  HG2     3.33  #peak 340
 48 CYSS HA     50 LYS  H       5.37  #peak 341
 15 ARG  H      16 SER  HA      5.45  #peak 345
 14 CYSS HB3    15 ARG  H       3.14  #peak 347
 15 ARG  H      15 ARG  HB2     3.63  #peak 349
 15 ARG  H      15 ARG  QB      0.00
 15 ARG  H      15 ARG  HG3     2.70  #peak 350
 15 ARG  H      15 ARG  QG      0.00
 13 ALA  QB     15 ARG  H       4.96  #peak 351
 29 GLU  HB2    30 GLY  H       5.20  #peak 359
 29 GLU  HB3    30 GLY  H       0.00
  7 GLY  HA2    10 CYSS H       5.50  #peak 362
 10 CYSS H      27 CYSS HA      0.00
  7 GLY  HA3    10 CYSS H       4.64  #peak 363
  8 GLU  HA     10 CYSS H       0.00
  7 GLY  QA     10 CYSS H       0.00
 10 CYSS H      10 CYSS HB2     2.88  #peak 364
  9 LYS  HB3    10 CYSS H       4.54  #peak 365
  9 LYS  HB2    10 CYSS H       3.91  #peak 366
  9 LYS  HG3    10 CYSS H       5.50  #peak 367
  9 LYS  HG2    10 CYSS H       5.25  #peak 368
  9 LYS  QG     10 CYSS H       0.00
  9 LYS  H      10 CYSS H       3.38  #peak 369
 36 CYSS H      37 LYS  HA      5.07  #peak 374
 36 CYSS H      36 CYSS HB3     3.55  #peak 377
 33 CYSS HB2    36 CYSS H       4.86  #peak 378
 33 CYSS HB3    36 CYSS H       0.00
 35 ALA  QB     36 CYSS H       3.11  #peak 380
 34 ALA  H      36 CYSS H       5.50  #peak 382
 33 CYSS H      36 CYSS H       0.00
 36 CYSS H      37 LYS  H       2.89  #peak 386
 34 ALA  HA     37 LYS  H       4.16  #peak 388
 33 CYSS HB3    37 LYS  H       4.86  #peak 390
 33 CYSS QB     37 LYS  H       0.00
 33 CYSS HB2    37 LYS  H       0.00
 36 CYSS HB3    37 LYS  H       4.80  #peak 391
 33 CYSS HB2    37 LYS  H       5.50  #peak 392
 33 CYSS HB3    37 LYS  H       0.00
 37 LYS  H      37 LYS  HB3     3.21  #peak 394
 37 LYS  H      37 LYS  QB      0.00
 37 LYS  H      37 LYS  HB2     0.00
 35 ALA  QB     37 LYS  H       4.92  #peak 395
 34 ALA  QB     37 LYS  H       0.00
 37 LYS  H      38 THR  QG2     5.38  #peak 396
 35 ALA  H      37 LYS  H       4.03  #peak 399
 16 SER  HA     17 GLU  H       2.75  #peak 402
 17 GLU  H      18 PRO  HD2     5.27  #peak 404
 17 GLU  H      17 GLU  HB3     3.56  #peak 405
 32 THR  H      32 THR  QG2     4.04  #peak 414
 28 GLY  HA2    29 GLU  H       3.50  #peak 416
 29 GLU  H      61 GLY  HA2     5.42  #peak 417
 29 GLU  H      61 GLY  QA      0.00
 29 GLU  H      61 GLY  HA3     0.00
 28 GLY  HA3    29 GLU  H       3.00  #peak 419
  9 LYS  HE2    29 GLU  H       5.50  #peak 420
  9 LYS  HE3    29 GLU  H       0.00
  9 LYS  QE     29 GLU  H       0.00
 29 GLU  H      29 GLU  HG2     3.52  #peak 421
 29 GLU  H      29 GLU  QG      0.00
 29 GLU  H      29 GLU  HB3     3.23  #peak 422
  9 LYS  HG3    29 GLU  H       4.82  #peak 424
  9 LYS  QG     29 GLU  H       0.00
 28 GLY  H      29 GLU  H       4.56  #peak 425
 37 LYS  HA     38 THR  H       2.53  #peak 426
 38 THR  H      38 THR  HB      3.68  #peak 427
 37 LYS  HE2    38 THR  H       5.50  #peak 428
 37 LYS  HE3    38 THR  H       0.00
 37 LYS  QE     38 THR  H       0.00
 38 THR  H      55 PRO  HB3     4.87  #peak 429
 38 THR  H      55 PRO  HB2     0.00
 37 LYS  HD3    38 THR  H       4.87  #peak 430
 37 LYS  QD     38 THR  H       0.00
 37 LYS  HB3    38 THR  H       0.00
 37 LYS  HD2    38 THR  H       0.00
 37 LYS  H      38 THR  H       4.73  #peak 433
 39 CYSS HA     40 ASN  H       2.57  #peak 434
 40 ASN  H      55 PRO  HD3     5.50  #peak 435
 39 CYSS HB2    40 ASN  H       5.17  #peak 436
 40 ASN  H      66 CYSS HB3     0.00
 39 CYSS HB3    40 ASN  H       0.00
 40 ASN  H      40 ASN  HB2     2.84  #peak 437
 39 CYSS HB3    40 ASN  H       4.55  #peak 438
 39 CYSS HB2    40 ASN  H       0.00
 40 ASN  H      67 LYS  HD3     5.23  #peak 439
 39 CYSS H      40 ASN  H       4.55  #peak 442
 40 ASN  H      40 ASN  HD21    3.87  #peak 443
 40 ASN  H      40 ASN  HD22    0.00
 40 ASN  H      40 ASN  HD22    4.35  #peak 444
 40 ASN  H      40 ASN  HD21    0.00
 54 GLY  HA2    56 ASP  H       4.19  #peak 446
 54 GLY  HA3    56 ASP  H       0.00
 54 GLY  HA3    56 ASP  H       4.68  #peak 448
 55 PRO  HD2    56 ASP  H       0.00
 56 ASP  H      56 ASP  HB2     3.81  #peak 449
 56 ASP  H      56 ASP  QB      0.00
 55 PRO  HB2    56 ASP  H       4.84  #peak 451
 39 CYSS HB3    56 ASP  H       0.00
 55 PRO  HB3    56 ASP  H       0.00
 56 ASP  H      58 CYSS H       5.11  #peak 453
 39 CYSS HA     40 ASN  HD22    4.96  #peak 454
 40 ASN  HD22   67 LYS  HA      0.00
 40 ASN  HD21   67 LYS  HA      0.00
 39 CYSS HA     40 ASN  HD21    0.00
 40 ASN  HB2    40 ASN  HD22    3.75  #peak 455
 38 THR  QG2    40 ASN  HD22    5.30  #peak 456
 38 THR  QG2    40 ASN  HD21    0.00
 18 PRO  HD2    20 GLN  HE22    5.21  #peak 461
 18 PRO  HD2    20 GLN  HE21    0.00
  7 GLY  HA2     9 LYS  H       4.94  #peak 468
  7 GLY  HA3     9 LYS  H       4.65  #peak 469
  7 GLY  QA      9 LYS  H       0.00
  9 LYS  H      10 CYSS HB2     4.96  #peak 470
  9 LYS  H       9 LYS  HB3     4.23  #peak 472
  8 GLU  QB      9 LYS  H       0.00
  8 GLU  HB3     9 LYS  H       0.00
  9 LYS  H       9 LYS  HB2     3.43  #peak 473
  9 LYS  H       9 LYS  HG3     4.36  #peak 474
  9 LYS  H       9 LYS  QG      0.00
 33 CYSS HB3    34 ALA  H       4.84  #peak 479
 33 CYSS HB2    34 ALA  H       0.00
 33 CYSS HB2    34 ALA  H       4.84  #peak 480
 33 CYSS HB3    34 ALA  H       0.00
 33 CYSS QB     34 ALA  H       0.00
 34 ALA  H      34 ALA  QB      2.92  #peak 481
 66 CYSS H      66 CYSS HB2     4.38  #peak 483
 64 CYSS HA     66 CYSS H       0.00
 65 SER  HB2    66 CYSS H       4.65  #peak 484
 65 SER  QB     66 CYSS H       0.00
 48 CYSS HB2    66 CYSS H       4.43  #peak 485
 66 CYSS H      66 CYSS HB3     3.16  #peak 486
 64 CYSS HB3    66 CYSS H       3.29  #peak 487
 48 CYSS HB3    66 CYSS H       5.24  #peak 488
 66 CYSS H      67 LYS  HE3     0.00
 66 CYSS H      67 LYS  HB2     5.07  #peak 489
 66 CYSS H      67 LYS  HG3     5.50  #peak 490
 66 CYSS H      67 LYS  HG2     4.07  #peak 491
 66 CYSS H      67 LYS  H       3.04  #peak 492
 48 CYSS HA     66 CYSS H       5.38  #peak 494
 61 GLY  HA2    62 SER  H       3.24  #peak 499
 61 GLY  QA     62 SER  H       0.00
 61 GLY  HA3    62 SER  H       0.00
 62 SER  H      62 SER  HB3     4.07  #peak 500
 62 SER  H      62 SER  QB      0.00
 62 SER  H      62 SER  HA      0.00
 62 SER  H      62 SER  HB2     0.00
 61 GLY  H      62 SER  H       4.87  #peak 502
 57 SER  HB2    58 CYSS H       4.73  #peak 505
 57 SER  HB3    58 CYSS H       0.00
 57 SER  QB     58 CYSS H       0.00
 55 PRO  HA     58 CYSS H       3.68  #peak 506
 57 SER  HB3    58 CYSS H       5.18  #peak 507
 57 SER  HB2    58 CYSS H       0.00
 52 CYSS HB3    58 CYSS H       0.00
 58 CYSS H      58 CYSS HB2     3.19  #peak 508
 58 CYSS H      58 CYSS QB      0.00
 56 ASP  HB2    58 CYSS H       5.50  #peak 509
 56 ASP  QB     58 CYSS H       0.00
 56 ASP  HB3    58 CYSS H       0.00
 55 PRO  HB2    58 CYSS H       5.50  #peak 510
 39 CYSS HB3    58 CYSS H       0.00
 55 PRO  HB3    58 CYSS H       0.00
 39 CYSS HB2    58 CYSS H       0.00
 58 CYSS H      59 LYS  HG2     5.50  #peak 512
 58 CYSS H      59 LYS  HG3     0.00
 37 LYS  HG2    58 CYSS H       0.00
 58 CYSS H      59 LYS  QG      0.00
 37 LYS  QG     58 CYSS H       0.00
 58 CYSS H      59 LYS  H       4.69  #peak 513
 47 LYS  HA     49 GLY  H       4.54  #peak 517
 46 CYSS HB3    49 GLY  H       4.99  #peak 521
 46 CYSS QB     49 GLY  H       0.00
 48 CYSS HB3    49 GLY  H       4.87  #peak 522
 47 LYS  HB2    49 GLY  H       4.91  #peak 523
 49 GLY  H      50 LYS  HB2     0.00
 49 GLY  H      50 LYS  HG2     5.50  #peak 525
 49 GLY  H      50 LYS  HG3     0.00
 49 GLY  H      50 LYS  H       3.12  #peak 526
 47 LYS  H      49 GLY  H       4.35  #peak 527
 48 CYSS H      49 GLY  H       2.81  #peak 528
 49 GLY  H      51 GLU  H       5.27  #peak 529
 52 CYSS H      58 CYSS HA      5.40  #peak 531
 51 GLU  HA     52 CYSS H       3.19  #peak 532
 52 CYSS H      52 CYSS HB3     3.70  #peak 533
 52 CYSS H      52 CYSS HB2     3.72  #peak 534
 51 GLU  HB2    52 CYSS H       5.13  #peak 536
 51 GLU  QB     52 CYSS H       0.00
 51 GLU  HB3    52 CYSS H       0.00
 51 GLU  HB3    52 CYSS H       5.50  #peak 537
 51 GLU  QG     52 CYSS H       0.00
 51 GLU  HG2    52 CYSS H       0.00
 51 GLU  HG3    52 CYSS H       0.00
 51 GLU  HB2    52 CYSS H       0.00
 50 LYS  HB3    52 CYSS H       4.68  #peak 538
 50 LYS  HB2    52 CYSS H       0.00
 50 LYS  HG3    52 CYSS H       5.50  #peak 539
 50 LYS  HG2    52 CYSS H       0.00
 52 CYSS H      53 THR  QG2     5.17  #peak 540
 51 GLU  H      52 CYSS H       3.49  #peak 541
 62 SER  HA     64 CYSS H       4.10  #peak 545
 63 SER  HB3    64 CYSS H       4.93  #peak 546
 63 SER  QB     64 CYSS H       0.00
 64 CYSS H      64 CYSS HB2     2.81  #peak 548
 64 CYSS H      64 CYSS HB3     3.16  #peak 549
 64 CYSS H      67 LYS  HE3     4.80  #peak 551
 64 CYSS H      67 LYS  QE      0.00
 64 CYSS H      67 LYS  HB2     4.29  #peak 552
 64 CYSS H      67 LYS  HG3     3.56  #peak 553
 64 CYSS H      67 LYS  HG2     3.78  #peak 554
 64 CYSS H      67 LYS  H       4.80  #peak 555
 64 CYSS H      65 SER  H       4.77  #peak 556
 63 SER  H      64 CYSS H       3.88  #peak 557
 50 LYS  HA     51 GLU  H       3.53  #peak 559
 49 GLY  HA2    51 GLU  H       4.92  #peak 560
 49 GLY  HA3    51 GLU  H       0.00
 51 GLU  H      51 GLU  HA      2.91  #peak 561
 49 GLY  HA3    51 GLU  H       5.00  #peak 562
 49 GLY  QA     51 GLU  H       0.00
 49 GLY  HA2    51 GLU  H       0.00
 46 CYSS HB3    51 GLU  H       4.65  #peak 563
 46 CYSS HB2    51 GLU  H       0.00
 51 GLU  H      51 GLU  HB2     3.77  #peak 564
 51 GLU  H      51 GLU  QB      0.00
 51 GLU  H      51 GLU  HB3     0.00
 51 GLU  H      51 GLU  HG2     4.32  #peak 565
 51 GLU  H      51 GLU  HG3     0.00
 51 GLU  H      51 GLU  QG      0.00
 50 LYS  HG2    51 GLU  H       4.90  #peak 568
 50 LYS  H      51 GLU  H       3.57  #peak 571
 48 CYSS H      51 GLU  H       5.50  #peak 572
 42 THR  H      46 CYSS HA      4.68  #peak 574
 42 THR  H      42 THR  HB      0.00
 41 CYSS HA     42 THR  H       2.76  #peak 575
 42 THR  H      53 THR  HA      4.08  #peak 576
 41 CYSS HB3    42 THR  H       3.13  #peak 577
 41 CYSS HB2    42 THR  H       4.00  #peak 578
 42 THR  H      42 THR  QG2     3.31  #peak 580
 42 THR  H      53 THR  QG2     4.91  #peak 581
 42 THR  H      47 LYS  H       5.50  #peak 583
 41 CYSS HB2    47 LYS  H       4.74  #peak 591
 46 CYSS HB3    47 LYS  H       4.33  #peak 592
 46 CYSS HB2    47 LYS  H       0.00
 46 CYSS QB     47 LYS  H       0.00
 47 LYS  H      47 LYS  HB2     3.19  #peak 593
 47 LYS  H      47 LYS  HG2     3.95  #peak 594
 47 LYS  H      47 LYS  QG      0.00
  7 GLY  H      10 CYSS HB2     4.85  #peak 603
  6 LYS  HB3     7 GLY  H       4.64  #peak 604
  6 LYS  QB      7 GLY  H       0.00
 64 CYSS HA     65 SER  H       2.73  #peak 606
 65 SER  H      65 SER  HB2     3.94  #peak 607
 65 SER  H      65 SER  QB      0.00
 48 CYSS HB2    65 SER  H       4.24  #peak 608
 64 CYSS HB2    65 SER  H       4.14  #peak 609
 64 CYSS HB3    65 SER  H       3.99  #peak 610
 48 CYSS HB3    65 SER  H       5.50  #peak 611
 65 SER  H      66 CYSS H       3.17  #peak 612
 65 SER  H      67 LYS  H       4.66  #peak 613
 65 SER  H      66 CYSS HA      5.33  #peak 614
 11 THR  QG2    27 CYSS HB2     4.89  #peak 617
 10 CYSS HA     27 CYSS HB2     4.59  #peak 618
 25 CYSS HB2    36 CYSS HB2     4.05  #peak 621
 25 CYSS QB     36 CYSS HB2     0.00
 25 CYSS HB2    36 CYSS HA      5.50  #peak 623
 25 CYSS QB     36 CYSS HA      0.00
 15 ARG  HA     15 ARG  HG3     3.55  #peak 625
 15 ARG  HA     15 ARG  QG      0.00
 47 LYS  H      47 LYS  HD2     5.50  #peak 626
 47 LYS  H      47 LYS  HD3     0.00
 37 LYS  HD2    38 THR  H       5.21  #peak 627
 37 LYS  QD     38 THR  H       0.00
 32 THR  H      37 LYS  HD3     0.00
 37 LYS  HD3    38 THR  H       0.00
 32 THR  H      37 LYS  HD2     0.00
 29 GLU  H      61 GLY  HA3     5.42  #peak 641
 29 GLU  H      61 GLY  QA      0.00
 29 GLU  H      61 GLY  HA2     0.00
  4 LYS  HA      4 LYS  HD2     5.50  #peak 649
  4 LYS  HA      4 LYS  HD3     0.00
  4 LYS  HA      4 LYS  QD      0.00
 58 CYSS HA     59 LYS  HD2     0.00
 58 CYSS HA     59 LYS  QD      0.00
 56 ASP  HB3    57 SER  HA      5.50  #peak 652
 54 GLY  HA2    56 ASP  HB2     0.00
 56 ASP  HB2    57 SER  HA      0.00
 42 THR  HA     42 THR  HB      2.73  #peak 656
 42 THR  HA     53 THR  HB      5.14  #peak 657
 41 CYSS HA     42 THR  HA      0.00
 42 THR  HA     53 THR  HA      4.75  #peak 658
 42 THR  HA     54 GLY  HA3     4.69  #peak 659
 42 THR  HA     54 GLY  HA2     0.00
 42 THR  HA     42 THR  QG2     2.91  #peak 660
 42 THR  HA     53 THR  QG2     5.50  #peak 661
 42 THR  HA     43 SER  H       3.31  #peak 662
 42 THR  HA     44 ASP  H       5.18  #peak 663
 42 THR  HA     45 GLY  H       5.50  #peak 664
 42 THR  HA     54 GLY  H       5.50  #peak 666
 45 GLY  HA3    46 CYSS HB2     5.50  #peak 668
 44 ASP  QB     45 GLY  HA3     0.00
 45 GLY  HA2    46 CYSS HB2     0.00
 45 GLY  HA2    46 CYSS HB3     0.00
 45 GLY  HA2    46 CYSS QB      0.00
 45 GLY  QA     46 CYSS HB2     0.00
 45 GLY  HA3    53 THR  QG2     4.40  #peak 670
 45 GLY  HA2    53 THR  QG2     0.00
  8 GLU  HA      9 LYS  HB2     5.50  #peak 675
  8 GLU  HA      9 LYS  HA      5.09  #peak 676
 38 THR  HA     55 PRO  HG2     4.64  #peak 682
 38 THR  HA     55 PRO  HG3     0.00
 39 CYSS HB2    55 PRO  HG2     5.50  #peak 685
 39 CYSS HB2    55 PRO  HG3     0.00
 39 CYSS HB3    55 PRO  HG3     0.00
 39 CYSS HB3    55 PRO  HG2     0.00
 39 CYSS H      55 PRO  HG2     5.40  #peak 687
 39 CYSS H      55 PRO  HG3     0.00
 28 GLY  HA2    29 GLU  HG2     5.20  #peak 691
 28 GLY  HA2    29 GLU  QG      0.00
 28 GLY  HA3    29 GLU  HG2     5.50  #peak 693
 29 GLU  HG3    30 GLY  HA3     0.00
 29 GLU  HG3    30 GLY  QA      0.00
 28 GLY  HA3    29 GLU  QG      0.00
 29 GLU  HG3    30 GLY  HA2     0.00
 29 GLU  QG     30 GLY  HA3     0.00
 29 GLU  HG2    30 GLY  H       5.50  #peak 694
 29 GLU  HG3    30 GLY  H       0.00
 29 GLU  QG     30 GLY  H       0.00
 59 LYS  HG2    60 CYSS H       5.50  #peak 701
 59 LYS  HG3    60 CYSS H       0.00
 59 LYS  QG     60 CYSS H       0.00
 39 CYSS HB2    55 PRO  HG3     5.50  #peak 706
 39 CYSS HB2    55 PRO  HG2     0.00
 39 CYSS HB3    55 PRO  HG2     0.00
 39 CYSS HB3    55 PRO  HG3     0.00
 39 CYSS H      55 PRO  HG3     5.39  #peak 708
 39 CYSS H      55 PRO  HG2     0.00
 39 CYSS HA     67 LYS  HD3     4.54  #peak 713
 39 CYSS HA     67 LYS  HD2     5.50  #peak 714
 38 THR  QG2    39 CYSS HA      4.63  #peak 715
 39 CYSS HA     41 CYSS H       4.50  #peak 717
 60 CYSS HA     61 GLY  H       2.89  #peak 718
 10 CYSS HB3    15 ARG  HG3     4.33  #peak 721
 10 CYSS HB3    15 ARG  QG      0.00
 13 ALA  QB     20 GLN  HA      4.60  #peak 724
 13 ALA  QB     21 CYSS HA      3.25  #peak 726
 13 ALA  QB     14 CYSS HB3     5.18  #peak 727
 13 ALA  QB     14 CYSS HB2     5.05  #peak 728
 13 ALA  QB     21 CYSS HB3     0.00
 13 ALA  QB     20 GLN  HB3     3.60  #peak 729
 13 ALA  QB     20 GLN  HB2     3.08  #peak 730
 13 ALA  QB     14 CYSS HA      4.08  #peak 736
 42 THR  HB     43 SER  HB2     5.06  #peak 737
 42 THR  HB     43 SER  HB3     0.00
 42 THR  HB     43 SER  QB      0.00
 19 CYSS HA     20 GLN  HB2     4.96  #peak 746
 19 CYSS HA     35 ALA  QB      4.66  #peak 747
 19 CYSS HA     20 GLN  H       2.58  #peak 748
 16 SER  H      19 CYSS HA      4.72  #peak 750
 14 CYSS HA     19 CYSS HA      3.56  #peak 751
 28 GLY  HA2    29 GLU  HA      5.50  #peak 752
 28 GLY  HA2    62 SER  QB      0.00
 28 GLY  HA2    62 SER  HB2     0.00
 28 GLY  HA2    62 SER  HB3     0.00
 27 CYSS HB3    28 GLY  HA2     5.50  #peak 754
  9 LYS  HB3    28 GLY  HA2     4.02  #peak 756
  9 LYS  HD2    28 GLY  HA2     5.18  #peak 757
  9 LYS  HB2    28 GLY  HA2     0.00
  9 LYS  QD     28 GLY  HA2     0.00
  9 LYS  HD3    28 GLY  HA2     0.00
 39 CYSS HB2    67 LYS  HD3     5.50  #peak 762
 60 CYSS HB3    67 LYS  HD3     0.00
 60 CYSS HB3    64 CYSS H       5.50  #peak 767
 35 ALA  QB     36 CYSS HB2     4.93  #peak 769
 19 CYSS HB2    35 ALA  QB      2.96  #peak 770
 19 CYSS HB3    35 ALA  QB      2.93  #peak 771
 27 CYSS HA     28 GLY  HA3     4.78  #peak 777
  9 LYS  HB3    27 CYSS HA      4.61  #peak 780
 11 THR  QG2    27 CYSS HA      3.23  #peak 782
  9 LYS  HG2    28 GLY  HA3     5.09  #peak 804
  9 LYS  QG     28 GLY  HA3     0.00
  9 LYS  HG2     9 LYS  HE2     4.07  #peak 805
  9 LYS  HG2     9 LYS  HE3     0.00
  6 LYS  QG      6 LYS  QE      0.00
  9 LYS  HG2     9 LYS  QE      0.00
  8 GLU  HG2     9 LYS  HG2     5.50  #peak 806
  8 GLU  HG3     9 LYS  HG2     0.00
  8 GLU  QG      9 LYS  HG2     0.00
  9 LYS  HG2    29 GLU  HG2     0.00
  9 LYS  HG2    29 GLU  HG3     0.00
  9 LYS  HG2    29 GLU  QG      0.00
  9 LYS  H       9 LYS  HG2     4.44  #peak 807
 21 CYSS HB3    25 CYSS HA      2.92  #peak 814
 25 CYSS HA     26 GLN  HB3     5.50  #peak 815
 48 CYSS HB3    64 CYSS HA      0.00
 25 CYSS HA     26 GLN  HB2     4.39  #peak 816
 25 CYSS HA     26 GLN  H       2.74  #peak 817
 31 CYSS HA     31 CYSS HB2     2.82  #peak 819
 31 CYSS HA     31 CYSS QB      0.00
  9 LYS  HB2    31 CYSS HA      5.50  #peak 820
 31 CYSS HA     37 LYS  HD3     0.00
 31 CYSS HA     37 LYS  QD      0.00
 31 CYSS HA     37 LYS  HD2     0.00
 31 CYSS HA     67 LYS  HB3     0.00
 31 CYSS HA     32 THR  QG2     4.23  #peak 821
  7 GLY  HA2    31 CYSS HA      5.31  #peak 822
 30 GLY  HA3    31 CYSS HA      0.00
 30 GLY  QA     31 CYSS HA      0.00
 30 GLY  HA2    31 CYSS HA      0.00
 31 CYSS HA     32 THR  H       3.55  #peak 825
 39 CYSS HB3    52 CYSS HB2     5.50  #peak 829
 39 CYSS HB2    52 CYSS HB2     0.00
 52 CYSS HB2    53 THR  HA      5.27  #peak 833
 65 SER  QB     66 CYSS HB3     0.00
 52 CYSS HB2    59 LYS  H       4.92  #peak 835
 40 ASN  H      66 CYSS HB3     0.00
 50 LYS  HG2    50 LYS  HE2     4.23  #peak 842
 50 LYS  HG2    50 LYS  HE3     0.00
 50 LYS  HG2    50 LYS  QE      0.00
 37 LYS  HG3    37 LYS  QE      0.00
 50 LYS  HG3    50 LYS  HE2     0.00
 50 LYS  HG3    50 LYS  HE3     0.00
 37 LYS  HG2    37 LYS  QE      0.00
 37 LYS  HG3    37 LYS  HE3     0.00
 37 LYS  HG2    37 LYS  HE3     0.00
 37 LYS  H      37 LYS  HG2     4.88  #peak 849
 37 LYS  H      37 LYS  QG      0.00
 37 LYS  H      37 LYS  HG3     0.00
 13 ALA  HA     20 GLN  HB2     3.02  #peak 852
 13 ALA  HA     20 GLN  H       4.74  #peak 854
 13 ALA  HA     15 ARG  H       5.50  #peak 856
 13 ALA  HA     16 SER  H       4.43  #peak 857
 13 ALA  HA     14 CYSS HA      5.01  #peak 858
 63 SER  HA     64 CYSS HB2     5.50  #peak 861
 23 SER  HA     24 LYS  HB2     5.50  #peak 864
 63 SER  HA     67 LYS  HG3     0.00
 23 SER  HA     24 LYS  HB3     0.00
 52 CYSS HB3    58 CYSS HB2     4.75  #peak 871
 52 CYSS HB3    58 CYSS QB      0.00
 58 CYSS HB2    59 LYS  H       5.00  #peak 872
 58 CYSS HB3    59 LYS  H       0.00
 52 CYSS H      58 CYSS HB2     5.50  #peak 873
 39 CYSS H      58 CYSS HB2     0.00
  6 LYS  H      10 CYSS HB2     0.00
 39 CYSS H      58 CYSS QB      0.00
 37 LYS  H      37 LYS  HG3     4.99  #peak 878
 37 LYS  H      37 LYS  HG2     0.00
 18 PRO  HA     19 CYSS HB2     4.73  #peak 881
 18 PRO  HA     19 CYSS HB3     5.50  #peak 882
 17 GLU  HB2    18 PRO  HA      3.52  #peak 885
 18 PRO  HA     19 CYSS H       2.81  #peak 887
 52 CYSS HB3    54 GLY  H       5.50  #peak 894
 34 ALA  QB     35 ALA  H       3.73  #peak 898
 34 ALA  QB     37 LYS  H       5.50  #peak 899
 50 LYS  HA     50 LYS  HE2     5.40  #peak 903
 50 LYS  HA     50 LYS  QE      0.00
 50 LYS  HA     50 LYS  HE3     0.00
 39 CYSS HB2    54 GLY  HA2     5.09  #peak 906
 39 CYSS HB3    54 GLY  HA2     0.00
 39 CYSS HB2    54 GLY  HA3     0.00
 54 GLY  HA2    55 PRO  HG3     5.50  #peak 907
 54 GLY  HA2    55 PRO  HG2     0.00
 54 GLY  HA2    55 PRO  HB3     0.00
 54 GLY  HA3    55 PRO  HG2     0.00
 39 CYSS HB3    54 GLY  HA2     4.02  #peak 908
 39 CYSS HB2    54 GLY  HA2     0.00
 39 CYSS HB3    54 GLY  HA3     0.00
 21 CYSS HB2    25 CYSS HA      4.39  #peak 910
 21 CYSS HB2    36 CYSS HA      4.64  #peak 914
 11 THR  HA     26 GLN  HB3     5.50  #peak 915
 65 SER  HA     67 LYS  HB2     5.50  #peak 916
 11 THR  HA     26 GLN  HB2     5.50  #peak 917
 11 THR  HA     11 THR  QG2     2.80  #peak 919
 65 SER  HA     66 CYSS HA      4.73  #peak 924
 16 SER  HA     16 SER  HB3     2.78  #peak 926
 16 SER  HA     16 SER  QB      0.00
 16 SER  HA     20 GLN  HG3     5.44  #peak 927
 16 SER  HA     17 GLU  HG2     4.56  #peak 928
 16 SER  HA     17 GLU  HB3     4.69  #peak 929
 15 ARG  HB3    16 SER  HA      5.31  #peak 930
 12 SER  HB2    13 ALA  QB      5.50  #peak 933
 12 SER  HB3    13 ALA  QB      0.00
 12 SER  QB     13 ALA  QB      0.00
 11 THR  QG2    12 SER  QB      0.00
 37 LYS  HA     37 LYS  HE2     5.50  #peak 936
 37 LYS  HA     37 LYS  HE3     0.00
 37 LYS  HA     37 LYS  QE      0.00
 37 LYS  HA     37 LYS  HG3     4.01  #peak 939
 37 LYS  HA     37 LYS  HG2     0.00
 37 LYS  HA     37 LYS  HG2     4.01  #peak 940
 37 LYS  HA     37 LYS  QG      0.00
 37 LYS  HA     37 LYS  HG3     0.00
 37 LYS  HA     38 THR  QG2     5.40  #peak 941
 36 CYSS HA     37 LYS  HA      5.15  #peak 944
 20 GLN  HB2    20 GLN  HG3     2.96  #peak 945
 13 ALA  QB     20 GLN  HG3     4.95  #peak 946
 20 GLN  HA     20 GLN  HG3     4.03  #peak 947
 20 GLN  H      20 GLN  HG3     4.54  #peak 950
 62 SER  HB2    67 LYS  HG3     5.50  #peak 955
 62 SER  HB3    67 LYS  HG3     0.00
 62 SER  QB     67 LYS  HG3     0.00
 62 SER  H      62 SER  HB2     4.19  #peak 957
 62 SER  H      62 SER  HB3     0.00
 62 SER  H      62 SER  QB      0.00
 36 CYSS HA     36 CYSS HB2     2.81  #peak 959
 36 CYSS HA     36 CYSS HB3     2.73  #peak 960
 35 ALA  QB     36 CYSS HA      4.31  #peak 961
 21 CYSS HB2    36 CYSS HB3     3.47  #peak 966
 33 CYSS HB2    36 CYSS HB3     5.50  #peak 967
 33 CYSS QB     36 CYSS HB3     0.00
 33 CYSS HB3    36 CYSS HB3     0.00
 35 ALA  QB     36 CYSS HB3     4.48  #peak 968
 21 CYSS H      36 CYSS HB3     5.09  #peak 970
 40 ASN  HB3    42 THR  QG2     5.50  #peak 976
 39 CYSS HA     40 ASN  HB2     5.50  #peak 977
 40 ASN  HB2    67 LYS  HA      0.00
 40 ASN  HB2    41 CYSS H       5.04  #peak 979
 40 ASN  HB3    41 CYSS H       0.00
 40 ASN  HB2    40 ASN  HD21    3.73  #peak 980
 40 ASN  HB2    40 ASN  HD22    0.00
 62 SER  HA     67 LYS  HB2     4.40  #peak 989
  6 LYS  HB2     6 LYS  HE2     5.50  #peak 990
  6 LYS  HB2     6 LYS  HE3     0.00
  6 LYS  HB2     6 LYS  QE      0.00
  6 LYS  QB      6 LYS  QE      0.00
  6 LYS  QB     10 CYSS HB3     0.00
  6 LYS  HB2    10 CYSS HB3     0.00
 64 CYSS HB3    67 LYS  HB2     5.36  #peak 991
  6 LYS  QB     10 CYSS HB2     0.00
  6 LYS  HB2    10 CYSS HB2     0.00
 67 LYS  HB2    67 LYS  HE2     5.33  #peak 992
 67 LYS  HB2    67 LYS  HE3     0.00
 67 LYS  HB2    67 LYS  HE3     5.33  #peak 993
 67 LYS  HB2    67 LYS  HE2     0.00
 67 LYS  HB2    67 LYS  QE      0.00
 67 LYS  HA     67 LYS  HD2     3.39  #peak 997
 64 CYSS HB2    67 LYS  HD2     5.50  #peak 998
 39 CYSS HB2    67 LYS  HD2     0.00
 60 CYSS HB3    67 LYS  HD2     0.00
 64 CYSS HB3    67 LYS  HD2     5.50  #peak 999
 67 LYS  H      67 LYS  HD2     5.04  #peak 1002
  9 LYS  HB2    27 CYSS HB3     5.50  #peak 1004
 41 CYSS HB3    47 LYS  QD      0.00
 41 CYSS HB3    47 LYS  HG2     5.50  #peak 1005
 41 CYSS HB3    47 LYS  QG      0.00
 41 CYSS HB3    42 THR  QG2     5.31  #peak 1007
 41 CYSS HB3    53 THR  HA      3.13  #peak 1011
 41 CYSS HB3    47 LYS  H       3.74  #peak 1012
 41 CYSS HB3    54 GLY  H       4.77  #peak 1016
 48 CYSS HB3    66 CYSS HB2     4.01  #peak 1018
 40 ASN  H      66 CYSS HB2     3.44  #peak 1019
 66 CYSS HB2    67 LYS  H       4.80  #peak 1022
 16 SER  HB3    20 GLN  HG2     4.06  #peak 1024
 16 SER  HB3    20 GLN  HG3     0.00
 16 SER  HB2    20 GLN  HG2     0.00
 16 SER  HB2    20 GLN  HG3     0.00
 16 SER  HB3    20 GLN  HB2     4.83  #peak 1025
 16 SER  HB2    20 GLN  HB2     0.00
 16 SER  HB3    20 GLN  H       4.71  #peak 1027
 16 SER  HB2    20 GLN  H       0.00
 16 SER  H      16 SER  HB3     3.63  #peak 1030
 16 SER  H      16 SER  HB2     0.00
 16 SER  HB3    20 GLN  HE22    5.50  #peak 1031
 16 SER  QB     20 GLN  HE22    0.00
 16 SER  HB3    20 GLN  HE21    0.00
 43 SER  H      43 SER  HB2     3.68  #peak 1032
 67 LYS  HG2    67 LYS  HE2     3.08  #peak 1034
 67 LYS  HG2    67 LYS  QE      0.00
 60 CYSS HB3    67 LYS  HE2     4.99  #peak 1036
 64 CYSS HB2    67 LYS  HE2     0.00
 60 CYSS HB3    67 LYS  HE3     0.00
 64 CYSS HB2    67 LYS  QE      0.00
 60 CYSS HB3    67 LYS  QE      0.00
 60 CYSS H      67 LYS  HE2     5.19  #peak 1037
 60 CYSS H      67 LYS  HE3     0.00
 60 CYSS H      67 LYS  QE      0.00
 64 CYSS H      67 LYS  HE2     5.47  #peak 1038
 64 CYSS H      67 LYS  HE3     0.00
 45 GLY  HA2    46 CYSS HB2     5.50  #peak 1040
 44 ASP  HB3    45 GLY  HA3     0.00
 44 ASP  QB     45 GLY  HA3     0.00
 45 GLY  HA3    46 CYSS HB3     0.00
 44 ASP  QB     45 GLY  QA      0.00
 44 ASP  HB3    45 GLY  QA      0.00
 29 GLU  HG3    30 GLY  HA2     5.50  #peak 1041
 29 GLU  HG2    30 GLY  HA3     0.00
 29 GLU  HG3    30 GLY  HA3     0.00
 29 GLU  HG2    30 GLY  HA2     0.00
 29 GLU  HB2    30 GLY  HA2     5.50  #peak 1043
 29 GLU  HB2    30 GLY  HA3     0.00
 29 GLU  HB2    30 GLY  QA      0.00
 45 GLY  HA2    53 THR  QG2     4.30  #peak 1045
 45 GLY  HA3    53 THR  QG2     0.00
 44 ASP  HA     45 GLY  HA2     5.47  #peak 1046
 44 ASP  HA     45 GLY  HA3     0.00
 30 GLY  QA     32 THR  HB      0.00
 30 GLY  HA2    32 THR  HB      0.00
 44 ASP  HA     45 GLY  QA      0.00
 29 GLU  H      30 GLY  HA2     5.50  #peak 1050
 29 GLU  H      30 GLY  QA      0.00
 29 GLU  H      30 GLY  HA3     0.00
 52 CYSS HB2    57 SER  HB2     5.28  #peak 1055
 52 CYSS HB2    57 SER  QB      0.00
 56 ASP  HB3    57 SER  HB2     5.50  #peak 1056
 56 ASP  HB2    57 SER  HB2     0.00
 56 ASP  QB     57 SER  QB      0.00
 56 ASP  HB2    57 SER  HB3     0.00
 56 ASP  HB3    57 SER  HB3     0.00
 56 ASP  HB2    57 SER  QB      0.00
 53 THR  H      57 SER  HB2     5.50  #peak 1059
 53 THR  H      57 SER  HB3     0.00
 53 THR  H      57 SER  QB      0.00
  8 GLU  HB2     9 LYS  H       4.99  #peak 1064
  8 GLU  HB3     9 LYS  H       0.00
  8 GLU  QB      9 LYS  H       0.00
 15 ARG  H      15 ARG  HD2     4.93  #peak 1068
 15 ARG  H      15 ARG  QD      0.00
 55 PRO  HB2    58 CYSS HB3     5.42  #peak 1073
 39 CYSS HB3    58 CYSS HB3     0.00
 55 PRO  HB3    58 CYSS HB3     0.00
 55 PRO  HB3    58 CYSS QB      0.00
 39 CYSS HB2    58 CYSS HB2     0.00
 58 CYSS HB3    59 LYS  H       5.00  #peak 1077
 58 CYSS HB2    59 LYS  H       0.00
 46 CYSS HA     47 LYS  HG2     4.21  #peak 1078
 47 LYS  HA     47 LYS  HG2     0.00
 47 LYS  HA     47 LYS  QG      0.00
 47 LYS  HA     47 LYS  HG3     0.00
 46 CYSS HA     53 THR  QG2     3.80  #peak 1086
 53 THR  HA     53 THR  QG2     2.72  #peak 1088
 53 THR  QG2    54 GLY  HA3     5.50  #peak 1089
 41 CYSS HB3    53 THR  QG2     4.32  #peak 1091
 46 CYSS HB2    53 THR  QG2     3.36  #peak 1092
 46 CYSS QB     53 THR  QG2     0.00
 10 CYSS HB2    15 ARG  HG3     4.40  #peak 1098
 31 CYSS HB3    37 LYS  QD      0.00
 31 CYSS HB3    37 LYS  HD2     0.00
 31 CYSS HB3    37 LYS  HD3     0.00
 31 CYSS HB2    32 THR  QG2     5.50  #peak 1099
 31 CYSS HB3    32 THR  QG2     0.00
 41 CYSS HB2    53 THR  QG2     4.72  #peak 1100
 41 CYSS HB2    53 THR  HA      3.12  #peak 1103
 28 GLY  HA3    31 CYSS HB2     5.50  #peak 1104
 30 GLY  HA2    31 CYSS HB3     0.00
 30 GLY  HA3    31 CYSS HB2     0.00
 30 GLY  QA     31 CYSS HB2     0.00
 30 GLY  QA     31 CYSS HB3     0.00
 30 GLY  HA2    31 CYSS HB2     0.00
 30 GLY  HA3    31 CYSS HB3     0.00
 28 GLY  HA3    31 CYSS QB      0.00
 40 ASN  H      41 CYSS HB2     5.50  #peak 1108
 31 CYSS HB2    32 THR  H       5.30  #peak 1110
 31 CYSS HB3    32 THR  H       0.00
 31 CYSS HB3    38 THR  H       0.00
 41 CYSS HB2    54 GLY  H       3.76  #peak 1113
  4 LYS  HA      4 LYS  HE2     5.50  #peak 1114
  4 LYS  HA      4 LYS  HE3     0.00
  4 LYS  HA      4 LYS  QE      0.00
 55 PRO  HG2    56 ASP  HA      4.64  #peak 1117
 55 PRO  HB2    56 ASP  HA      0.00
 56 ASP  HA     58 CYSS H       4.91  #peak 1123
  6 LYS  HG3    33 CYSS HB2     5.50  #peak 1126
 60 CYSS HB2    67 LYS  HD3     0.00
  6 LYS  QG     33 CYSS HB2     0.00
 33 CYSS HB2    35 ALA  QB      0.00
 33 CYSS HB3    35 ALA  QB      0.00
 33 CYSS QB     35 ALA  QB      0.00
 28 GLY  HA2    29 GLU  HB3     5.49  #peak 1137
 29 GLU  HB3    29 GLU  HG2     2.97  #peak 1142
 29 GLU  HB2    29 GLU  HG3     0.00
  6 LYS  HA      6 LYS  HG3     4.24  #peak 1145
  6 LYS  HA      6 LYS  HG2     0.00
  6 LYS  HA      6 LYS  QG      0.00
  8 GLU  HG2     9 LYS  HG3     5.50  #peak 1149
  8 GLU  HG3     9 LYS  HG3     0.00
  9 LYS  HG3    29 GLU  HG2     0.00
  9 LYS  HG3    29 GLU  HG3     0.00
  9 LYS  QG     29 GLU  HG2     0.00
  9 LYS  QG     29 GLU  HG3     0.00
  9 LYS  HG3    29 GLU  QG      0.00
 56 ASP  HB2    57 SER  HB3     5.50  #peak 1157
 56 ASP  HB2    57 SER  HB2     0.00
 56 ASP  HB3    57 SER  HB2     0.00
 56 ASP  QB     57 SER  QB      0.00
 56 ASP  HB3    57 SER  QB      0.00
 56 ASP  HB3    57 SER  HB3     0.00
 57 SER  HA     57 SER  HB3     2.77  #peak 1158
 57 SER  HA     57 SER  QB      0.00
 53 THR  H      57 SER  HB3     5.50  #peak 1160
 53 THR  H      57 SER  HB2     0.00
 10 CYSS HA     27 CYSS HA      3.17  #peak 1164
 10 CYSS HA     27 CYSS HB3     3.30  #peak 1165
 10 CYSS HA     10 CYSS HB3     2.78  #peak 1166
  9 LYS  HB3    10 CYSS HA      5.50  #peak 1167
  9 LYS  HB2    10 CYSS HA      4.97  #peak 1168
 10 CYSS HA     28 GLY  H       3.83  #peak 1171
 13 ALA  QB     21 CYSS HB3     5.50  #peak 1177
 21 CYSS HB3    24 LYS  HG3     0.00
 21 CYSS HB3    22 GLY  HA2     5.24  #peak 1179
 21 CYSS HB3    22 GLY  QA      0.00
 21 CYSS HB3    36 CYSS HB2     3.47  #peak 1180
 21 CYSS HA     21 CYSS HB3     0.00
 21 CYSS HB3    25 CYSS HB2     3.03  #peak 1182
 21 CYSS HB3    25 CYSS QB      0.00
 21 CYSS H      21 CYSS HB3     3.80  #peak 1183
 21 CYSS HB3    22 GLY  H       4.64  #peak 1184
 21 CYSS HB3    36 CYSS HA      5.48  #peak 1186
 49 GLY  HA2    50 LYS  HG2     5.29  #peak 1190
 49 GLY  QA     50 LYS  HG2     0.00
 49 GLY  HA3    50 LYS  HG2     0.00
 41 CYSS HA     46 CYSS HA      4.46  #peak 1195
 46 CYSS HA     53 THR  HA      3.68  #peak 1196
 45 GLY  HA2    46 CYSS HA      5.02  #peak 1197
 45 GLY  HA3    46 CYSS HA      0.00
 45 GLY  QA     46 CYSS HA      0.00
 41 CYSS HB3    46 CYSS HA      3.04  #peak 1198
 41 CYSS HB2    46 CYSS HA      4.07  #peak 1199
 46 CYSS HA     47 LYS  HB2     4.95  #peak 1201
 46 CYSS HA     47 LYS  H       2.66  #peak 1204
 46 CYSS HA     48 CYSS H       4.58  #peak 1205
 41 CYSS H      46 CYSS HA      5.50  #peak 1206
 50 LYS  HB2    51 GLU  H       4.51  #peak 1209
 50 LYS  HB3    51 GLU  H       0.00
 50 LYS  H      50 LYS  HB2     3.95  #peak 1211
 50 LYS  H      50 LYS  HB3     0.00
 19 CYSS HB3    21 CYSS H       5.07  #peak 1215
 19 CYSS HB3    20 GLN  H       4.77  #peak 1216
 52 CYSS HA     58 CYSS HA      4.08  #peak 1219
 52 CYSS HA     57 SER  HB2     4.13  #peak 1220
 52 CYSS HA     57 SER  QB      0.00
 52 CYSS HA     57 SER  HB3     0.00
 52 CYSS HA     52 CYSS HB3     3.37  #peak 1222
 52 CYSS HA     57 SER  HB3     0.00
 52 CYSS HA     57 SER  HB2     0.00
 52 CYSS HA     57 SER  QB      0.00
 52 CYSS HA     52 CYSS HB2     2.92  #peak 1224
 52 CYSS HA     53 THR  QG2     4.98  #peak 1225
 52 CYSS HA     54 GLY  H       5.50  #peak 1227
 38 THR  QG2    55 PRO  HB3     5.50  #peak 1228
 38 THR  QG2    55 PRO  HB2     0.00
 55 PRO  HB3    58 CYSS HB2     5.50  #peak 1231
 55 PRO  HB2    58 CYSS HB2     0.00
 55 PRO  HB2    58 CYSS QB      0.00
 55 PRO  HB3    58 CYSS QB      0.00
 39 CYSS H      55 PRO  HB3     4.89  #peak 1232
 39 CYSS H      55 PRO  HB2     0.00
 36 CYSS HB2    37 LYS  HA      5.45  #peak 1239
 25 CYSS HA     36 CYSS HB2     5.09  #peak 1240
 21 CYSS H      36 CYSS HB2     5.50  #peak 1241
 36 CYSS HB2    37 LYS  H       4.74  #peak 1242
 36 CYSS H      36 CYSS HB2     3.87  #peak 1243
 67 LYS  HA     67 LYS  HG2     3.83  #peak 1245
 62 SER  HA     67 LYS  HG2     4.42  #peak 1246
 64 CYSS HB2    67 LYS  HG2     3.89  #peak 1247
 67 LYS  HG2    67 LYS  HE3     3.88  #peak 1250
 48 CYSS HA     66 CYSS HB3     4.73  #peak 1263
 48 CYSS HA     48 CYSS HB3     2.90  #peak 1264
 47 LYS  HB3    48 CYSS HA      5.50  #peak 1265
 47 LYS  HB2    48 CYSS HA      5.36  #peak 1266
 17 GLU  HA     17 GLU  HG3     3.92  #peak 1271
 16 SER  HA     17 GLU  HG3     5.50  #peak 1272
 17 GLU  HG3    18 PRO  HD2     5.50  #peak 1273
 17 GLU  HG3    18 PRO  HD3     0.00
 17 GLU  H      17 GLU  HG3     4.39  #peak 1274
 47 LYS  H      47 LYS  HB3     4.12  #peak 1277
 47 LYS  HB3    48 CYSS H       5.08  #peak 1278
 14 CYSS HB2    15 ARG  HG3     5.50  #peak 1279
 14 CYSS HB2    15 ARG  QG      0.00
 11 THR  QG2    14 CYSS HB2     4.68  #peak 1280
 13 ALA  QB     14 CYSS HB2     0.00
 10 CYSS HA     14 CYSS HB2     5.50  #peak 1281
 14 CYSS HB2    27 CYSS HB3     5.50  #peak 1283
 14 CYSS HB2    15 ARG  H       4.11  #peak 1284
 15 ARG  H      15 ARG  HG2     3.86  #peak 1293
 14 CYSS H      15 ARG  HG2     5.50  #peak 1294
 15 ARG  HG2    16 SER  H       0.00
 15 ARG  HB2    16 SER  HA      5.37  #peak 1296
  7 GLY  HA2     8 GLU  QB      0.00
  7 GLY  QA      8 GLU  QB      0.00
 15 ARG  HB2    15 ARG  HD2     3.81  #peak 1298
 27 CYSS HB3    28 GLY  HA3     5.50  #peak 1301
 27 CYSS HB2    28 GLY  HA3     0.00
  9 LYS  HB3    28 GLY  HA3     3.23  #peak 1304
  9 LYS  HB2    28 GLY  HA3     4.40  #peak 1305
  9 LYS  HD2    28 GLY  HA3     0.00
  9 LYS  QD     28 GLY  HA3     0.00
  9 LYS  HD3    28 GLY  HA3     0.00
  9 LYS  HG3    28 GLY  HA3     5.09  #peak 1306
 15 ARG  HB3    15 ARG  HD3     4.05  #peak 1313
 15 ARG  HB3    15 ARG  QD      0.00
 15 ARG  H      15 ARG  HB3     3.63  #peak 1315
 67 LYS  HB3    67 LYS  HE3     5.14  #peak 1319
 67 LYS  HB3    67 LYS  HE2     0.00
 67 LYS  HB3    67 LYS  QE      0.00
 67 LYS  HG3    67 LYS  HE3     3.16  #peak 1320
 67 LYS  HG3    67 LYS  QE      0.00
 62 SER  HA     67 LYS  HE3     3.96  #peak 1322
 62 SER  HA     67 LYS  QE      0.00
 60 CYSS HB3    67 LYS  HE3     4.32  #peak 1323
 60 CYSS HB3    67 LYS  HE2     0.00
 60 CYSS HB3    67 LYS  QE      0.00
 60 CYSS H      67 LYS  HE3     5.50  #peak 1324
 60 CYSS H      67 LYS  HE2     0.00
 67 LYS  H      67 LYS  HE3     5.50  #peak 1326
 67 LYS  H      67 LYS  HE2     0.00
 38 THR  HA     38 THR  HB      2.94  #peak 1327
 31 CYSS HA     32 THR  HA      4.46  #peak 1328
 32 THR  HA     33 CYSS HB3     5.50  #peak 1329
 32 THR  HA     33 CYSS HB2     0.00
 32 THR  HA     33 CYSS HB2     5.50  #peak 1331
 32 THR  HA     33 CYSS HB3     0.00
 38 THR  HA     55 PRO  HB3     4.10  #peak 1332
 38 THR  HA     55 PRO  HG3     0.00
 38 THR  HA     55 PRO  HB2     0.00
 62 SER  HA     67 LYS  HE2     5.42  #peak 1342
 12 SER  HA     15 ARG  HB2     3.90  #peak 1344
 12 SER  HA     15 ARG  QB      0.00
 62 SER  HA     67 LYS  HG3     2.71  #peak 1346
 62 SER  HA     67 LYS  HD2     3.99  #peak 1347
 12 SER  HA     15 ARG  H       3.96  #peak 1350
 12 SER  HA     14 CYSS H       5.50  #peak 1351
 12 SER  HA     16 SER  H       0.00
 25 CYSS HA     26 GLN  HA      5.24  #peak 1353
 40 ASN  HA     66 CYSS HB2     0.00
 40 ASN  HA     40 ASN  HB3     2.81  #peak 1354
 11 THR  QG2    26 GLN  HA      4.25  #peak 1357
 39 CYSS H      40 ASN  HA      5.07  #peak 1360
 40 ASN  HA     40 ASN  HD21    4.71  #peak 1361
 40 ASN  HA     40 ASN  HD22    0.00
 20 GLN  HB2    20 GLN  HG2     2.92  #peak 1362
 13 ALA  QB     20 GLN  HG2     5.28  #peak 1363
 19 CYSS HA     20 GLN  HG2     4.78  #peak 1365
 20 GLN  HG2    21 CYSS H       5.50  #peak 1367
 67 LYS  H      67 LYS  HD3     4.59  #peak 1373
 26 GLN  HB3    27 CYSS HA      5.49  #peak 1379
 16 SER  HB3    20 GLN  HB3     5.38  #peak 1381
 16 SER  QB     20 GLN  HB3     0.00
 20 GLN  H      20 GLN  HB3     4.06  #peak 1383
 20 GLN  HB3    20 GLN  HE21    5.50  #peak 1384
 26 GLN  HB3    26 GLN  QE2     0.00
 14 CYSS HA     19 CYSS HB2     5.08  #peak 1390
 49 GLY  HA3    50 LYS  HG2     5.29  #peak 1393
 49 GLY  HA2    50 LYS  HG2     0.00
 16 SER  HA     17 GLU  HA      4.64  #peak 1403
 17 GLU  HA     19 CYSS HA      4.67  #peak 1404
 16 SER  HB3    17 GLU  HA      5.13  #peak 1405
 16 SER  QB     17 GLU  HA      0.00
 17 GLU  HA     19 CYSS HB2     5.46  #peak 1407
 17 GLU  HA     18 PRO  HB3     4.28  #peak 1409
 17 GLU  HA     17 GLU  HG2     4.15  #peak 1410
 17 GLU  HA     17 GLU  HB3     2.97  #peak 1411
 56 ASP  HB2    57 SER  HA      5.50  #peak 1415
 56 ASP  QB     57 SER  HA      0.00
 56 ASP  HB3    57 SER  HA      0.00
 54 GLY  HA3    56 ASP  HB2     0.00
 25 CYSS HA     26 GLN  HG2     5.50  #peak 1422
 25 CYSS HA     26 GLN  HG3     0.00
 33 CYSS HB3    35 ALA  QB      5.50  #peak 1432
 33 CYSS QB     35 ALA  QB      0.00
 33 CYSS HB2    35 ALA  QB      0.00
 33 CYSS HB2    34 ALA  QB      0.00
 31 CYSS HA     33 CYSS HB3     5.50  #peak 1434
 31 CYSS HA     33 CYSS QB      0.00
 31 CYSS HA     33 CYSS HB2     0.00
 33 CYSS HB3    36 CYSS H       4.59  #peak 1437
 33 CYSS HB2    36 CYSS H       0.00
 33 CYSS QB     36 CYSS H       0.00
  6 LYS  HA     31 CYSS HA      5.50  #peak 1439
  6 LYS  HA      6 LYS  HE2     5.50  #peak 1440
  6 LYS  HA      6 LYS  HE3     0.00
  6 LYS  HA      6 LYS  QE      0.00
  6 LYS  HA     10 CYSS HB3     0.00
  6 LYS  HA      6 LYS  HG2     4.24  #peak 1443
  6 LYS  HA      6 LYS  QG      0.00
  6 LYS  HA      6 LYS  HG3     0.00
  9 LYS  HA     28 GLY  HA3     4.63  #peak 1445
 50 LYS  HA     50 LYS  HE3     5.50  #peak 1446
 50 LYS  HA     50 LYS  HE2     0.00
 50 LYS  HA     50 LYS  QE      0.00
 50 LYS  HA     51 GLU  HB2     4.93  #peak 1447
 50 LYS  HA     51 GLU  QB      0.00
 50 LYS  HA     51 GLU  HB3     0.00
  9 LYS  HA      9 LYS  HB3     2.81  #peak 1448
 24 LYS  HA     24 LYS  HB3     2.92  #peak 1449
 50 LYS  HA     50 LYS  HB3     0.00
 24 LYS  HA     24 LYS  HB2     0.00
 24 LYS  HA     24 LYS  QB      0.00
  9 LYS  HA      9 LYS  HD3     4.19  #peak 1450
  9 LYS  HA      9 LYS  QD      0.00
  9 LYS  HA      9 LYS  HG2     2.91  #peak 1452
  9 LYS  HA      9 LYS  QG      0.00
 50 LYS  HA     50 LYS  HG2     3.95  #peak 1453
 24 LYS  HA     24 LYS  QG      0.00
 24 LYS  HA     24 LYS  HG2     0.00
 24 LYS  HA     24 LYS  HG3     0.00
 14 CYSS HA     19 CYSS HB3     4.91  #peak 1462
 14 CYSS HA     20 GLN  HB2     5.09  #peak 1463
 14 CYSS HA     35 ALA  QB      5.50  #peak 1464
 14 CYSS HA     21 CYSS H       4.32  #peak 1466
 47 LYS  HG2    66 CYSS HB3     5.50  #peak 1473
 66 CYSS HB3    67 LYS  HD3     0.00
 41 CYSS H      66 CYSS HB3     5.03  #peak 1475
 34 ALA  HA     37 LYS  HE2     5.50  #peak 1479
 34 ALA  HA     37 LYS  HE3     0.00
 34 ALA  HA     37 LYS  QE      0.00
 34 ALA  HA     36 CYSS H       5.48  #peak 1486
 55 PRO  HB2    56 ASP  HA      4.67  #peak 1495
 39 CYSS HB3    55 PRO  HD3     3.20  #peak 1497
 39 CYSS HB2    55 PRO  HA      0.00
 21 CYSS HA     24 LYS  HB3     5.50  #peak 1498
 21 CYSS HA     24 LYS  HB2     0.00
 39 CYSS HB3    41 CYSS HB2     4.89  #peak 1499
 39 CYSS HB3    58 CYSS HB2     0.00
 39 CYSS HB2    58 CYSS HB3     0.00
 39 CYSS HB2    58 CYSS QB      0.00
 41 CYSS H      53 THR  HA      5.50  #peak 1509
 45 GLY  H      53 THR  HA      5.50  #peak 1511
  8 GLU  HB3     9 LYS  H       4.99  #peak 1518
  8 GLU  HB2     9 LYS  H       0.00
 60 CYSS HB2    64 CYSS HB2     4.33  #peak 1519
 64 CYSS HB2    67 LYS  HG3     4.56  #peak 1520
 62 SER  HA     64 CYSS HB2     5.37  #peak 1523
 63 SER  QB     64 CYSS HB2     0.00
 61 GLY  HA3    64 CYSS HB2     5.50  #peak 1524
 61 GLY  QA     64 CYSS HB2     0.00
 63 SER  QB     64 CYSS HB2     0.00
 61 GLY  HA2    64 CYSS HB2     0.00
 61 GLY  H      64 CYSS HB2     4.82  #peak 1525
 46 CYSS HB2    51 GLU  HB2     5.50  #peak 1531
 46 CYSS HB2    51 GLU  HB3     0.00
 41 CYSS HB3    46 CYSS HB2     4.54  #peak 1537
 41 CYSS HB3    46 CYSS QB      0.00
 46 CYSS HB2    47 LYS  H       4.31  #peak 1538
 46 CYSS HB3    47 LYS  H       0.00
 46 CYSS HB2    51 GLU  H       4.20  #peak 1539
 46 CYSS HB3    51 GLU  H       0.00
 15 ARG  HA     15 ARG  HB3     3.25  #peak 1544
  6 LYS  HD2    15 ARG  HA      0.00
  6 LYS  QD     15 ARG  HA      0.00
 15 ARG  HA     15 ARG  QB      0.00
 15 ARG  HA     15 ARG  HG2     3.42  #peak 1545
  6 LYS  QG     15 ARG  HA      0.00
 38 THR  QG2    39 CYSS HB2     5.50  #peak 1550
 39 CYSS HB3    42 THR  QG2     0.00
 39 CYSS HB2    55 PRO  HD3     3.90  #peak 1551
 39 CYSS HB2    55 PRO  HA      0.00
 39 CYSS HB3    55 PRO  HD3     0.00
 50 LYS  HB3    51 GLU  H       4.64  #peak 1555
 50 LYS  HB2    51 GLU  H       0.00
 33 CYSS H      37 LYS  HB2     0.00
 11 THR  HB     13 ALA  H       3.90  #peak 1559
 15 ARG  HB2    15 ARG  HD3     3.81  #peak 1562
 15 ARG  HB2    15 ARG  QD      0.00
 15 ARG  QB     15 ARG  QD      0.00
 15 ARG  H      15 ARG  HD3     4.93  #peak 1567
 19 CYSS HB2    35 ALA  HA      5.39  #peak 1570
 19 CYSS HB3    35 ALA  HA      5.48  #peak 1571
 35 ALA  HA     37 LYS  H       4.88  #peak 1574
 35 ALA  HA     36 CYSS HA      4.95  #peak 1576
  9 LYS  HB3     9 LYS  HE2     5.50  #peak 1583
  9 LYS  HB3     9 LYS  HE3     0.00
  9 LYS  HB3     9 LYS  QE      0.00
  9 LYS  HB3    29 GLU  H       5.27  #peak 1584
 46 CYSS HB3    53 THR  QG2     4.28  #peak 1589
 45 GLY  HA3    46 CYSS HB3     5.50  #peak 1591
 45 GLY  HA2    46 CYSS HB3     0.00
 45 GLY  QA     46 CYSS HB3     0.00
 46 CYSS HB3    51 GLU  HA      3.94  #peak 1592
 46 CYSS HB2    51 GLU  HA      0.00
 46 CYSS HB3    52 CYSS H       5.40  #peak 1596
 21 CYSS HB2    22 GLY  HA3     5.50  #peak 1602
 21 CYSS HB2    22 GLY  HA2     0.00
 21 CYSS HB2    22 GLY  QA      0.00
 22 GLY  HA3    23 SER  HA      5.50  #peak 1603
 22 GLY  QA     23 SER  HA      0.00
 20 GLN  HA     22 GLY  HA3     0.00
 21 CYSS H      22 GLY  HA3     5.40  #peak 1606
 21 CYSS H      22 GLY  HA2     0.00
 21 CYSS H      22 GLY  QA      0.00
 22 GLY  HA3    24 LYS  H       4.99  #peak 1608
 22 GLY  HA2    24 LYS  H       0.00
 22 GLY  QA     24 LYS  H       0.00
 33 CYSS HA     33 CYSS HB2     2.96  #peak 1610
 33 CYSS HA     33 CYSS HB3     0.00
  6 LYS  HD2    33 CYSS HA      5.50  #peak 1611
  6 LYS  HD3    33 CYSS HA      0.00
  6 LYS  QD     33 CYSS HA      0.00
 33 CYSS HA     37 LYS  HD3     0.00
 33 CYSS HA     37 LYS  HD2     0.00
 33 CYSS HA     34 ALA  QB      4.84  #peak 1612
 33 CYSS HA     35 ALA  QB      0.00
 33 CYSS HA     34 ALA  H       2.78  #peak 1614
 33 CYSS HA     35 ALA  H       4.58  #peak 1615
 50 LYS  HA     50 LYS  HG3     4.15  #peak 1617
 50 LYS  HA     50 LYS  HG2     0.00
 10 CYSS HA     11 THR  QG2     3.72  #peak 1620
 11 THR  QG2    12 SER  HA      5.50  #peak 1622
 11 THR  QG2    62 SER  HB2     0.00
 11 THR  QG2    62 SER  HB3     0.00
 11 THR  QG2    62 SER  QB      0.00
 11 THR  QG2    27 CYSS HB3     4.59  #peak 1623
 10 CYSS HB3    11 THR  QG2     5.36  #peak 1624
 11 THR  QG2    14 CYSS HB3     0.00
 11 THR  QG2    26 GLN  HB3     3.10  #peak 1626
  9 LYS  HB3    11 THR  QG2     5.50  #peak 1627
 11 THR  QG2    26 GLN  HB2     2.93  #peak 1628
 11 THR  QG2    26 GLN  H       3.61  #peak 1629
 11 THR  QG2    13 ALA  H       4.98  #peak 1631
  4 LYS  HG2     5 GLY  HA3     5.50  #peak 1640
  4 LYS  QG      5 GLY  QA      0.00
  5 GLY  QA      6 LYS  QG      0.00
  7 GLY  HA2    10 CYSS HB2     5.50  #peak 1646
 30 GLY  HA3    31 CYSS HB2     0.00
 30 GLY  HA2    31 CYSS HB2     0.00
 30 GLY  QA     31 CYSS HB3     0.00
 30 GLY  QA     31 CYSS HB2     0.00
 30 GLY  HA2    31 CYSS HB3     0.00
 29 GLU  HG3    30 GLY  HA3     5.50  #peak 1647
 29 GLU  HG3    30 GLY  HA2     0.00
 29 GLU  HG2    30 GLY  HA2     0.00
 29 GLU  HG2    30 GLY  HA3     0.00
 29 GLU  HB2    30 GLY  HA3     5.50  #peak 1648
 29 GLU  HB2    30 GLY  QA      0.00
 29 GLU  HB2    30 GLY  HA2     0.00
  9 LYS  HB2    30 GLY  HA3     5.38  #peak 1649
  9 LYS  HB2    30 GLY  QA      0.00
  9 LYS  HB2    30 GLY  HA2     0.00
 30 GLY  QA     67 LYS  HB3     0.00
 30 GLY  HA2    67 LYS  HB3     0.00
 21 CYSS HB2    22 GLY  HA2     5.50  #peak 1651
 21 CYSS HB2    22 GLY  HA3     0.00
 22 GLY  HA2    24 LYS  H       4.99  #peak 1653
 22 GLY  HA3    24 LYS  H       0.00
 22 GLY  QA     24 LYS  H       0.00
 62 SER  HA     67 LYS  HB3     5.39  #peak 1657
 67 LYS  HB3    67 LYS  HE2     5.14  #peak 1658
 67 LYS  HB3    67 LYS  HE3     0.00
 67 LYS  H      67 LYS  HB3     3.88  #peak 1660
 11 THR  QG2    26 GLN  HG3     4.57  #peak 1662
 11 THR  QG2    26 GLN  QG      0.00
 11 THR  QG2    26 GLN  HG2     0.00
 25 CYSS HA     26 GLN  HG3     5.50  #peak 1663
 25 CYSS HA     26 GLN  QG      0.00
 26 GLN  H      26 GLN  HG3     4.98  #peak 1664
 26 GLN  H      26 GLN  QG      0.00
 26 GLN  H      26 GLN  HG2     0.00
 27 CYSS H      27 CYSS HB3     3.76  #peak 1666
 38 THR  H      38 THR  QG2     3.29  #peak 1670
 38 THR  QG2    39 CYSS H       0.00
 38 THR  QG2    40 ASN  HD21    5.04  #peak 1672
 38 THR  QG2    40 ASN  HD22    0.00
 26 GLN  HA     26 GLN  HB3     3.33  #peak 1683
 26 GLN  HA     26 GLN  HG3     0.00
 26 GLN  HA     26 GLN  HG2     0.00
 60 CYSS HB2    64 CYSS HB3     4.79  #peak 1687
 64 CYSS HB3    67 LYS  HG2     3.57  #peak 1689
 51 GLU  HA     51 GLU  HB3     3.79  #peak 1695
 51 GLU  HA     51 GLU  QG      0.00
 51 GLU  HA     51 GLU  QB      0.00
 51 GLU  HA     51 GLU  HB2     0.00
 51 GLU  HA     51 GLU  HG2     0.00
 46 CYSS HA     51 GLU  HA      5.50  #peak 1696
 50 LYS  HA     51 GLU  HA      0.00
 39 CYSS HB2    55 PRO  HD2     5.07  #peak 1702
 39 CYSS HB3    55 PRO  HD2     0.00
 39 CYSS HB3    55 PRO  HD2     3.38  #peak 1704
 54 GLY  HA2    55 PRO  HD2     2.94  #peak 1705
 54 GLY  HA3    55 PRO  HD2     0.00
 39 CYSS H      55 PRO  HD2     5.17  #peak 1707
 54 GLY  H      55 PRO  HD2     5.12  #peak 1708
 41 CYSS HB3    53 THR  HB      5.10  #peak 1710
 41 CYSS HB2    53 THR  HB      5.40  #peak 1711
 42 THR  HB     53 THR  HB      5.50  #peak 1713
 46 CYSS HA     53 THR  HB      0.00
 43 SER  H      53 THR  HB      4.92  #peak 1714
 45 GLY  H      53 THR  HB      5.30  #peak 1716
 38 THR  HB     55 PRO  HG3     5.50  #peak 1718
 38 THR  HB     55 PRO  HB3     0.00
 64 CYSS HB3    67 LYS  HG3     3.99  #peak 1726
 67 LYS  HG3    67 LYS  HE2     4.12  #peak 1727
 67 LYS  H      67 LYS  HG3     4.39  #peak 1731
 32 THR  HB     33 CYSS H       5.50  #peak 1733
 20 GLN  HA     20 GLN  HB3     3.07  #peak 1739
 20 GLN  HA     20 GLN  HG2     0.00
 20 GLN  HA     20 GLN  HE21    4.65  #peak 1745
 20 GLN  HA     20 GLN  HE22    0.00
 20 GLN  HA     20 GLN  QE2     0.00
 20 GLN  HA     20 GLN  HE22    5.10  #peak 1746
 20 GLN  HA     20 GLN  HE21    0.00
 43 SER  HA     53 THR  QG2     3.90  #peak 1748
 43 SER  HA     44 ASP  HA      4.93  #peak 1749
 47 LYS  HA     47 LYS  HB3     2.85  #peak 1752
 47 LYS  HA     47 LYS  HD2     4.41  #peak 1753
 47 LYS  HA     47 LYS  HD3     0.00
 47 LYS  HA     47 LYS  QD      0.00
 61 GLY  HA2    64 CYSS HB2     5.50  #peak 1758
 60 CYSS HB3    61 GLY  QA      0.00
 61 GLY  QA     64 CYSS HB2     0.00
 60 CYSS HB3    61 GLY  HA3     0.00
 61 GLY  HA3    64 CYSS HB2     0.00
 21 CYSS HA     25 CYSS HB2     5.50  #peak 1764
 21 CYSS HA     25 CYSS QB      0.00
 21 CYSS HA     36 CYSS HB3     0.00
 21 CYSS HA     21 CYSS HB3     3.00  #peak 1765
 20 GLN  HB3    21 CYSS HA      5.15  #peak 1766
 20 GLN  HB2    21 CYSS HA      5.39  #peak 1767
 21 CYSS HA     24 LYS  HB2     5.50  #peak 1768
 21 CYSS HA     24 LYS  HB3     0.00
 21 CYSS HA     24 LYS  QB      0.00
 20 GLN  HA     21 CYSS HA      4.91  #peak 1770
 21 CYSS HA     25 CYSS HA      3.97  #peak 1771
 28 GLY  HA3    29 GLU  HA      4.63  #peak 1777
 29 GLU  HA     31 CYSS HB2     5.50  #peak 1778
 29 GLU  HA     31 CYSS HB3     0.00
 29 GLU  HA     29 GLU  HB2     2.95  #peak 1780
 29 GLU  HA     29 GLU  HB3     0.00
 29 GLU  HA     31 CYSS H       4.51  #peak 1784
 66 CYSS HA     66 CYSS HB2     2.77  #peak 1789
 66 CYSS HA     66 CYSS HB3     2.90  #peak 1790
 40 ASN  HB2    66 CYSS HA      3.44  #peak 1791
 48 CYSS HB3    66 CYSS HA      4.69  #peak 1792
 40 ASN  H      66 CYSS HA      3.93  #peak 1794
 40 ASN  HD22   66 CYSS HA      5.49  #peak 1798
 40 ASN  HD21   66 CYSS HA      0.00
 55 PRO  HD3    58 CYSS HB3     5.50  #peak 1800
 41 CYSS HB2    55 PRO  HD3     0.00
 55 PRO  HD3    58 CYSS QB      0.00
 54 GLY  HA2    55 PRO  HD3     3.57  #peak 1803
 54 GLY  HA3    55 PRO  HD3     0.00
 55 PRO  HD3    56 ASP  H       5.19  #peak 1804
 54 GLY  H      55 PRO  HD3     5.50  #peak 1806
 37 LYS  H      37 LYS  HB2     3.21  #peak 1821
 37 LYS  H      37 LYS  HB3     0.00
 65 SER  H      65 SER  HB3     3.94  #peak 1823
 65 SER  HB3    66 CYSS H       4.65  #peak 1824
 50 LYS  H      51 GLU  HG2     5.50  #peak 1828
 50 LYS  H      51 GLU  HG3     0.00
 50 LYS  H      51 GLU  QG      0.00
 18 PRO  HB2    19 CYSS HB2     4.89  #peak 1831
 18 PRO  HB2    19 CYSS HB3     4.63  #peak 1832
 47 LYS  HB2    48 CYSS HB3     5.50  #peak 1835
 48 CYSS HB3    50 LYS  HB2     0.00
 48 CYSS HB3    66 CYSS HB3     3.13  #peak 1838
 47 LYS  H      48 CYSS HB3     5.05  #peak 1840
 16 SER  HB2    20 GLN  HG3     3.91  #peak 1845
 16 SER  HB3    20 GLN  HG2     0.00
 16 SER  QB     20 GLN  HG2     0.00
 16 SER  HB2    20 GLN  HG2     0.00
 16 SER  HB2    20 GLN  HB2     4.32  #peak 1846
 16 SER  HB3    20 GLN  HB2     0.00
 16 SER  QB     20 GLN  HB2     0.00
 16 SER  HB2    20 GLN  HE21    5.50  #peak 1850
 16 SER  HB3    20 GLN  HE21    0.00
 16 SER  HB2    20 GLN  HE22    0.00
  7 GLY  HA3    10 CYSS HB2     5.50  #peak 1866
  7 GLY  HA3    31 CYSS HB2     0.00
  7 GLY  QA     10 CYSS HB2     0.00
  7 GLY  HA3     8 GLU  HB3     5.50  #peak 1867
  7 GLY  HA3     8 GLU  HB2     0.00
  7 GLY  HA3     8 GLU  QB      0.00
  7 GLY  QA      8 GLU  QB      0.00
  6 LYS  HB3     7 GLY  HA3     5.34  #peak 1868
  6 LYS  QB      7 GLY  HA3     0.00
  6 LYS  QB      7 GLY  QA      0.00
  6 LYS  HB3     7 GLY  QA      0.00
  7 GLY  HA3     9 LYS  HB2     5.50  #peak 1869
  7 GLY  QA      9 LYS  HB2     0.00
 67 LYS  HA     67 LYS  HE2     4.91  #peak 1879
 67 LYS  HA     67 LYS  QE      0.00
 67 LYS  HA     67 LYS  HE3     5.28  #peak 1880
 67 LYS  HA     67 LYS  HE2     0.00
 67 LYS  HA     67 LYS  HB3     2.97  #peak 1881
 67 LYS  HA     67 LYS  HD3     2.85  #peak 1882
 40 ASN  H      67 LYS  HA      4.91  #peak 1885
 66 CYSS H      67 LYS  HA      5.50  #peak 1886
 64 CYSS H      67 LYS  HA      0.00
 40 ASN  HD21   67 LYS  HA      4.40  #peak 1887
 40 ASN  HD22   67 LYS  HA      0.00
 66 CYSS HA     67 LYS  HA      4.93  #peak 1890
 14 CYSS HB3    15 ARG  HB2     5.50  #peak 1891
 14 CYSS HB3    15 ARG  QB      0.00
 14 CYSS HB3    15 ARG  HG3     5.15  #peak 1892
 14 CYSS HB3    15 ARG  QG      0.00
 14 CYSS HB3    15 ARG  HA      5.41  #peak 1894
 41 CYSS HA     42 THR  QG2     3.97  #peak 1905
 42 THR  QG2    54 GLY  HA3     5.50  #peak 1906
 42 THR  QG2    55 PRO  HD3     0.00
 42 THR  QG2    54 GLY  HA2     0.00
 18 PRO  HG3    19 CYSS H       5.41  #peak 1914
 52 CYSS HB3    58 CYSS HA      2.77  #peak 1920
 52 CYSS HB2    58 CYSS HA      2.72  #peak 1921
 58 CYSS HA     59 LYS  HG2     5.50  #peak 1924
 58 CYSS HA     59 LYS  HG3     0.00
 58 CYSS HA     59 LYS  QG      0.00
 58 CYSS HA     59 LYS  H       2.82  #peak 1926
 48 CYSS HB2    64 CYSS HB3     5.50  #peak 1930
 40 ASN  HB2    48 CYSS HB2     0.00
 47 LYS  HB2    48 CYSS HB2     5.50  #peak 1932
 48 CYSS HB2    50 LYS  HB2     0.00
 48 CYSS HB2    50 LYS  HG3     5.50  #peak 1933
 48 CYSS HB2    50 LYS  HG2     0.00
 48 CYSS HB2    50 LYS  HG2     4.96  #peak 1934
 48 CYSS HB2    50 LYS  HG3     0.00
 48 CYSS HB2    50 LYS  H       5.38  #peak 1938
 48 CYSS HA     48 CYSS HB2     2.81  #peak 1940
  7 GLY  HA2     8 GLU  HB3     5.10  #peak 1942
  7 GLY  HA2     8 GLU  QB      0.00
  7 GLY  HA2     8 GLU  HB2     0.00
  7 GLY  QA      8 GLU  QB      0.00
  6 LYS  HA      7 GLY  HA2     5.50  #peak 1944
 49 GLY  QA     50 LYS  HA      0.00
 49 GLY  HA3    50 LYS  HA      0.00
 49 GLY  HA2    50 LYS  HA      0.00
 39 CYSS HB2    54 GLY  HA3     5.50  #peak 1945
 52 CYSS HB2    54 GLY  HA3     0.00
 39 CYSS HB3    54 GLY  HA3     0.00
 39 CYSS HB2    54 GLY  HA2     0.00
 41 CYSS HB2    54 GLY  HA3     5.06  #peak 1946
 41 CYSS HB2    54 GLY  HA2     0.00
 54 GLY  HA3    55 PRO  HG2     5.45  #peak 1947
 54 GLY  HA2    55 PRO  HG2     0.00
 54 GLY  HA2    55 PRO  HG3     0.00
 39 CYSS HB3    54 GLY  HA3     3.69  #peak 1948
 39 CYSS HB3    54 GLY  HA2     0.00
 55 PRO  HA     58 CYSS HB2     3.44  #peak 1954
 55 PRO  HA     58 CYSS QB      0.00
 11 THR  QG2    26 GLN  HG2     4.57  #peak 1964
 11 THR  QG2    26 GLN  HG3     0.00
 26 GLN  H      26 GLN  HG2     4.54  #peak 1965
 26 GLN  H      26 GLN  QG      0.00
 26 GLN  H      26 GLN  HG3     0.00
  4 LYS  HA      4 LYS  QG      4.39  #peak 697
 58 CYSS HA     59 LYS  QG      0.00
 58 CYSS HA     59 LYS  HG2     0.00
  4 LYS  QB      5 GLY  QA      4.76  #peak 1639
  4 LYS  HB3     5 GLY  HA3     0.00
  4 LYS  HB3     5 GLY  QA      0.00
  5 GLY  QA      6 LYS  HA      4.53  #peak 1642
  5 GLY  QA      6 LYS  HB2     5.34  #peak 1638
  5 GLY  QA      6 LYS  QB      0.00
  4 LYS  HB2     5 GLY  QA      0.00
  5 GLY  QA      6 LYS  QE      5.50  #peak 1635
  5 GLY  HA3     6 LYS  HE2     0.00
  5 GLY  QA      6 LYS  HE3     0.00
  5 GLY  HA3     6 LYS  HE3     0.00
  6 LYS  H       6 LYS  QG      5.50  #peak 274
  6 LYS  H       6 LYS  HG2     0.00
  4 LYS  QG      6 LYS  H       0.00
  6 LYS  H       6 LYS  HG3     0.00
  6 LYS  QG      6 LYS  QE      3.88  #peak 1148
  9 LYS  HG3     9 LYS  HE2     0.00
  9 LYS  HG3     9 LYS  HE3     0.00
  9 LYS  HG3     9 LYS  QE      0.00
  9 LYS  QG      9 LYS  QE      0.00
  6 LYS  HG2     6 LYS  HE3     0.00
  6 LYS  QG     15 ARG  HA      5.50  #peak 1146
  6 LYS  HG2    15 ARG  HA      0.00
  7 GLY  QA      9 LYS  HG3     0.00
  6 LYS  HG3    15 ARG  HA      0.00
  7 GLY  HA3     9 LYS  HG3     0.00
  7 GLY  HA2     8 GLU  QG      5.50  #peak 1941
  7 GLY  HA2     8 GLU  HG2     0.00
  7 GLY  HA2     8 GLU  HG3     0.00
  7 GLY  QA      8 GLU  QG      0.00
  8 GLU  H       8 GLU  QG      5.32  #peak 93
  8 GLU  H       8 GLU  HG2     0.00
  8 GLU  H       8 GLU  HG3     0.00
  8 GLU  QG      9 LYS  H       5.50  #peak 471
  8 GLU  HG2     9 LYS  H       0.00
  8 GLU  HG3     9 LYS  H       0.00
 15 ARG  HA     15 ARG  QD      5.34  #peak 1566
 12 SER  HA     15 ARG  HD3     0.00
 18 PRO  QG     20 GLN  HE21    4.61  #peak 1864
 18 PRO  HG2    20 GLN  HE21    0.00
 18 PRO  HG2    20 GLN  HE22    0.00
 18 PRO  HG2    20 GLN  QE2     0.00
 18 PRO  QG     20 GLN  HE22    4.61  #peak 463
 18 PRO  HG2    20 GLN  HE22    0.00
 18 PRO  HG2    20 GLN  HE21    0.00
 22 GLY  HA3    23 SER  QB      4.58  #peak 1605
 22 GLY  QA     23 SER  QB      0.00
 23 SER  HA     24 LYS  QG      5.50  #peak 865
 23 SER  HA     24 LYS  HG2     0.00
 23 SER  QB     24 LYS  HB2     5.34  #peak 1785
 23 SER  QB     24 LYS  QD      0.00
 23 SER  QB     24 LYS  HB3     0.00
 23 SER  QB     24 LYS  QB      0.00
 23 SER  QB     24 LYS  QG      5.50  #peak 1852
 23 SER  HB3    24 LYS  HG2     0.00
 24 LYS  H      24 LYS  QG      4.23  #peak 105
 24 LYS  H      24 LYS  HG2     0.00
 24 LYS  H      24 LYS  HG3     0.00
 25 CYSS HB3    26 GLN  QG      5.50  #peak 615
 18 PRO  HB3    19 CYSS HB2     0.00
 26 GLN  HA     26 GLN  QG      3.33  #peak 1684
 26 GLN  HA     26 GLN  HG2     0.00
 26 GLN  HA     26 GLN  HG3     0.00
 26 GLN  HA     62 SER  QB      5.16  #peak 1682
 26 GLN  HA     62 SER  HB2     0.00
 26 GLN  HA     62 SER  HB3     0.00
 29 GLU  HB3    61 GLY  QA      5.50  #peak 1138
 29 GLU  HB3    61 GLY  HA2     0.00
 29 GLU  HB2    61 GLY  HA2     0.00
 29 GLU  HB2    61 GLY  QA      0.00
 29 GLU  HB2    30 GLY  HA2     0.00
 29 GLU  HB3    61 GLY  HA3     0.00
 29 GLU  HG2    61 GLY  QA      5.50  #peak 1760
 29 GLU  HG3    61 GLY  QA      0.00
 29 GLU  QG     61 GLY  QA      0.00
 29 GLU  HG2    61 GLY  HA3     0.00
 32 THR  HA     37 LYS  QB      5.50  #peak 1333
 37 LYS  QD     38 THR  HA      0.00
 37 LYS  HB3    38 THR  HA      0.00
 32 THR  HA     37 LYS  HD3     0.00
 32 THR  HA     37 LYS  QD      0.00
 37 LYS  HD3    38 THR  HA      0.00
 32 THR  HA     37 LYS  HD2     0.00
 32 THR  HA     37 LYS  QE      4.56  #peak 636
 37 LYS  HA     37 LYS  HE2     0.00
 37 LYS  HA     37 LYS  QE      0.00
 37 LYS  HA     37 LYS  HE3     0.00
  9 LYS  HA      9 LYS  QE      0.00
 32 THR  QG2    37 LYS  QE      5.50  #peak 648
 37 LYS  HE2    38 THR  QG2     0.00
 37 LYS  QE     38 THR  QG2     0.00
 32 THR  QG2    37 LYS  HE3     0.00
 37 LYS  HE3    38 THR  QG2     0.00
 33 CYSS H      37 LYS  QB      5.29  #peak 158
 33 CYSS H      37 LYS  HD3     0.00
 33 CYSS H      37 LYS  QD      0.00
 33 CYSS H      37 LYS  HB2     0.00
 33 CYSS H      37 LYS  HB3     0.00
 33 CYSS H      37 LYS  HD2     0.00
 33 CYSS H      37 LYS  QG      5.50  #peak 159
 33 CYSS H      37 LYS  HG2     0.00
 33 CYSS H      34 ALA  QB      0.00
 33 CYSS H      37 LYS  HG3     0.00
 33 CYSS HB3    37 LYS  QB      5.45  #peak 1430
 33 CYSS HB3    37 LYS  HB2     0.00
 33 CYSS HB3    37 LYS  HB3     0.00
 33 CYSS QB     37 LYS  HB2     0.00
 33 CYSS HB2    37 LYS  HB2     0.00
 34 ALA  HA     37 LYS  QB      4.91  #peak 1481
 34 ALA  HA     37 LYS  HB3     0.00
 34 ALA  HA     37 LYS  HB2     0.00
 34 ALA  HA     37 LYS  HD3     0.00
 35 ALA  H      37 LYS  QB      5.50  #peak 176
 35 ALA  H      37 LYS  HB3     0.00
 35 ALA  H      37 LYS  HB2     0.00
 35 ALA  H      37 LYS  HD3     0.00
 36 CYSS H      37 LYS  QB      4.92  #peak 379
 36 CYSS H      37 LYS  HB2     0.00
 36 CYSS H      37 LYS  HB3     0.00
 37 LYS  HA     37 LYS  QD      3.69  #peak 938
 37 LYS  HA     37 LYS  HD3     0.00
 37 LYS  HA     37 LYS  HD2     0.00
 37 LYS  QB     37 LYS  QE      5.50  #peak 1815
  9 LYS  HB2     9 LYS  HE2     0.00
  9 LYS  HB2     9 LYS  HE3     0.00
  9 LYS  HB2     9 LYS  QE      0.00
 37 LYS  HB3    37 LYS  QE      0.00
 37 LYS  HB3    37 LYS  HE2     0.00
 37 LYS  HB3    37 LYS  HE3     0.00
 37 LYS  QG     37 LYS  QE      3.77  #peak 635
  4 LYS  QG      4 LYS  QE      0.00
 37 LYS  HG2    37 LYS  QE      0.00
 37 LYS  HG2    37 LYS  HE3     0.00
  9 LYS  HG2     9 LYS  HE2     0.00
  9 LYS  HG2     9 LYS  HE3     0.00
  9 LYS  HG2     9 LYS  QE      0.00
 37 LYS  QG     38 THR  H       4.68  #peak 431
 37 LYS  HG3    38 THR  H       0.00
 37 LYS  HG2    38 THR  H       0.00
 37 LYS  QD     55 PRO  HA      5.50  #peak 1957
 37 LYS  HB3    55 PRO  HA      0.00
 37 LYS  HD3    55 PRO  HA      0.00
 37 LYS  HD2    55 PRO  HA      0.00
 37 LYS  QD     55 PRO  HG2     5.23  #peak 680
 37 LYS  HD3    55 PRO  HG3     0.00
 37 LYS  HB3    55 PRO  HG3     0.00
 37 LYS  HB3    55 PRO  HG2     0.00
 37 LYS  HD3    55 PRO  HG2     0.00
 37 LYS  QD     55 PRO  HG3     5.50  #peak 702
 37 LYS  HB3    55 PRO  HG2     0.00
 37 LYS  HD3    55 PRO  HG2     0.00
 37 LYS  HB3    55 PRO  HG3     0.00
 37 LYS  HD3    55 PRO  HG3     0.00
 42 THR  HB     44 ASP  QB      5.31  #peak 738
 42 THR  HB     44 ASP  HB2     0.00
 42 THR  QG2    44 ASP  QB      4.95  #peak 1808
 42 THR  QG2    44 ASP  HB2     0.00
 46 CYSS HB2    51 GLU  QG      5.50  #peak 1532
 46 CYSS HB2    51 GLU  HB3     0.00
 46 CYSS HB2    51 GLU  QB      0.00
 46 CYSS QB     51 GLU  QB      0.00
 46 CYSS HB2    51 GLU  HB2     0.00
 47 LYS  HB3    47 LYS  QE      5.25  #peak 633
 47 LYS  HB3    47 LYS  HE2     0.00
 47 LYS  HB3    47 LYS  HE3     0.00
 48 CYSS HB3    65 SER  QB      5.34  #peak 1425
 50 LYS  H      50 LYS  QD      5.50  #peak 647
 50 LYS  H      50 LYS  HD2     0.00
 50 LYS  H      50 LYS  HD3     0.00
 58 CYSS HA     59 LYS  QB      5.50  #peak 1923
 58 CYSS HA     59 LYS  HB2     0.00
 58 CYSS HA     59 LYS  HD2     0.00
 58 CYSS HA     59 LYS  HD3     0.00
 58 CYSS HA     59 LYS  QD      0.00
 59 LYS  HA     59 LYS  QG      3.65  #peak 798
 59 LYS  HA     59 LYS  HG2     0.00
 59 LYS  HA     59 LYS  HG3     0.00
 16 SER  H      17 GLU  H       4.80  #peak 11
 18 PRO  HB3    19 CYSS H       3.52  #peak 18
 47 LYS  HA     48 CYSS H       3.45  #peak 22
 48 CYSS H      49 GLY  HA3     5.11  #peak 23
 48 CYSS H      49 GLY  HA2     0.00
 21 CYSS HB3    25 CYSS H       4.21  #peak 41
 52 CYSS HB2    54 GLY  H       3.86  #peak 51
 12 SER  HB2    13 ALA  H       5.21  #peak 206
 12 SER  HB3    13 ALA  H       0.00
 12 SER  QB     13 ALA  H       0.00
 41 CYSS H      66 CYSS HB2     3.58  #peak 232
 11 THR  QG2    28 GLY  H       4.84  #peak 254
 52 CYSS HB2    59 LYS  H       4.31  #peak 291
 59 LYS  H      59 LYS  HB3     3.85  #peak 294
 59 LYS  H      59 LYS  QB      0.00
 59 LYS  H      59 LYS  HB2     0.00
 59 LYS  HG2    60 CYSS H       5.50  #peak 310
 59 LYS  HG3    60 CYSS H       0.00
 59 LYS  QG     60 CYSS H       0.00
 45 GLY  H      46 CYSS H       4.18  #peak 328
 50 LYS  H      50 LYS  HB2     2.91  #peak 338
 48 CYSS H      50 LYS  H       4.03  #peak 342
 14 CYSS H      15 ARG  H       3.07  #peak 352
 37 LYS  H      55 PRO  HB3     5.50  #peak 393
 37 LYS  H      55 PRO  HB2     0.00
  9 LYS  HB2    29 GLU  H       4.15  #peak 423
  9 LYS  HD2    29 GLU  H       0.00
  9 LYS  QD     29 GLU  H       0.00
  9 LYS  HD3    29 GLU  H       0.00
 49 GLY  H      49 GLY  HA2     2.89  #peak 519
 48 CYSS HB2    49 GLY  H       4.87  #peak 520
 46 CYSS HB2    52 CYSS H       4.28  #peak 535
 46 CYSS QB     52 CYSS H       0.00
 22 GLY  HA2    25 CYSS HB2     5.50  #peak 620
 22 GLY  QA     25 CYSS HB2     0.00
 22 GLY  HA2    25 CYSS QB      0.00
 15 ARG  HG3    16 SER  H       5.50  #peak 629
 31 CYSS H      37 LYS  HD3     0.00
 38 THR  HA     55 PRO  HG2     5.44  #peak 703
 54 GLY  HA2    55 PRO  HG2     0.00
 38 THR  HA     55 PRO  HG3     0.00
  8 GLU  HA      9 LYS  HG2     5.50  #peak 803
  7 GLY  HA3     9 LYS  HG2     0.00
  6 LYS  QG     15 ARG  HA      0.00
  6 LYS  QG      7 GLY  HA3     0.00
  6 LYS  HG3    15 ARG  HA      0.00
  6 LYS  QG      7 GLY  QA      0.00
  7 GLY  QA      9 LYS  HG2     0.00
  6 LYS  HG2    15 ARG  HA      0.00
 25 CYSS HA     25 CYSS HB2     3.02  #peak 812
 52 CYSS HB2    60 CYSS H       5.50  #peak 836
 13 ALA  HA     20 GLN  HB3     4.75  #peak 851
 13 ALA  HA     20 GLN  HG2     0.00
 23 SER  HA     25 CYSS HB2     5.50  #peak 862
 23 SER  HA     25 CYSS QB      0.00
 37 LYS  HG2    38 THR  H       5.50  #peak 877
 32 THR  H      37 LYS  HG2     0.00
 37 LYS  HG3    38 THR  H       0.00
 16 SER  HB3    20 GLN  HG3     4.06  #peak 949
 16 SER  QB     20 GLN  HG3     0.00
 16 SER  HB2    20 GLN  HG3     0.00
 41 CYSS H      41 CYSS HB3     3.60  #peak 1013
 39 CYSS HA     67 LYS  HE2     5.23  #peak 1035
 67 LYS  HA     67 LYS  HE2     0.00
 39 CYSS HA     67 LYS  QE      0.00
 67 LYS  HA     67 LYS  HE3     0.00
 67 LYS  HA     67 LYS  QE      0.00
 31 CYSS H      31 CYSS HB3     3.57  #peak 1112
 31 CYSS H      31 CYSS HB2     0.00
 31 CYSS H      31 CYSS QB      0.00
  6 LYS  HG2    33 CYSS HB2     5.50  #peak 1127
 60 CYSS HB2    67 LYS  HD2     0.00
  6 LYS  HG3    33 CYSS HB2     0.00
  6 LYS  QG     33 CYSS HB2     0.00
 59 LYS  H      60 CYSS HB2     5.09  #peak 1132
 28 GLY  HA3    29 GLU  HB3     5.41  #peak 1141
 29 GLU  HB2    30 GLY  QA      0.00
 29 GLU  HB2    30 GLY  HA2     0.00
 29 GLU  HB2    30 GLY  HA3     0.00
 44 ASP  HA     44 ASP  HB3     3.01  #peak 1174
 46 CYSS HA     47 LYS  HG2     4.45  #peak 1202
 46 CYSS HA     47 LYS  QG      0.00
 52 CYSS HA     53 THR  H       2.76  #peak 1226
 21 CYSS HB2    36 CYSS HB2     3.47  #peak 1237
 32 THR  HA     37 LYS  HG2     4.97  #peak 1334
 37 LYS  HG3    38 THR  HA      0.00
 32 THR  HA     37 LYS  HG3     0.00
  9 LYS  HE2    29 GLU  HG2     5.50  #peak 1401
  9 LYS  HE3    29 GLU  HG2     0.00
  9 LYS  QE     29 GLU  HG2     0.00
  9 LYS  QE     29 GLU  HG3     0.00
  9 LYS  QE     29 GLU  QG      0.00
 62 SER  HB2    67 LYS  HD2     5.50  #peak 1414
 62 SER  HB3    67 LYS  HD2     0.00
 62 SER  QB     67 LYS  HD2     0.00
 56 ASP  H      56 ASP  HB3     3.88  #peak 1417
 33 CYSS HB3    37 LYS  HD3     5.50  #peak 1431
 33 CYSS HB3    37 LYS  QD      0.00
 33 CYSS HB2    37 LYS  HD3     0.00
 33 CYSS HB2    37 LYS  HD2     0.00
 33 CYSS QB     37 LYS  HD2     0.00
 33 CYSS QB     37 LYS  HD3     0.00
 33 CYSS HB3    37 LYS  HD2     0.00
 14 CYSS HA     21 CYSS HA      5.50  #peak 1459
 14 CYSS HA     36 CYSS HB2     0.00
 46 CYSS HB2    51 GLU  HA      3.64  #peak 1536
 46 CYSS HB3    51 GLU  HB3     5.50  #peak 1588
 46 CYSS HB3    51 GLU  QB      0.00
 46 CYSS HB3    51 GLU  HB2     0.00
 50 LYS  H      50 LYS  HG3     4.55  #peak 1619
 11 THR  QG2    14 CYSS HB2     4.74  #peak 1625
 29 GLU  HA     29 GLU  HG2     4.18  #peak 1779
 29 GLU  HA     29 GLU  QG      0.00
 39 CYSS HB2    55 PRO  HD3     4.29  #peak 1799
 33 CYSS H      37 LYS  HB3     5.50  #peak 1817
 37 LYS  HB3    38 THR  H       4.70  #peak 1819
 37 LYS  HB2    38 THR  H       0.00
 50 LYS  HA     51 GLU  HG2     5.50  #peak 1825
 50 LYS  HA     51 GLU  HG3     0.00
 50 LYS  HA     51 GLU  QG      0.00
 40 ASN  HB2    48 CYSS HB3     5.50  #peak 1839
 40 ASN  HB3    48 CYSS HB3     0.00
 38 THR  QG2    67 LYS  HA      4.37  #peak 1884
 48 CYSS HB2    66 CYSS HB2     4.75  #peak 1935
 37 LYS  HG2    55 PRO  HA      4.50  #peak 1958
 37 LYS  HG3    55 PRO  HA      0.00
 37 LYS  HG3    55 PRO  HA      5.36  #peak 1959
 37 LYS  HG2    55 PRO  HA      0.00
  8 GLU  HA      8 GLU  QB      2.67  #peak 674
  8 GLU  HA      8 GLU  HB3     0.00
  9 LYS  QD     29 GLU  HG2     5.50  #peak 689
  9 LYS  HD2    29 GLU  HG2     0.00
  9 LYS  HD2    29 GLU  QG      0.00
  9 LYS  HB2    29 GLU  HG2     0.00
  9 LYS  HB2    29 GLU  QG      0.00
  9 LYS  HD3    29 GLU  HG2     0.00
  9 LYS  HB2    29 GLU  HG3     0.00
 12 SER  HA     15 ARG  QD      4.33  #peak 1067
 12 SER  HA     15 ARG  HD2     0.00
 12 SER  QB     15 ARG  H       5.33  #peak 935
 16 SER  QB     17 GLU  H       3.33  #peak 403
 16 SER  HB3    17 GLU  H       0.00
 29 GLU  HB2    61 GLY  QA      5.50  #peak 1140
 29 GLU  HB3    61 GLY  HA3     0.00
 29 GLU  HB2    61 GLY  HA3     0.00
 29 GLU  HB3    61 GLY  HA2     0.00
 37 LYS  HB2    37 LYS  QE      5.23  #peak 1083
 37 LYS  HB3    37 LYS  HE3     0.00
 37 LYS  HB2    37 LYS  HE2     0.00
 37 LYS  HB2    37 LYS  HE3     0.00
 49 GLY  HA2    50 LYS  QD      5.50  #peak 1391
 49 GLY  HA2    50 LYS  HD2     0.00
 49 GLY  HA3    50 LYS  HD2     0.00
 49 GLY  HA3    50 LYS  HD3     0.00
 49 GLY  HA3    50 LYS  QD      5.50  #peak 1189
 49 GLY  QA     50 LYS  QD      0.00
 49 GLY  HA3    50 LYS  HD2     0.00
 49 GLY  HA3    50 LYS  HD3     0.00
  6 LYS  QD      7 GLY  QA      0.00
 49 GLY  HA2    50 LYS  HD2     0.00
 49 GLY  QA     50 LYS  HD2     0.00
 50 LYS  HA     50 LYS  QD      3.42  #peak 1451
 24 LYS  HA     24 LYS  HB3     0.00
 50 LYS  HA     50 LYS  HD2     0.00
 50 LYS  HA     50 LYS  HD3     0.00
 50 LYS  HB2    50 LYS  QE      5.45  #peak 900
  6 LYS  HB2     6 LYS  HE2     0.00
  6 LYS  HB2     6 LYS  QE      0.00
 50 LYS  HB2    50 LYS  HE2     0.00
 50 LYS  HB2    50 LYS  HE3     0.00
 50 LYS  HG3    50 LYS  QE      3.73  #peak 1618
 51 GLU  HA     51 GLU  QG      4.25  #peak 1826
 51 GLU  HA     51 GLU  HG2     0.00
 51 GLU  HA     51 GLU  HG3     0.00
  6 LYS  HA      7 GLY  H       3.42  #peak 599
  8 GLU  HA      8 GLU  HG2     4.13  #peak 673
  8 GLU  HA      8 GLU  HG3     0.00
  8 GLU  HA      8 GLU  QG      0.00
  8 GLU  HA     10 CYSS H       4.66  #peak 679
 30 GLY  H      31 CYSS HA      5.50  #peak 824
  7 GLY  H      31 CYSS HA      0.00
 38 THR  QG2    55 PRO  HB3     5.50  #peak 1493
 38 THR  QG2    39 CYSS HB3     0.00
 38 THR  QG2    55 PRO  HB2     0.00
 38 THR  QG2    39 CYSS HB2     0.00
  9 LYS  HB2    28 GLY  HA3     4.13  #peak 1814
 11 THR  QG2    14 CYSS HB3     5.45  #peak 1893
 54 GLY  H      57 SER  H       5.50  #peak 119
  6 LYS  QE     15 ARG  HA      4.45  #peak 1542
  6 LYS  HE2    15 ARG  HA      0.00
  6 LYS  HE3    15 ARG  HA      0.00
 23 SER  QB     24 LYS  QG      5.50  #peak 1786
 23 SER  HB2    24 LYS  HG2     0.00
 23 SER  QB     24 LYS  HG2     0.00
 60 CYSS HB2    61 GLY  QA      4.97  #peak 1129
 60 CYSS HB2    61 GLY  HA2     0.00
 47 LYS  HA     47 LYS  HD2     4.80  #peak 624
 47 LYS  HA     47 LYS  HD3     0.00
 47 LYS  HA     47 LYS  QD      0.00
  6 LYS  HA      7 GLY  HA3     5.16  #peak 1438
  6 LYS  HA      7 GLY  QA      0.00


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

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