NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type subtype subsubtype
591174 2n25 cing 1-original 3 XPLOR/CNS distance NOE ambi


assign ( resid 45 and name HA
  )
       ( resid 47 and name HN
  ) 4.2 2.4 0.8 volume=0.184 peak=1732 ppm1=3.872 ppm2=6.991

assign ( resid 43 and name HN
  )
       ( resid 46 and name HN
  ) 3.8 2.0 0.8 volume=0.374 peak=190 ppm1=7.448 ppm2=7.709

assign ( resid 41 and name HN
  )
       ( resid 41 and name HA
  ) 3.9 2.1 0.8 volume=0.289 peak=275 ppm1=8.777 ppm2=4.583

assign ( resid 40 and name HA
  )
       ( resid 40 and name HB#
  ) 4.4 2.6 0.9 volume=0.153 peak=1989 ppm1=4.912 ppm2=1.164

assign ( resid 33 and name HA
  )
       ( resid 41 and name HN
  ) 4.5 2.7 0.9 volume=0.125 peak=1237 ppm1=5.241 ppm2=8.784

assign ( resid 50 and name HN
  )
       ( resid 49 and name HA
  ) 3.5 1.7 0.7 volume=0.626 peak=609 ppm1=7.433 ppm2=3.871

assign ( resid 33 and name HA
  )
       ( resid 34 and name HN
  ) 4.0 2.2 0.8 volume=0.245 peak=997 ppm1=5.237 ppm2=8.963

assign ( resid 36 and name HG1
  )
       ( resid 36 and name HB1
  ) 3.4 1.6 0.7 volume=0.739 peak=1789 ppm1=1.648 ppm2=1.076

assign ( resid 40 and name HN
  )
       ( resid 39 and name HA
  ) 2.9 1.1 0.6 volume=1.676 peak=533 ppm1=7.741 ppm2=3.787

assign ( resid 56 and name HG1
  )
       ( resid 56 and name HD1
  ) 3.2 1.4 0.6 volume=0.955 peak=1042 ppm1=1.796 ppm2=3.560

assign ( resid 36 and name HA
  )
       ( resid 36 and name HB1
  ) 5.1 3.3 0.9 volume=0.063 peak=2320 ppm1=4.259 ppm2=1.076

assign ( resid 41 and name HN
  )
       ( resid 41 and name HB2
  ) 3.8 2.0 0.8 volume=0.333 peak=361 ppm1=8.771 ppm2=2.646

assign ( resid 54 and name HN
  )
       ( resid 54 and name HB2
  ) 3.4 1.6 0.7 volume=0.738 peak=594 ppm1=6.898 ppm2=3.060

assign ( resid 35 and name HA
  )
       ( resid 35 and name HN
  ) 4.0 2.2 0.8 volume=0.248 peak=2097 ppm1=4.032 ppm2=9.449

assign ( resid 37 and name HN
  )
       ( resid 36 and name HB1
  ) 3.5 1.7 0.7 volume=0.609 peak=814 ppm1=8.364 ppm2=1.081

assign ( resid 51 and name HN
  )
       ( resid 51 and name HB1
  ) 3.6 1.8 0.7 volume=0.522 peak=194 ppm1=8.920 ppm2=2.277

assign ( resid 56 and name HB1
  )
       ( resid 56 and name HB2
  ) 2.7 0.9 0.5 volume=2.494 peak=1185 ppm1=2.109 ppm2=1.685

assign ( resid 57 and name HA
  )
       ( resid 57 and name HB2
  ) 3.0 1.2 0.6 volume=1.421 peak=2134 ppm1=4.040 ppm2=1.353

assign ( resid 38 and name HN
  )
       ( resid 37 and name HB1
  ) 4.0 2.2 0.8 volume=0.276 peak=329 ppm1=7.795 ppm2=2.640

assign ( resid 41 and name HN
  )
       ( resid 40 and name HN
  ) 3.9 2.1 0.8 volume=0.309 peak=315 ppm1=8.770 ppm2=7.738

assign ( resid 50 and name HB1
  )
       ( resid 50 and name HA
  ) 4.3 2.5 0.9 volume=0.167 peak=2174 ppm1=2.902 ppm2=4.162

assign ( resid 35 and name HA
  )
       ( resid 36 and name HN
  ) 4.2 2.4 0.8 volume=0.197 peak=1895 ppm1=4.033 ppm2=9.119

assign ( resid 41 and name HD1 or resid 41 and name HD2
  )
       ( resid 50 and name HB1
  ) 3.8 2.0 0.8 volume=0.369 peak=64 ppm1=7.183 ppm2=2.896

assign ( resid 39 and name HA
  )
       ( resid 39 and name HB2
  ) 3.5 1.7 0.7 volume=0.636 peak=1800 ppm1=3.787 ppm2=1.513

assign ( resid 51 and name HN
  )
       ( resid 50 and name HN
  ) 3.7 1.9 0.7 volume=0.440 peak=350 ppm1=8.917 ppm2=7.424

assign ( resid 57 and name HN
  )
       ( resid 56 and name HA
  ) 2.9 1.1 0.6 volume=1.639 peak=873 ppm1=7.980 ppm2=4.296

assign ( resid 48 and name HA
  )
       ( resid 48 and name HN
  ) 3.6 1.8 0.7 volume=0.511 peak=1819 ppm1=3.927 ppm2=7.733

assign ( resid 43 and name HB1
  )
       ( resid 43 and name HA
  ) 4.8 3.0 1.0 volume=0.086 peak=1048 ppm1=2.608 ppm2=4.977

assign ( resid 57 and name HN
  )
       ( resid 56 and name HB1
  ) 3.5 1.7 0.7 volume=0.591 peak=803 ppm1=7.974 ppm2=2.112

assign ( resid 47 and name HB2
  )
       ( resid 41 and name HB2
  ) 4.6 2.8 0.9 volume=0.119 peak=1168 ppm1=2.189 ppm2=2.629

assign ( resid 35 and name HG1
  or resid 35 and name HG2
  )
       ( resid 35 and name HN
  ) 4.6 2.8 0.9 volume=0.107 peak=1066 ppm1=1.628 ppm2=9.497

assign ( resid 52 and name HN
  )
       ( resid 52 and name HB2
  or resid 52 and name HB1
  ) 3.0 1.2 0.6 volume=1.427 peak=819 ppm1=7.117 ppm2=1.755

assign ( resid 43 and name HB2
  )
       ( resid 43 and name HA
  ) 5.0 3.2 1.0 volume=0.065 peak=2293 ppm1=2.661 ppm2=4.972

assign ( resid 30 and name HN
  )
       ( resid 30 and name HA
  ) 3.9 2.1 0.8 volume=0.322 peak=277 ppm1=8.043 ppm2=4.325

assign ( resid 43 and name HN
  )
       ( resid 43 and name HB1
  ) 3.0 1.2 0.6 volume=1.555 peak=709 ppm1=7.454 ppm2=2.606

assign ( resid 43 and name HB1
  )
       ( resid 46 and name HN
  ) 4.5 2.7 0.9 volume=0.132 peak=1896 ppm1=2.615 ppm2=7.710

assign ( resid 51 and name HA
  )
       ( resid 51 and name HG2
  ) 4.0 2.2 0.8 volume=0.258 peak=1770 ppm1=3.832 ppm2=3.049

assign ( resid 52 and name HN
  )
       ( resid 51 and name HN
  ) 3.6 1.8 0.7 volume=0.462 peak=767 ppm1=7.114 ppm2=8.914

assign ( resid 51 and name HN
  )
       ( resid 51 and name HA
  ) 3.6 1.8 0.7 volume=0.529 peak=179 ppm1=8.917 ppm2=3.845

assign ( resid 40 and name HA
  )
       ( resid 33 and name HA
  ) 4.5 2.7 0.9 volume=0.124 peak=1183 ppm1=4.910 ppm2=5.232

assign ( resid 39 and name HN
  )
       ( resid 39 and name HB1
  ) 2.9 1.1 0.6 volume=1.710 peak=357 ppm1=8.182 ppm2=1.040

assign ( resid 53 and name HG2#
  )
       ( resid 53 and name HN
  ) 3.6 1.8 0.7 volume=0.485 peak=1129 ppm1=1.118 ppm2=7.599

assign ( resid 56 and name HG2
  )
       ( resid 56 and name HA
  ) 4.3 2.5 0.9 volume=0.159 peak=2067 ppm1=1.851 ppm2=4.266

assign ( resid 49 and name HA
  )
       ( resid 50 and name HN
  ) 4.0 2.2 0.8 volume=0.279 peak=1480 ppm1=3.869 ppm2=7.441

assign ( resid 36 and name HN
  )
       ( resid 35 and name HA
  ) 4.0 2.2 0.8 volume=0.251 peak=126 ppm1=9.113 ppm2=4.036

assign ( resid 51 and name HN
  )
       ( resid 52 and name HN
  ) 3.6 1.8 0.7 volume=0.529 peak=634 ppm1=8.913 ppm2=7.111

assign ( resid 52 and name HA
  )
       ( resid 52 and name HB2
  or resid 52 and name HB1
  ) 2.8 1.0 0.6 volume=2.439 peak=1441 ppm1=4.007 ppm2=1.757

assign ( resid 54 and name HE1
  )
       ( resid 36 and name HG2
  ) 3.5 1.7 0.7 volume=0.573 peak=54 ppm1=7.848 ppm2=1.682

assign ( resid 33 and name HB1
  or resid 33 and name HB2
  )
       ( resid 34 and name HN
  ) 4.1 2.3 0.8 volume=0.227 peak=2251 ppm1=3.491 ppm2=8.948

assign ( resid 39 and name HA
  )
       ( resid 40 and name HB#
  ) 3.5 1.7 0.7 volume=0.576 peak=2193 ppm1=3.787 ppm2=1.145

assign ( resid 43 and name HB2
  )
       ( resid 46 and name HN
  ) 4.7 2.9 0.9 volume=0.104 peak=1953 ppm1=2.666 ppm2=7.704

assign ( resid 48 and name HA
  )
       ( resid 51 and name HN
  ) 4.4 2.6 0.9 volume=0.145 peak=1884 ppm1=3.928 ppm2=8.919

assign ( resid 41 and name HD1 or resid 41 and name HD2
  )
       ( resid 41 and name HE1 or resid 41 and name HE2
  ) 3.2 1.4 0.6 volume=0.925 peak=39 ppm1=7.183 ppm2=6.813

assign ( resid 56 and name HD1
  )
       ( resid 56 and name HG1
  ) 3.2 1.4 0.6 volume=1.069 peak=2278 ppm1=3.562 ppm2=1.800

assign ( resid 50 and name HN
  )
       ( resid 51 and name HN
  ) 3.6 1.8 0.7 volume=0.526 peak=282 ppm1=7.432 ppm2=8.913

assign ( resid 46 and name HB#
  )
       ( resid 46 and name HN
  ) 3.2 1.4 0.6 volume=1.048 peak=1288 ppm1=1.405 ppm2=7.710

assign ( resid 51 and name HA
  )
       ( resid 54 and name HB1
  ) 4.3 2.5 0.9 volume=0.168 peak=2138 ppm1=3.832 ppm2=2.900

assign ( resid 41 and name HE1 or resid 41 and name HE2
  )
       ( resid 46 and name HB#
  ) 3.5 1.7 0.7 volume=0.600 peak=48 ppm1=6.809 ppm2=1.391

assign ( resid 47 and name HB2
  )
       ( resid 41 and name HB1
  ) 4.6 2.8 0.9 volume=0.116 peak=2231 ppm1=2.188 ppm2=2.662

assign ( resid 32 and name HN
  )
       ( resid 32 and name HA
  ) 3.4 1.6 0.7 volume=0.744 peak=481 ppm1=7.674 ppm2=4.628

assign ( resid 57 and name HA
  )
       ( resid 57 and name HB1
  ) 2.9 1.1 0.6 volume=1.731 peak=1976 ppm1=4.039 ppm2=1.448

assign ( resid 51 and name HA
  )
       ( resid 51 and name HB2
  ) 3.9 2.1 0.8 volume=0.286 peak=1537 ppm1=3.837 ppm2=1.958

assign ( resid 51 and name HG2
  )
       ( resid 51 and name HB2
  ) 3.9 2.1 0.8 volume=0.292 peak=1558 ppm1=3.046 ppm2=1.961

assign ( resid 46 and name HA
  )
       ( resid 50 and name HN
  ) 3.9 2.1 0.8 volume=0.287 peak=1469 ppm1=3.878 ppm2=7.447

assign ( resid 36 and name HG2
  )
       ( resid 36 and name HN
  ) 4.0 2.2 0.8 volume=0.255 peak=1515 ppm1=1.683 ppm2=9.113

assign ( resid 37 and name HA
  )
       ( resid 37 and name HB1
  ) 3.4 1.6 0.7 volume=0.738 peak=908 ppm1=5.001 ppm2=2.647

assign ( resid 37 and name HA
  )
       ( resid 37 and name HB2
  ) 2.8 1.0 0.6 volume=2.316 peak=1427 ppm1=5.001 ppm2=3.293

assign ( resid 46 and name HA
  )
       ( resid 46 and name HB#
  ) 2.7 0.9 0.5 volume=2.579 peak=1873 ppm1=3.876 ppm2=1.399

assign ( resid 40 and name HN
  )
       ( resid 40 and name HA
  ) 4.0 2.2 0.8 volume=0.246 peak=504 ppm1=7.745 ppm2=4.906

assign ( resid 32 and name HN
  )
       ( resid 32 and name HB2
  ) 3.6 1.8 0.7 volume=0.513 peak=246 ppm1=7.677 ppm2=2.836

assign ( resid 41 and name HB1
  )
       ( resid 41 and name HD1 or resid 41 and name HD2
  ) 3.8 2.0 0.8 volume=0.336 peak=924 ppm1=2.662 ppm2=7.169

assign ( resid 53 and name HG2#
  )
       ( resid 49 and name HA
  ) 3.8 2.0 0.8 volume=0.335 peak=2157 ppm1=1.121 ppm2=3.839

assign ( resid 57 and name HD1#
  )
       ( resid 53 and name HN
  ) 4.2 2.4 0.8 volume=0.199 peak=1835 ppm1=0.701 ppm2=7.602

assign ( resid 47 and name HN
  )
       ( resid 47 and name HB1
  ) 3.5 1.7 0.7 volume=0.631 peak=302 ppm1=6.977 ppm2=2.838

assign ( resid 46 and name HA
  )
       ( resid 49 and name HN
  ) 3.0 1.2 0.6 volume=1.511 peak=1786 ppm1=3.874 ppm2=7.702

assign ( resid 33 and name HA
  )
       ( resid 40 and name HB#
  ) 4.1 2.3 0.8 volume=0.239 peak=1009 ppm1=5.232 ppm2=1.137

assign ( resid 47 and name HB1
  )
       ( resid 47 and name HN
  ) 4.0 2.2 0.8 volume=0.264 peak=958 ppm1=2.839 ppm2=6.982

assign ( resid 48 and name HN
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 3.0 1.2 0.6 volume=1.438 peak=667 ppm1=7.728 ppm2=1.649

assign ( resid 36 and name HN
  )
       ( resid 38 and name HN
  ) 4.3 2.5 0.9 volume=0.173 peak=244 ppm1=9.116 ppm2=7.818

assign ( resid 50 and name HA
  )
       ( resid 50 and name HB2
  ) 3.9 2.1 0.8 volume=0.292 peak=2262 ppm1=4.161 ppm2=2.980

assign ( resid 46 and name HB#
  )
       ( resid 45 and name HN
  ) 4.2 2.4 0.8 volume=0.209 peak=1391 ppm1=1.403 ppm2=7.869

assign ( resid 45 and name HB#
  )
       ( resid 45 and name HN
  ) 3.0 1.2 0.6 volume=1.469 peak=1324 ppm1=1.247 ppm2=7.846

assign ( resid 47 and name HN
  )
       ( resid 46 and name HA
  ) 3.6 1.8 0.7 volume=0.475 peak=200 ppm1=6.974 ppm2=3.873

assign ( resid 50 and name HN
  )
       ( resid 50 and name HB1
  ) 3.1 1.3 0.6 volume=1.222 peak=698 ppm1=7.433 ppm2=2.897

assign ( resid 51 and name HN
  )
       ( resid 51 and name HB2
  ) 3.7 1.9 0.7 volume=0.397 peak=313 ppm1=8.916 ppm2=1.958

assign ( resid 47 and name HB1
  )
       ( resid 43 and name HN
  ) 4.5 2.7 0.9 volume=0.124 peak=1712 ppm1=2.835 ppm2=7.432

assign ( resid 40 and name HB#
  )
       ( resid 40 and name HA
  ) 4.2 2.4 0.8 volume=0.202 peak=1690 ppm1=1.144 ppm2=4.911

assign ( resid 37 and name HA
  )
       ( resid 37 and name HN
  ) 3.8 2.0 0.8 volume=0.350 peak=2156 ppm1=5.001 ppm2=8.359

assign ( resid 38 and name HN
  )
       ( resid 37 and name HN
  ) 3.3 1.5 0.7 volume=0.865 peak=527 ppm1=7.800 ppm2=8.353

assign ( resid 50 and name HB1
  )
       ( resid 51 and name HN
  ) 4.8 3.0 1.0 volume=0.092 peak=1909 ppm1=2.888 ppm2=8.912

assign ( resid 51 and name HG2
  )
       ( resid 51 and name HG1
  ) 3.3 1.5 0.7 volume=0.817 peak=2032 ppm1=3.047 ppm2=2.861

assign ( resid 48 and name HN
  )
       ( resid 49 and name HN
  ) 2.3 0.5 0.5 volume=7.500 peak=395 ppm1=7.731 ppm2=7.701

assign ( resid 37 and name HB2
  )
       ( resid 37 and name HN
  ) 4.3 2.5 0.9 volume=0.181 peak=1490 ppm1=3.296 ppm2=8.360

assign ( resid 52 and name HN
  )
       ( resid 51 and name HB1
  ) 3.9 2.1 0.8 volume=0.315 peak=530 ppm1=7.117 ppm2=2.266

assign ( resid 36 and name HB1
  )
       ( resid 36 and name HB2
  ) 3.5 1.7 0.7 volume=0.619 peak=1404 ppm1=1.074 ppm2=1.263

assign ( resid 41 and name HD1 or resid 41 and name HD2
  )
       ( resid 41 and name HB2
  ) 3.7 1.9 0.7 volume=0.387 peak=96 ppm1=7.181 ppm2=2.610

assign ( resid 35 and name HN
  )
       ( resid 34 and name HA
  ) 3.3 1.5 0.7 volume=0.853 peak=682 ppm1=9.451 ppm2=4.301

assign ( resid 48 and name HN
  )
       ( resid 44 and name HA
  ) 3.6 1.8 0.7 volume=0.475 peak=710 ppm1=7.726 ppm2=3.384

assign ( resid 33 and name HA
  )
       ( resid 40 and name HA
  ) 4.2 2.4 0.8 volume=0.183 peak=1763 ppm1=5.249 ppm2=4.882

assign ( resid 41 and name HB1
  )
       ( resid 41 and name HN
  ) 4.9 3.1 1.0 volume=0.078 peak=1640 ppm1=2.676 ppm2=8.777

assign ( resid 46 and name HN
  )
       ( resid 45 and name HB#
  ) 2.6 0.8 0.5 volume=3.217 peak=368 ppm1=7.709 ppm2=1.253

assign ( resid 53 and name HN
  )
       ( resid 52 and name HN
  ) 3.3 1.5 0.7 volume=0.858 peak=133 ppm1=7.591 ppm2=7.099

assign ( resid 50 and name HB2
  )
       ( resid 50 and name HA
  ) 4.2 2.4 0.8 volume=0.202 peak=1615 ppm1=2.987 ppm2=4.160

assign ( resid 36 and name HG2
  )
       ( resid 37 and name HN
  ) 4.7 2.9 0.9 volume=0.104 peak=1661 ppm1=1.679 ppm2=8.378

assign ( resid 38 and name HN
  )
       ( resid 37 and name HB2
  ) 3.5 1.7 0.7 volume=0.568 peak=677 ppm1=7.794 ppm2=3.296

assign ( resid 39 and name HB2
  )
       ( resid 39 and name HA
  ) 4.3 2.5 0.9 volume=0.166 peak=994 ppm1=1.515 ppm2=3.778

assign ( resid 51 and name HN
  )
       ( resid 48 and name HA
  ) 3.7 1.9 0.7 volume=0.452 peak=881 ppm1=8.920 ppm2=3.916

assign ( resid 51 and name HG1
  )
       ( resid 52 and name HN
  ) 4.0 2.2 0.8 volume=0.255 peak=1311 ppm1=2.867 ppm2=7.120

assign ( resid 36 and name HN
  )
       ( resid 36 and name HB2
  ) 3.6 1.8 0.7 volume=0.498 peak=569 ppm1=9.116 ppm2=1.271

assign ( resid 44 and name HA
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 4.4 2.6 0.9 volume=0.141 peak=1880 ppm1=3.379 ppm2=1.651

assign ( resid 50 and name HN
  )
       ( resid 47 and name HA
  ) 3.5 1.7 0.7 volume=0.577 peak=695 ppm1=7.433 ppm2=3.893

assign ( resid 36 and name HG1
  )
       ( resid 36 and name HB2
  ) 3.4 1.6 0.7 volume=0.714 peak=1089 ppm1=1.649 ppm2=1.263

assign ( resid 52 and name HA
  )
       ( resid 54 and name HN
  ) 4.0 2.2 0.8 volume=0.279 peak=1141 ppm1=4.006 ppm2=6.904

assign ( resid 47 and name HB2
  )
       ( resid 47 and name HB1
  ) 4.5 2.7 0.9 volume=0.127 peak=2237 ppm1=2.190 ppm2=2.829

assign ( resid 57 and name HD2#
  )
       ( resid 57 and name HA
  ) 3.5 1.7 0.7 volume=0.610 peak=1697 ppm1=0.747 ppm2=4.046

assign ( resid 35 and name HN
  )
       ( resid 34 and name HB1
  ) 4.6 2.8 0.9 volume=0.114 peak=303 ppm1=9.450 ppm2=3.309

assign ( resid 43 and name HN
  )
       ( resid 43 and name HA
  ) 3.8 2.0 0.8 volume=0.379 peak=713 ppm1=7.454 ppm2=4.975

assign ( resid 43 and name HB2
  )
       ( resid 46 and name HB#
  ) 3.8 2.0 0.8 volume=0.347 peak=1073 ppm1=2.653 ppm2=1.402

assign ( resid 50 and name HB2
  )
       ( resid 50 and name HE1
  ) 4.2 2.4 0.8 volume=0.188 peak=1118 ppm1=2.990 ppm2=7.864

assign ( resid 52 and name HN
  )
       ( resid 51 and name HB2
  ) 3.9 2.1 0.8 volume=0.286 peak=448 ppm1=7.111 ppm2=1.962

assign ( resid 43 and name HB2
  )
       ( resid 43 and name HN
  ) 4.3 2.5 0.9 volume=0.175 peak=1627 ppm1=2.659 ppm2=7.450

assign ( resid 41 and name HD1 or resid 41 and name HD2
  )
       ( resid 47 and name HB2
  ) 4.1 2.3 0.8 volume=0.213 peak=25 ppm1=7.183 ppm2=2.182

assign ( resid 32 and name HB2
  )
       ( resid 44 and name HA
  ) 4.4 2.6 0.9 volume=0.151 peak=1881 ppm1=2.842 ppm2=3.378

assign ( resid 47 and name HB1
  )
       ( resid 41 and name HB1
  ) 4.0 2.2 0.8 volume=0.262 peak=1356 ppm1=2.836 ppm2=2.660

assign ( resid 53 and name HN
  )
       ( resid 50 and name HA
  ) 3.9 2.1 0.8 volume=0.307 peak=204 ppm1=7.579 ppm2=4.132

assign ( resid 53 and name HG2#
  )
       ( resid 54 and name HN
  ) 4.3 2.5 0.9 volume=0.160 peak=1408 ppm1=1.114 ppm2=6.922

assign ( resid 46 and name HA
  )
       ( resid 43 and name HB1
  ) 4.2 2.4 0.8 volume=0.198 peak=1516 ppm1=3.875 ppm2=2.610

assign ( resid 40 and name HB#
  )
       ( resid 33 and name HB1
  or resid 33 and name HB2
  ) 4.1 2.3 0.8 volume=0.226 peak=2077 ppm1=1.145 ppm2=3.492

assign ( resid 33 and name HB2
  )
       ( resid 33 and name HA
  ) 4.2 2.4 0.8 volume=0.201 peak=2309 ppm1=3.501 ppm2=5.235

assign ( resid 36 and name HG1
  )
       ( resid 37 and name HN
  ) 4.5 2.7 0.9 volume=0.138 peak=1251 ppm1=1.639 ppm2=8.386

assign ( resid 33 and name HA
  )
       ( resid 40 and name HN
  ) 4.7 2.9 0.9 volume=0.094 peak=1262 ppm1=5.229 ppm2=7.715

assign ( resid 53 and name HA
  )
       ( resid 54 and name HN
  ) 4.8 3.0 1.0 volume=0.085 peak=1666 ppm1=4.003 ppm2=6.876

assign ( resid 35 and name HA
  )
       ( resid 35 and name HG1
  or resid 35 and name HG2
  ) 3.3 1.5 0.7 volume=0.867 peak=1316 ppm1=4.029 ppm2=1.618

assign ( resid 45 and name HA
  )
       ( resid 45 and name HB#
  ) 2.5 0.7 0.5 volume=4.888 peak=2112 ppm1=3.873 ppm2=1.237

assign ( resid 48 and name HA
  )
       ( resid 51 and name HB1
  ) 3.5 1.7 0.7 volume=0.551 peak=1905 ppm1=3.929 ppm2=2.267

assign ( resid 36 and name HB2
  )
       ( resid 36 and name HN
  ) 4.1 2.3 0.8 volume=0.220 peak=1703 ppm1=1.264 ppm2=9.112

assign ( resid 51 and name HA
  )
       ( resid 51 and name HN
  ) 4.1 2.3 0.8 volume=0.225 peak=1039 ppm1=3.833 ppm2=8.920

assign ( resid 36 and name HB2
  )
       ( resid 36 and name HB1
  ) 3.0 1.2 0.6 volume=1.358 peak=2260 ppm1=1.266 ppm2=1.081

assign ( resid 37 and name HN
  )
       ( resid 37 and name HA
  ) 3.8 2.0 0.8 volume=0.333 peak=293 ppm1=8.360 ppm2=4.999

assign ( resid 36 and name HG2
  )
       ( resid 54 and name HB2
  ) 4.8 3.0 1.0 volume=0.092 peak=2046 ppm1=1.677 ppm2=3.088

assign ( resid 46 and name HN
  )
       ( resid 46 and name HB#
  ) 2.7 0.9 0.5 volume=2.516 peak=800 ppm1=7.709 ppm2=1.401

assign ( resid 37 and name HN
  )
       ( resid 36 and name HB2
  ) 3.5 1.7 0.7 volume=0.579 peak=175 ppm1=8.360 ppm2=1.261

assign ( resid 56 and name HB1
  )
       ( resid 56 and name HA
  ) 4.0 2.2 0.8 volume=0.244 peak=2323 ppm1=2.107 ppm2=4.273

assign ( resid 38 and name HA
  )
       ( resid 39 and name HN
  ) 5.2 3.4 0.8 volume=0.055 peak=1759 ppm1=4.205 ppm2=8.170

assign ( resid 46 and name HN
  )
       ( resid 43 and name HB1
  ) 3.6 1.8 0.7 volume=0.457 peak=740 ppm1=7.709 ppm2=2.609

assign ( resid 57 and name HD2#
  )
       ( resid 57 and name HB1
  ) 2.5 0.7 0.5 volume=4.775 peak=1504 ppm1=0.746 ppm2=1.449

assign ( resid 49 and name HA
  )
       ( resid 51 and name HN
  ) 4.6 2.8 0.9 volume=0.108 peak=2131 ppm1=3.866 ppm2=8.939

assign ( resid 37 and name HB1
  )
       ( resid 54 and name HE1
  ) 3.9 2.1 0.8 volume=0.314 peak=1325 ppm1=2.646 ppm2=7.847

assign ( resid 43 and name HN
  )
       ( resid 43 and name HB2
  ) 3.1 1.3 0.6 volume=1.210 peak=874 ppm1=7.454 ppm2=2.658

assign ( resid 34 and name HN
  )
       ( resid 40 and name HB#
  ) 4.7 2.9 0.9 volume=0.100 peak=331 ppm1=8.951 ppm2=1.130

assign ( resid 54 and name HE1
  )
       ( resid 37 and name HB2
  ) 3.0 1.2 0.6 volume=1.367 peak=35 ppm1=7.850 ppm2=3.294

assign ( resid 43 and name HA
  )
       ( resid 43 and name HB1
  ) 4.1 2.3 0.8 volume=0.240 peak=2088 ppm1=4.988 ppm2=2.607

assign ( resid 41 and name HN
  )
       ( resid 40 and name HA
  ) 3.3 1.5 0.7 volume=0.785 peak=804 ppm1=8.774 ppm2=4.903

assign ( resid 45 and name HN
  )
       ( resid 45 and name HB#
  ) 3.2 1.4 0.6 volume=1.041 peak=552 ppm1=7.870 ppm2=1.239

assign ( resid 33 and name HN
  )
       ( resid 32 and name HA
  ) 2.8 1.0 0.6 volume=2.150 peak=825 ppm1=8.497 ppm2=4.650

assign ( resid 56 and name HG1
  )
       ( resid 56 and name HA
  ) 4.4 2.6 0.9 volume=0.148 peak=2094 ppm1=1.803 ppm2=4.262

assign ( resid 46 and name HB#
  )
       ( resid 43 and name HB1
  ) 3.3 1.5 0.7 volume=0.777 peak=2056 ppm1=1.405 ppm2=2.606

assign ( resid 46 and name HB#
  )
       ( resid 43 and name HN
  ) 4.0 2.2 0.8 volume=0.266 peak=1130 ppm1=1.402 ppm2=7.455

assign ( resid 50 and name HA
  )
       ( resid 50 and name HN
  ) 4.3 2.5 0.9 volume=0.177 peak=1108 ppm1=4.161 ppm2=7.432

assign ( resid 45 and name HB#
  )
       ( resid 46 and name HN
  ) 2.9 1.1 0.6 volume=1.832 peak=1986 ppm1=1.248 ppm2=7.709

assign ( resid 36 and name HN
  )
       ( resid 36 and name HG1
  ) 3.4 1.6 0.7 volume=0.720 peak=547 ppm1=9.118 ppm2=1.660

assign ( resid 39 and name HN
  )
       ( resid 37 and name HN
  ) 3.8 2.0 0.8 volume=0.367 peak=211 ppm1=8.188 ppm2=8.332

assign ( resid 56 and name HG2
  )
       ( resid 56 and name HD2
  ) 3.4 1.6 0.7 volume=0.691 peak=887 ppm1=1.847 ppm2=3.632

assign ( resid 57 and name HD1#
  )
       ( resid 57 and name HN
  ) 3.7 1.9 0.7 volume=0.454 peak=2191 ppm1=0.702 ppm2=7.980

assign ( resid 40 and name HA
  )
       ( resid 40 and name HN
  ) 5.3 3.5 0.7 volume=0.047 peak=1771 ppm1=4.921 ppm2=7.749

assign ( resid 47 and name HB2
  )
       ( resid 32 and name HB1
  ) 4.4 2.6 0.9 volume=0.145 peak=1193 ppm1=2.190 ppm2=2.572

assign ( resid 35 and name HA
  )
       ( resid 38 and name HA
  ) 3.3 1.5 0.7 volume=0.765 peak=1125 ppm1=4.031 ppm2=4.207

assign ( resid 48 and name HA
  )
       ( resid 49 and name HN
  ) 3.5 1.7 0.7 volume=0.631 peak=1741 ppm1=3.925 ppm2=7.703

assign ( resid 52 and name HN
  )
       ( resid 52 and name HG2
  ) 3.1 1.3 0.6 volume=1.148 peak=582 ppm1=7.122 ppm2=1.501

assign ( resid 57 and name HB1
  )
       ( resid 57 and name HN
  ) 3.8 2.0 0.8 volume=0.368 peak=1652 ppm1=1.453 ppm2=7.972

assign ( resid 36 and name HG2
  )
       ( resid 36 and name HA
  ) 4.6 2.8 0.9 volume=0.109 peak=1481 ppm1=1.686 ppm2=4.254

assign ( resid 39 and name HA
  )
       ( resid 40 and name HN
  ) 3.4 1.6 0.7 volume=0.717 peak=941 ppm1=3.787 ppm2=7.748

assign ( resid 48 and name HN
  )
       ( resid 47 and name HB2
  ) 3.8 2.0 0.8 volume=0.333 peak=560 ppm1=7.719 ppm2=2.173

assign ( resid 30 and name HN
  )
       ( resid 30 and name HB1
  or resid 30 and name HB2
  ) 3.6 1.8 0.7 volume=0.455 peak=546 ppm1=8.041 ppm2=1.436

assign ( resid 57 and name HD2#
  )
       ( resid 57 and name HN
  ) 3.8 2.0 0.8 volume=0.347 peak=1169 ppm1=0.746 ppm2=7.978

assign ( resid 56 and name HA
  )
       ( resid 57 and name HN
  ) 3.8 2.0 0.8 volume=0.338 peak=1392 ppm1=4.285 ppm2=7.981

assign ( resid 49 and name HN
  )
       ( resid 49 and name HA
  ) 2.8 1.0 0.6 volume=2.061 peak=671 ppm1=7.697 ppm2=3.868

assign ( resid 39 and name HN
  )
       ( resid 38 and name HN
  ) 3.7 1.9 0.7 volume=0.400 peak=846 ppm1=8.181 ppm2=7.779

assign ( resid 40 and name HB#
  )
       ( resid 39 and name HA
  ) 3.8 2.0 0.8 volume=0.342 peak=1933 ppm1=1.145 ppm2=3.802

assign ( resid 51 and name HA
  )
       ( resid 54 and name HB2
  ) 4.0 2.2 0.8 volume=0.269 peak=1866 ppm1=3.832 ppm2=3.060

assign ( resid 56 and name HG2
  )
       ( resid 56 and name HB1
  ) 2.9 1.1 0.6 volume=1.946 peak=1829 ppm1=1.847 ppm2=2.108

assign ( resid 56 and name HB1
  )
       ( resid 57 and name HN
  ) 4.3 2.5 0.9 volume=0.159 peak=1114 ppm1=2.109 ppm2=7.973

assign ( resid 43 and name HA
  )
       ( resid 43 and name HN
  ) 4.6 2.8 0.9 volume=0.115 peak=2017 ppm1=4.985 ppm2=7.461

assign ( resid 38 and name HA
  )
       ( resid 38 and name HN
  ) 4.0 2.2 0.8 volume=0.252 peak=1522 ppm1=4.200 ppm2=7.778

assign ( resid 52 and name HN
  )
       ( resid 53 and name HN
  ) 3.0 1.2 0.6 volume=1.375 peak=820 ppm1=7.119 ppm2=7.616

assign ( resid 45 and name HA
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 3.1 1.3 0.6 volume=1.190 peak=1814 ppm1=3.870 ppm2=1.652

assign ( resid 46 and name HB#
  )
       ( resid 46 and name HA
  ) 3.1 1.3 0.6 volume=1.267 peak=1958 ppm1=1.404 ppm2=3.870

assign ( resid 47 and name HN
  )
       ( resid 46 and name HB#
  ) 3.4 1.6 0.7 volume=0.754 peak=416 ppm1=6.974 ppm2=1.408

assign ( resid 40 and name HB#
  )
       ( resid 40 and name HN
  ) 3.3 1.5 0.7 volume=0.895 peak=2106 ppm1=1.146 ppm2=7.745

assign ( resid 36 and name HB2
  )
       ( resid 36 and name HG2
  ) 3.4 1.6 0.7 volume=0.670 peak=2295 ppm1=1.261 ppm2=1.685

assign ( resid 33 and name HN
  )
       ( resid 33 and name HA
  ) 3.9 2.1 0.8 volume=0.304 peak=391 ppm1=8.501 ppm2=5.239

assign ( resid 56 and name HB1
  )
       ( resid 56 and name HD1
  ) 4.0 2.2 0.8 volume=0.256 peak=1486 ppm1=2.115 ppm2=3.570

assign ( resid 51 and name HN
  )
       ( resid 51 and name HG1
  ) 3.5 1.7 0.7 volume=0.636 peak=816 ppm1=8.917 ppm2=2.868

assign ( resid 34 and name HN
  )
       ( resid 34 and name HB2
  ) 3.8 2.0 0.8 volume=0.386 peak=140 ppm1=8.946 ppm2=2.991

assign ( resid 57 and name HB2
  )
       ( resid 57 and name HA
  ) 3.6 1.8 0.7 volume=0.514 peak=1484 ppm1=1.351 ppm2=4.033

assign ( resid 43 and name HN
  )
       ( resid 41 and name HB1
  ) 3.0 1.2 0.6 volume=1.523 peak=267 ppm1=7.454 ppm2=2.645

assign ( resid 54 and name HN
  )
       ( resid 53 and name HG2#
  ) 4.1 2.3 0.8 volume=0.217 peak=518 ppm1=6.904 ppm2=1.115

assign ( resid 48 and name HB1
  or resid 48 and name HB2
  )
       ( resid 48 and name HA
  ) 2.9 1.1 0.6 volume=1.710 peak=1851 ppm1=1.650 ppm2=3.915

assign ( resid 35 and name HN
  )
       ( resid 34 and name HB2
  ) 4.1 2.3 0.8 volume=0.241 peak=392 ppm1=9.451 ppm2=2.997

assign ( resid 32 and name HN
  )
       ( resid 32 and name HB1
  ) 3.6 1.8 0.7 volume=0.513 peak=353 ppm1=7.672 ppm2=2.601

assign ( resid 57 and name HD1#
  )
       ( resid 57 and name HB1
  ) 2.4 0.6 0.5 volume=5.056 peak=2043 ppm1=0.698 ppm2=1.454

assign ( resid 38 and name HN
  )
       ( resid 38 and name HA
  ) 3.3 1.5 0.7 volume=0.895 peak=488 ppm1=7.800 ppm2=4.201

assign ( resid 54 and name HB2
  )
       ( resid 54 and name HE1
  ) 4.6 2.8 0.9 volume=0.120 peak=1802 ppm1=3.078 ppm2=7.848

assign ( resid 35 and name HN
  )
       ( resid 36 and name HN
  ) 4.0 2.2 0.8 volume=0.258 peak=583 ppm1=9.446 ppm2=9.132

assign ( resid 56 and name HG2
  )
       ( resid 56 and name HD1
  ) 3.3 1.5 0.7 volume=0.767 peak=2110 ppm1=1.846 ppm2=3.560

assign ( resid 37 and name HN
  )
       ( resid 37 and name HB1
  ) 3.9 2.1 0.8 volume=0.316 peak=544 ppm1=8.360 ppm2=2.652

assign ( resid 53 and name HG2#
  )
       ( resid 56 and name HA
  ) 4.0 2.2 0.8 volume=0.253 peak=1182 ppm1=1.117 ppm2=4.305

assign ( resid 37 and name HN
  )
       ( resid 38 and name HN
  ) 3.3 1.5 0.7 volume=0.800 peak=736 ppm1=8.355 ppm2=7.811

assign ( resid 39 and name HN
  )
       ( resid 37 and name HB1
  ) 4.7 2.9 0.9 volume=0.096 peak=688 ppm1=8.189 ppm2=2.637

assign ( resid 32 and name HN
  )
       ( resid 40 and name HB#
  ) 3.6 1.8 0.7 volume=0.508 peak=716 ppm1=7.695 ppm2=1.151

assign ( resid 36 and name HN
  )
       ( resid 36 and name HB1
  ) 3.7 1.9 0.7 volume=0.400 peak=588 ppm1=9.115 ppm2=1.088

assign ( resid 39 and name HB2
  )
       ( resid 39 and name HN
  ) 4.1 2.3 0.8 volume=0.220 peak=983 ppm1=1.514 ppm2=8.174

assign ( resid 35 and name HN
  )
       ( resid 35 and name HG1
  or resid 35 and name HG2
  ) 3.4 1.6 0.7 volume=0.653 peak=531 ppm1=9.453 ppm2=1.625

assign ( resid 56 and name HB1
  )
       ( resid 56 and name HD2
  ) 4.2 2.4 0.8 volume=0.207 peak=1044 ppm1=2.112 ppm2=3.628

assign ( resid 45 and name HB#
  )
       ( resid 43 and name HB1
  ) 4.1 2.3 0.8 volume=0.231 peak=1085 ppm1=1.247 ppm2=2.614

assign ( resid 57 and name HA
  )
       ( resid 59 and name HD2
  ) 4.3 2.5 0.9 volume=0.176 peak=1761 ppm1=4.047 ppm2=3.426

assign ( resid 57 and name HN
  )
       ( resid 57 and name HA
  ) 3.1 1.3 0.6 volume=1.298 peak=283 ppm1=7.980 ppm2=4.045

assign ( resid 34 and name HB2
  )
       ( resid 34 and name HN
  ) 4.9 3.1 1.0 volume=0.080 peak=1546 ppm1=2.986 ppm2=8.948

assign ( resid 39 and name HA
  )
       ( resid 39 and name HG2
  or resid 39 and name HG1
  ) 3.5 1.7 0.7 volume=0.631 peak=1965 ppm1=3.790 ppm2=1.093

assign ( resid 47 and name HB2
  )
       ( resid 44 and name HA
  ) 4.8 3.0 1.0 volume=0.085 peak=2129 ppm1=2.181 ppm2=3.382

assign ( resid 56 and name HA
  )
       ( resid 56 and name HG2
  ) 4.3 2.5 0.9 volume=0.170 peak=1361 ppm1=4.284 ppm2=1.856

assign ( resid 46 and name HB#
  )
       ( resid 43 and name HB2
  ) 3.3 1.5 0.7 volume=0.779 peak=1341 ppm1=1.405 ppm2=2.658

assign ( resid 41 and name HE1 or resid 41 and name HE2
  )
       ( resid 50 and name HB1
  ) 3.6 1.8 0.7 volume=0.471 peak=21 ppm1=6.806 ppm2=2.894

assign ( resid 43 and name HB1
  )
       ( resid 43 and name HN
  ) 4.0 2.2 0.8 volume=0.263 peak=974 ppm1=2.609 ppm2=7.450

assign ( resid 56 and name HB2
  )
       ( resid 56 and name HD1
  ) 3.3 1.5 0.7 volume=0.783 peak=2270 ppm1=1.673 ppm2=3.563

assign ( resid 35 and name HA
  )
       ( resid 37 and name HN
  ) 3.9 2.1 0.8 volume=0.309 peak=1613 ppm1=4.038 ppm2=8.361

assign ( resid 50 and name HN
  )
       ( resid 49 and name HB#
  ) 3.2 1.4 0.6 volume=0.990 peak=638 ppm1=7.433 ppm2=1.219

assign ( resid 41 and name HN
  )
       ( resid 33 and name HA
  ) 4.0 2.2 0.8 volume=0.252 peak=774 ppm1=8.784 ppm2=5.226

assign ( resid 51 and name HG2
  )
       ( resid 51 and name HB1
  ) 3.7 1.9 0.7 volume=0.430 peak=1529 ppm1=3.043 ppm2=2.269

assign ( resid 37 and name HN
  )
       ( resid 39 and name HN
  ) 3.9 2.1 0.8 volume=0.288 peak=741 ppm1=8.362 ppm2=8.156

assign ( resid 33 and name HN
  )
       ( resid 32 and name HB1
  ) 3.4 1.6 0.7 volume=0.658 peak=491 ppm1=8.497 ppm2=2.603

assign ( resid 37 and name HN
  )
       ( resid 34 and name HB1
  ) 3.4 1.6 0.7 volume=0.681 peak=475 ppm1=8.359 ppm2=3.310

assign ( resid 40 and name HB#
  )
       ( resid 41 and name HN
  ) 3.9 2.1 0.8 volume=0.325 peak=1419 ppm1=1.146 ppm2=8.772

assign ( resid 50 and name HB2
  )
       ( resid 51 and name HN
  ) 4.5 2.7 0.9 volume=0.130 peak=1157 ppm1=2.979 ppm2=8.910

assign ( resid 36 and name HG1
  )
       ( resid 36 and name HG2
  ) 2.6 0.8 0.5 volume=3.597 peak=2089 ppm1=1.649 ppm2=1.684

assign ( resid 33 and name HA
  )
       ( resid 33 and name HB1
  or resid 33 and name HB2
  ) 3.9 2.1 0.8 volume=0.318 peak=984 ppm1=5.231 ppm2=3.500

assign ( resid 43 and name HB1
  )
       ( resid 46 and name HB#
  ) 3.6 1.8 0.7 volume=0.494 peak=2265 ppm1=2.604 ppm2=1.403

assign ( resid 47 and name HN
  )
       ( resid 41 and name HB2
  ) 3.9 2.1 0.8 volume=0.305 peak=554 ppm1=6.978 ppm2=2.616

assign ( resid 39 and name HB1
  )
       ( resid 39 and name HB2
  ) 3.4 1.6 0.7 volume=0.675 peak=1917 ppm1=1.034 ppm2=1.513

assign ( resid 33 and name HN
  )
       ( resid 33 and name HB1
  or resid 33 and name HB2
  ) 3.2 1.4 0.6 volume=0.954 peak=513 ppm1=8.492 ppm2=3.487

assign ( resid 54 and name HN
  )
       ( resid 52 and name HN
  ) 3.4 1.6 0.7 volume=0.719 peak=553 ppm1=6.907 ppm2=7.112

assign ( resid 46 and name HA
  )
       ( resid 46 and name HN
  ) 3.0 1.2 0.6 volume=1.370 peak=1934 ppm1=3.874 ppm2=7.710

assign ( resid 52 and name HA
  )
       ( resid 52 and name HG1
  ) 3.1 1.3 0.6 volume=1.203 peak=1927 ppm1=4.005 ppm2=1.400

assign ( resid 45 and name HN
  )
       ( resid 44 and name HA
  ) 3.7 1.9 0.7 volume=0.387 peak=861 ppm1=7.870 ppm2=3.375

assign ( resid 51 and name HG1
  )
       ( resid 51 and name HN
  ) 4.2 2.4 0.8 volume=0.210 peak=910 ppm1=2.859 ppm2=8.914

assign ( resid 45 and name HN
  )
       ( resid 45 and name HA
  ) 3.5 1.7 0.7 volume=0.601 peak=834 ppm1=7.871 ppm2=3.893

assign ( resid 47 and name HN
  )
       ( resid 45 and name HN
  ) 3.9 2.1 0.8 volume=0.285 peak=826 ppm1=6.973 ppm2=7.866

assign ( resid 47 and name HN
  )
       ( resid 48 and name HN
  ) 3.1 1.3 0.6 volume=1.160 peak=706 ppm1=6.978 ppm2=7.726

assign ( resid 56 and name HD1
  )
       ( resid 56 and name HB1
  ) 3.9 2.1 0.8 volume=0.283 peak=883 ppm1=3.557 ppm2=2.110

assign ( resid 36 and name HN
  )
       ( resid 37 and name HN
  ) 3.4 1.6 0.7 volume=0.757 peak=407 ppm1=9.115 ppm2=8.358

assign ( resid 51 and name HA
  )
       ( resid 51 and name HB1
  ) 4.2 2.4 0.8 volume=0.191 peak=1852 ppm1=3.831 ppm2=2.270

assign ( resid 53 and name HN
  )
       ( resid 53 and name HG2#
  ) 3.1 1.3 0.6 volume=1.201 peak=711 ppm1=7.592 ppm2=1.109

assign ( resid 56 and name HD1
  )
       ( resid 56 and name HG2
  ) 3.2 1.4 0.6 volume=1.011 peak=1507 ppm1=3.559 ppm2=1.850

assign ( resid 46 and name HN
  )
       ( resid 43 and name HB2
  ) 3.6 1.8 0.7 volume=0.485 peak=354 ppm1=7.709 ppm2=2.658

assign ( resid 50 and name HN
  )
       ( resid 52 and name HN
  ) 3.9 2.1 0.8 volume=0.290 peak=501 ppm1=7.430 ppm2=7.119

assign ( resid 41 and name HN
  )
       ( resid 41 and name HB2
  ) 3.8 2.0 0.8 volume=0.358 peak=538 ppm1=8.770 ppm2=2.609

assign ( resid 51 and name HN
  )
       ( resid 51 and name HG2
  ) 3.5 1.7 0.7 volume=0.590 peak=795 ppm1=8.918 ppm2=3.025

assign ( resid 52 and name HA
  )
       ( resid 52 and name HN
  ) 3.4 1.6 0.7 volume=0.699 peak=1223 ppm1=4.004 ppm2=7.117

assign ( resid 46 and name HB#
  )
       ( resid 47 and name HN
  ) 3.7 1.9 0.7 volume=0.399 peak=1734 ppm1=1.406 ppm2=6.976

assign ( resid 45 and name HB#
  )
       ( resid 43 and name HB2
  ) 4.0 2.2 0.8 volume=0.258 peak=2233 ppm1=1.245 ppm2=2.652

assign ( resid 45 and name HA
  )
       ( resid 45 and name HN
  ) 3.5 1.7 0.7 volume=0.598 peak=2168 ppm1=3.874 ppm2=7.846

assign ( resid 54 and name HB2
  )
       ( resid 54 and name HN
  ) 3.8 2.0 0.8 volume=0.357 peak=1672 ppm1=3.062 ppm2=6.921

assign ( resid 47 and name HB2
  )
       ( resid 47 and name HN
  ) 4.3 2.5 0.9 volume=0.164 peak=1052 ppm1=2.182 ppm2=6.985

assign ( resid 33 and name HA
  )
       ( resid 33 and name HN
  ) 4.6 2.8 0.9 volume=0.107 peak=2192 ppm1=5.239 ppm2=8.477

assign ( resid 57 and name HN
  )
       ( resid 57 and name HB1
  ) 2.8 1.0 0.6 volume=2.349 peak=397 ppm1=7.976 ppm2=1.427

assign ( resid 53 and name HN
  )
       ( resid 52 and name HB2
  or resid 52 and name HB1
  ) 3.5 1.7 0.7 volume=0.550 peak=484 ppm1=7.594 ppm2=1.756

assign ( resid 53 and name HN
  )
       ( resid 53 and name HA
  ) 3.1 1.3 0.6 volume=1.287 peak=611 ppm1=7.592 ppm2=3.997

assign ( resid 56 and name HD2
  )
       ( resid 56 and name HG2
  ) 3.4 1.6 0.7 volume=0.756 peak=1756 ppm1=3.639 ppm2=1.851

assign ( resid 50 and name HN
  )
       ( resid 49 and name HN
  ) 3.3 1.5 0.7 volume=0.870 peak=799 ppm1=7.430 ppm2=7.697

assign ( resid 57 and name HD1#
  )
       ( resid 57 and name HB2
  ) 2.4 0.6 0.5 volume=5.594 peak=1178 ppm1=0.699 ppm2=1.364

assign ( resid 40 and name HB#
  )
       ( resid 33 and name HA
  ) 4.4 2.6 0.9 volume=0.151 peak=1518 ppm1=1.149 ppm2=5.233

assign ( resid 39 and name HN
  )
       ( resid 34 and name HN
  ) 4.3 2.5 0.9 volume=0.174 peak=166 ppm1=8.176 ppm2=8.940

assign ( resid 48 and name HA
  )
       ( resid 51 and name HB2
  ) 3.4 1.6 0.7 volume=0.694 peak=2074 ppm1=3.928 ppm2=1.966

assign ( resid 53 and name HA
  )
       ( resid 53 and name HG2#
  ) 3.1 1.3 0.6 volume=1.325 peak=975 ppm1=3.996 ppm2=1.119

assign ( resid 49 and name HB#
  )
       ( resid 49 and name HA
  ) 2.6 0.8 0.5 volume=3.330 peak=1983 ppm1=1.222 ppm2=3.873

assign ( resid 47 and name HB1
  )
       ( resid 44 and name HA
  ) 4.3 2.5 0.9 volume=0.180 peak=1276 ppm1=2.843 ppm2=3.375

assign ( resid 57 and name HB2
  )
       ( resid 57 and name HD1#
  ) 2.7 0.9 0.5 volume=2.748 peak=1961 ppm1=1.352 ppm2=0.705

assign ( resid 37 and name HB2
  )
       ( resid 54 and name HE1
  ) 3.2 1.4 0.6 volume=1.049 peak=2117 ppm1=3.302 ppm2=7.847

assign ( resid 33 and name HN
  )
       ( resid 41 and name HN
  ) 4.0 2.2 0.8 volume=0.253 peak=454 ppm1=8.499 ppm2=8.763

assign ( resid 58 and name HN
  )
       ( resid 57 and name HA
  ) 2.9 1.1 0.6 volume=1.823 peak=633 ppm1=7.936 ppm2=4.042

assign ( resid 51 and name HA
  )
       ( resid 51 and name HG1
  ) 4.2 2.4 0.8 volume=0.189 peak=1246 ppm1=3.829 ppm2=2.861

assign ( resid 57 and name HA
  )
       ( resid 58 and name HN
  ) 3.2 1.4 0.6 volume=1.017 peak=969 ppm1=4.043 ppm2=7.926

assign ( resid 57 and name HN
  )
       ( resid 57 and name HD1#
  ) 3.5 1.7 0.7 volume=0.565 peak=492 ppm1=7.976 ppm2=0.725

assign ( resid 58 and name HN
  )
       ( resid 57 and name HB1
  ) 2.9 1.1 0.6 volume=1.773 peak=459 ppm1=7.941 ppm2=1.428

assign ( resid 46 and name HB#
  )
       ( resid 41 and name HE1 or resid 41 and name HE2
  ) 4.0 2.2 0.8 volume=0.249 peak=2132 ppm1=1.406 ppm2=6.811

assign ( resid 54 and name HN
  )
       ( resid 54 and name HB1
  ) 3.3 1.5 0.7 volume=0.883 peak=847 ppm1=6.900 ppm2=2.901

assign ( resid 47 and name HN
  )
       ( resid 47 and name HB2
  ) 3.6 1.8 0.7 volume=0.512 peak=779 ppm1=6.977 ppm2=2.180

assign ( resid 56 and name HB1
  )
       ( resid 56 and name HG1
  ) 2.8 1.0 0.6 volume=2.262 peak=2301 ppm1=2.112 ppm2=1.805

assign ( resid 43 and name HA
  )
       ( resid 43 and name HB2
  ) 4.1 2.3 0.8 volume=0.223 peak=1477 ppm1=4.991 ppm2=2.656

assign ( resid 51 and name HG1
  )
       ( resid 51 and name HA
  ) 4.0 2.2 0.8 volume=0.271 peak=1115 ppm1=2.869 ppm2=3.833

assign ( resid 51 and name HN
  )
       ( resid 50 and name HB1
  ) 3.5 1.7 0.7 volume=0.622 peak=622 ppm1=8.917 ppm2=2.897

assign ( resid 50 and name HB2
  )
       ( resid 49 and name HB#
  ) 4.3 2.5 0.9 volume=0.161 peak=1979 ppm1=2.982 ppm2=1.197

assign ( resid 37 and name HB1
  )
       ( resid 37 and name HA
  ) 4.3 2.5 0.9 volume=0.175 peak=2099 ppm1=2.648 ppm2=4.987

assign ( resid 41 and name HB2
  )
       ( resid 41 and name HN
  ) 4.7 2.9 0.9 volume=0.097 peak=1415 ppm1=2.604 ppm2=8.776

assign ( resid 57 and name HB2
  )
       ( resid 57 and name HD2#
  ) 2.7 0.9 0.5 volume=2.872 peak=1238 ppm1=1.352 ppm2=0.745

assign ( resid 54 and name HN
  )
       ( resid 53 and name HN
  ) 3.3 1.5 0.7 volume=0.904 peak=511 ppm1=6.901 ppm2=7.592

assign ( resid 47 and name HB1
  )
       ( resid 41 and name HB2
  ) 3.7 1.9 0.7 volume=0.426 peak=1471 ppm1=2.837 ppm2=2.616

assign ( resid 35 and name HN
  )
       ( resid 35 and name HA
  ) 3.8 2.0 0.8 volume=0.371 peak=862 ppm1=9.457 ppm2=4.010

assign ( resid 45 and name HA
  )
       ( resid 48 and name HN
  ) 2.9 1.1 0.6 volume=1.680 peak=1668 ppm1=3.873 ppm2=7.729

assign ( resid 54 and name HE1
  )
       ( resid 36 and name HG1
  ) 3.5 1.7 0.7 volume=0.591 peak=49 ppm1=7.846 ppm2=1.647

assign ( resid 37 and name HN
  )
       ( resid 36 and name HG1
  ) 3.4 1.6 0.7 volume=0.734 peak=274 ppm1=8.360 ppm2=1.655

assign ( resid 36 and name HA
  )
       ( resid 36 and name HN
  ) 4.3 2.5 0.9 volume=0.179 peak=1194 ppm1=4.270 ppm2=9.117

assign ( resid 34 and name HB2
  )
       ( resid 39 and name HN
  ) 4.8 3.0 1.0 volume=0.088 peak=2159 ppm1=2.992 ppm2=8.184

assign ( resid 46 and name HA
  )
       ( resid 47 and name HN
  ) 4.2 2.4 0.8 volume=0.184 peak=1809 ppm1=3.867 ppm2=6.977

assign ( resid 43 and name HN
  )
       ( resid 41 and name HA
  ) 3.1 1.3 0.6 volume=1.192 peak=613 ppm1=7.452 ppm2=4.588

assign ( resid 58 and name HN
  )
       ( resid 57 and name HD1#
  ) 3.7 1.9 0.7 volume=0.433 peak=539 ppm1=7.937 ppm2=0.728

assign ( resid 49 and name HB#
  )
       ( resid 49 and name HN
  ) 2.8 1.0 0.6 volume=2.430 peak=2030 ppm1=1.224 ppm2=7.702

assign ( resid 44 and name HA
  )
       ( resid 48 and name HN
  ) 4.5 2.7 0.9 volume=0.131 peak=1962 ppm1=3.376 ppm2=7.739

assign ( resid 49 and name HN
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 3.0 1.2 0.6 volume=1.376 peak=427 ppm1=7.698 ppm2=1.647

assign ( resid 36 and name HN
  )
       ( resid 35 and name HN
  ) 3.9 2.1 0.8 volume=0.292 peak=119 ppm1=9.116 ppm2=9.448

assign ( resid 39 and name HA
  )
       ( resid 39 and name HB1
  ) 3.6 1.8 0.7 volume=0.526 peak=1767 ppm1=3.786 ppm2=1.032

assign ( resid 48 and name HN
  )
       ( resid 48 and name HA
  ) 3.2 1.4 0.6 volume=1.056 peak=522 ppm1=7.729 ppm2=3.907

assign ( resid 46 and name HN
  )
       ( resid 45 and name HN
  ) 2.8 1.0 0.6 volume=2.045 peak=745 ppm1=7.712 ppm2=7.835

assign ( resid 47 and name HN
  )
       ( resid 47 and name HA
  ) 3.6 1.8 0.7 volume=0.500 peak=247 ppm1=6.973 ppm2=3.895

assign ( resid 37 and name HA
  )
       ( resid 39 and name HN
  ) 4.3 2.5 0.9 volume=0.179 peak=1925 ppm1=5.003 ppm2=8.181

assign ( resid 57 and name HD1#
  )
       ( resid 57 and name HA
  ) 2.9 1.1 0.6 volume=1.706 peak=925 ppm1=0.700 ppm2=4.048

assign ( resid 53 and name HA
  )
       ( resid 59 and name HB2
  ) 3.9 2.1 0.8 volume=0.283 peak=1271 ppm1=3.998 ppm2=0.972

assign ( resid 51 and name HG2
  )
       ( resid 51 and name HN
  ) 4.5 2.7 0.9 volume=0.132 peak=1093 ppm1=3.042 ppm2=8.919

assign ( resid 34 and name HN
  )
       ( resid 39 and name HN
  ) 4.4 2.6 0.9 volume=0.139 peak=827 ppm1=8.939 ppm2=8.179

assign ( resid 54 and name HE1
  )
       ( resid 37 and name HB1
  ) 3.4 1.6 0.7 volume=0.643 peak=37 ppm1=7.847 ppm2=2.646

assign ( resid 46 and name HA
  )
       ( resid 43 and name HB2
  ) 4.2 2.4 0.8 volume=0.198 peak=2234 ppm1=3.876 ppm2=2.649

assign ( resid 57 and name HB2
  )
       ( resid 57 and name HN
  ) 3.7 1.9 0.7 volume=0.406 peak=1409 ppm1=1.352 ppm2=7.972

assign ( resid 37 and name HA
  )
       ( resid 38 and name HN
  ) 3.3 1.5 0.7 volume=0.843 peak=962 ppm1=5.001 ppm2=7.803

assign ( resid 41 and name HN
  )
       ( resid 41 and name HD1 or resid 41 and name HD2
  ) 3.7 1.9 0.7 volume=0.403 peak=690 ppm1=8.776 ppm2=7.169

assign ( resid 36 and name HB2
  )
       ( resid 36 and name HG1
  ) 3.4 1.6 0.7 volume=0.708 peak=2019 ppm1=1.263 ppm2=1.647

assign ( resid 56 and name HD2
  )
       ( resid 56 and name HB1
  ) 4.1 2.3 0.8 volume=0.227 peak=1022 ppm1=3.639 ppm2=2.112

assign ( resid 38 and name HB1
  )
       ( resid 38 and name HB2
  ) 3.4 1.6 0.7 volume=0.676 peak=2277 ppm1=3.885 ppm2=4.048

assign ( resid 46 and name HB#
  )
       ( resid 47 and name HB2
  ) 4.3 2.5 0.9 volume=0.180 peak=1348 ppm1=1.405 ppm2=2.229

assign ( resid 56 and name HB2
  )
       ( resid 56 and name HA
  ) 4.1 2.3 0.8 volume=0.222 peak=1000 ppm1=1.685 ppm2=4.263

assign ( resid 54 and name HN
  )
       ( resid 54 and name HA
  ) 3.6 1.8 0.7 volume=0.530 peak=405 ppm1=6.905 ppm2=4.434

assign ( resid 36 and name HN
  )
       ( resid 36 and name HG2
  ) 3.4 1.6 0.7 volume=0.646 peak=257 ppm1=9.118 ppm2=1.688

assign ( resid 33 and name HB2
  )
       ( resid 40 and name HB#
  ) 3.5 1.7 0.7 volume=0.551 peak=1132 ppm1=3.492 ppm2=1.134

assign ( resid 37 and name HB1
  )
       ( resid 37 and name HB2
  ) 3.5 1.7 0.7 volume=0.625 peak=1988 ppm1=2.649 ppm2=3.302

assign ( resid 37 and name HB1
  )
       ( resid 37 and name HN
  ) 4.5 2.7 0.9 volume=0.126 peak=2207 ppm1=2.633 ppm2=8.360

assign ( resid 57 and name HB2
  )
       ( resid 57 and name HB1
  ) 2.4 0.6 0.5 volume=5.264 peak=1170 ppm1=1.351 ppm2=1.456

assign ( resid 44 and name HA
  )
       ( resid 32 and name HB1
  ) 4.7 2.9 0.9 volume=0.103 peak=1017 ppm1=3.382 ppm2=2.587

assign ( resid 37 and name HN
  )
       ( resid 37 and name HB2
  ) 3.5 1.7 0.7 volume=0.561 peak=476 ppm1=8.360 ppm2=3.289

assign ( resid 39 and name HN
  )
       ( resid 34 and name HB2
  ) 4.0 2.2 0.8 volume=0.266 peak=203 ppm1=8.179 ppm2=2.980

assign ( resid 54 and name HB1
  )
       ( resid 54 and name HN
  ) 4.0 2.2 0.8 volume=0.258 peak=2053 ppm1=2.904 ppm2=6.907

assign ( resid 53 and name HB
  )
       ( resid 53 and name HG2#
  ) 3.1 1.3 0.6 volume=1.218 peak=1752 ppm1=3.995 ppm2=1.118

assign ( resid 56 and name HB1
  )
       ( resid 56 and name HG2
  ) 2.8 1.0 0.6 volume=2.110 peak=1572 ppm1=2.115 ppm2=1.849

assign ( resid 56 and name HA
  )
       ( resid 56 and name HB1
  ) 3.5 1.7 0.7 volume=0.580 peak=2083 ppm1=4.285 ppm2=2.112

assign ( resid 50 and name HB2
  )
       ( resid 50 and name HN
  ) 3.9 2.1 0.8 volume=0.292 peak=1855 ppm1=2.987 ppm2=7.436

assign ( resid 50 and name HB2
  )
       ( resid 50 and name HD2
  ) 3.5 1.7 0.7 volume=0.552 peak=1649 ppm1=2.985 ppm2=6.614

assign ( resid 37 and name HN
  )
       ( resid 36 and name HN
  ) 3.3 1.5 0.7 volume=0.833 peak=592 ppm1=8.361 ppm2=9.113

assign ( resid 47 and name HB1
  )
       ( resid 32 and name HB1
  ) 3.7 1.9 0.7 volume=0.407 peak=1011 ppm1=2.840 ppm2=2.589

assign ( resid 50 and name HB1
  )
       ( resid 50 and name HD2
  ) 4.1 2.3 0.8 volume=0.235 peak=943 ppm1=2.897 ppm2=6.615

assign ( resid 46 and name HN
  )
       ( resid 46 and name HA
  ) 3.1 1.3 0.6 volume=1.226 peak=812 ppm1=7.710 ppm2=3.869

assign ( resid 51 and name HG1
  )
       ( resid 51 and name HG2
  ) 3.1 1.3 0.6 volume=1.132 peak=1497 ppm1=2.862 ppm2=3.041

assign ( resid 36 and name HB1
  )
       ( resid 36 and name HN
  ) 4.2 2.4 0.8 volume=0.186 peak=2279 ppm1=1.070 ppm2=9.107

assign ( resid 38 and name HB2
  )
       ( resid 38 and name HB1
  ) 3.2 1.4 0.6 volume=0.935 peak=1816 ppm1=4.053 ppm2=3.888

assign ( resid 57 and name HA
  )
       ( resid 57 and name HD2#
  ) 3.0 1.2 0.6 volume=1.553 peak=2252 ppm1=4.040 ppm2=0.741

assign ( resid 36 and name HG2
  )
       ( resid 36 and name HB2
  ) 3.6 1.8 0.7 volume=0.516 peak=1978 ppm1=1.685 ppm2=1.259

assign ( resid 34 and name HN
  )
       ( resid 33 and name HB1
  or resid 33 and name HB2
  ) 3.7 1.9 0.7 volume=0.396 peak=675 ppm1=8.951 ppm2=3.484

assign ( resid 48 and name HN
  )
       ( resid 47 and name HB1
  ) 3.3 1.5 0.7 volume=0.865 peak=599 ppm1=7.725 ppm2=2.834

assign ( resid 53 and name HB
  )
       ( resid 59 and name HB1
  ) 4.0 2.2 0.8 volume=0.250 peak=2033 ppm1=3.999 ppm2=0.921

assign ( resid 50 and name HN
  )
       ( resid 50 and name HB2
  ) 3.1 1.3 0.6 volume=1.256 peak=652 ppm1=7.435 ppm2=2.991

assign ( resid 37 and name HN
  )
       ( resid 34 and name HB2
  ) 4.0 2.2 0.8 volume=0.249 peak=347 ppm1=8.361 ppm2=2.999

assign ( resid 34 and name HN
  )
       ( resid 34 and name HB1
  ) 3.7 1.9 0.7 volume=0.408 peak=258 ppm1=8.946 ppm2=3.307

assign ( resid 48 and name HB1
  or resid 48 and name HB2
  )
       ( resid 45 and name HB#
  ) 2.5 0.7 0.5 volume=4.231 peak=1928 ppm1=1.645 ppm2=1.256

assign ( resid 47 and name HB1
  )
       ( resid 48 and name HN
  ) 4.0 2.2 0.8 volume=0.249 peak=1577 ppm1=2.834 ppm2=7.725

assign ( resid 52 and name HN
  )
       ( resid 52 and name HA
  ) 3.1 1.3 0.6 volume=1.108 peak=781 ppm1=7.115 ppm2=4.000

assign ( resid 39 and name HN
  )
       ( resid 39 and name HB2
  ) 3.5 1.7 0.7 volume=0.582 peak=555 ppm1=8.184 ppm2=1.520

assign ( resid 45 and name HN
  )
       ( resid 46 and name HB#
  ) 3.2 1.4 0.6 volume=1.023 peak=349 ppm1=7.871 ppm2=1.410

assign ( resid 48 and name HA
  )
       ( resid 48 and name HB1
  or resid 48 and name HB2
  ) 2.5 0.7 0.5 volume=4.635 peak=1951 ppm1=3.916 ppm2=1.650

assign ( resid 50 and name HA
  )
       ( resid 53 and name HG2#
  ) 3.9 2.1 0.8 volume=0.315 peak=1777 ppm1=4.161 ppm2=1.126

assign ( resid 41 and name HD1 or resid 41 and name HD2
  )
       ( resid 50 and name HB2
  ) 3.9 2.1 0.8 volume=0.310 peak=31 ppm1=7.183 ppm2=2.988

assign ( resid 38 and name HN
  )
       ( resid 38 and name HB2
  ) 3.5 1.7 0.7 volume=0.556 peak=589 ppm1=7.799 ppm2=4.043

assign ( resid 57 and name HD2#
  )
       ( resid 58 and name HN
  ) 3.8 2.0 0.8 volume=0.347 peak=2163 ppm1=0.747 ppm2=7.939

assign ( resid 45 and name HB#
  )
       ( resid 45 and name HA
  ) 2.7 0.9 0.5 volume=2.814 peak=1112 ppm1=1.248 ppm2=3.871

assign ( resid 57 and name HB1
  )
       ( resid 57 and name HA
  ) 3.8 2.0 0.8 volume=0.362 peak=2208 ppm1=1.450 ppm2=4.030

assign ( resid 36 and name HN
  )
       ( resid 36 and name HA
  ) 3.5 1.7 0.7 volume=0.610 peak=344 ppm1=9.119 ppm2=4.268

assign ( resid 56 and name HB2
  )
       ( resid 56 and name HB1
  ) 2.7 0.9 0.5 volume=2.544 peak=2115 ppm1=1.690 ppm2=2.111

assign ( resid 36 and name HG1
  )
       ( resid 36 and name HN
  ) 4.1 2.3 0.8 volume=0.236 peak=1702 ppm1=1.648 ppm2=9.116

assign ( resid 52 and name HA
  )
       ( resid 52 and name HG2
  ) 3.0 1.2 0.6 volume=1.532 peak=1314 ppm1=4.006 ppm2=1.519

assign ( resid 36 and name HB1
  )
       ( resid 36 and name HA
  ) 4.8 3.0 1.0 volume=0.089 peak=2198 ppm1=1.071 ppm2=4.255

assign ( resid 38 and name HN
  )
       ( resid 37 and name HA
  ) 3.7 1.9 0.7 volume=0.420 peak=474 ppm1=7.801 ppm2=4.988

assign ( resid 38 and name HN
  )
       ( resid 38 and name HB1
  ) 3.9 2.1 0.8 volume=0.316 peak=563 ppm1=7.799 ppm2=3.874

assign ( resid 57 and name HA
  )
       ( resid 57 and name HN
  ) 3.2 1.4 0.6 volume=1.017 peak=1329 ppm1=4.042 ppm2=7.969

assign ( resid 48 and name HN
  )
       ( resid 47 and name HN
  ) 3.4 1.6 0.7 volume=0.719 peak=792 ppm1=7.729 ppm2=6.973

assign ( resid 46 and name HB#
  )
       ( resid 41 and name HD1 or resid 41 and name HD2
  ) 3.6 1.8 0.7 volume=0.484 peak=1912 ppm1=1.405 ppm2=7.165

assign ( resid 43 and name HN
  )
       ( resid 46 and name HB#
  ) 3.1 1.3 0.6 volume=1.215 peak=851 ppm1=7.451 ppm2=1.401

assign ( resid 34 and name HN
  )
       ( resid 40 and name HA
  ) 4.2 2.4 0.8 volume=0.187 peak=157 ppm1=8.950 ppm2=4.912

assign ( resid 54 and name HN
  )
       ( resid 51 and name HA
  ) 3.4 1.6 0.7 volume=0.700 peak=783 ppm1=6.906 ppm2=3.836

assign ( resid 35 and name HG1
  or resid 35 and name HG2
  )
       ( resid 36 and name HN
  ) 4.7 2.9 0.9 volume=0.099 peak=1374 ppm1=1.615 ppm2=9.119

assign ( resid 53 and name HA
  )
       ( resid 53 and name HN
  ) 4.3 2.5 0.9 volume=0.181 peak=1487 ppm1=3.998 ppm2=7.550

assign ( resid 50 and name HD2
  )
       ( resid 51 and name HA
  ) 3.7 1.9 0.7 volume=0.419 peak=13 ppm1=6.606 ppm2=3.836

assign ( resid 49 and name HA
  )
       ( resid 52 and name HN
  ) 4.3 2.5 0.9 volume=0.177 peak=2189 ppm1=3.876 ppm2=7.123

assign ( resid 36 and name HG1
  )
       ( resid 54 and name HE1
  ) 4.8 3.0 1.0 volume=0.085 peak=2075 ppm1=1.647 ppm2=7.844

assign ( resid 40 and name HN
  )
       ( resid 39 and name HB2
  ) 3.7 1.9 0.7 volume=0.405 peak=312 ppm1=7.735 ppm2=1.525

assign ( resid 39 and name HA
  )
       ( resid 39 and name HN
  ) 4.3 2.5 0.9 volume=0.176 peak=1184 ppm1=3.786 ppm2=8.186

assign ( resid 41 and name HE1 or resid 41 and name HE2
  )
       ( resid 50 and name HB2
  ) 3.7 1.9 0.7 volume=0.387 peak=8 ppm1=6.810 ppm2=2.990

assign ( resid 57 and name HA
  )
       ( resid 57 and name HD1#
  ) 2.9 1.1 0.6 volume=1.797 peak=2127 ppm1=4.040 ppm2=0.708

assign ( resid 47 and name HB2
  )
       ( resid 48 and name HN
  ) 4.5 2.7 0.9 volume=0.121 peak=2029 ppm1=2.184 ppm2=7.715

assign ( resid 57 and name HD1#
  )
       ( resid 58 and name HN
  ) 3.7 1.9 0.7 volume=0.439 peak=1199 ppm1=0.702 ppm2=7.938

assign ( resid 46 and name HN
  )
       ( resid 47 and name HN
  ) 3.5 1.7 0.7 volume=0.592 peak=307 ppm1=7.706 ppm2=6.972

assign ( resid 50 and name HB2
  )
       ( resid 41 and name HE1 or resid 41 and name HE2
  ) 3.9 2.1 0.8 volume=0.300 peak=1584 ppm1=2.989 ppm2=6.812

assign ( resid 36 and name HG2
  )
       ( resid 36 and name HB1
  ) 3.4 1.6 0.7 volume=0.659 peak=2170 ppm1=1.684 ppm2=1.077

assign ( resid 51 and name HG1
  )
       ( resid 51 and name HB1
  ) 3.5 1.7 0.7 volume=0.607 peak=1064 ppm1=2.853 ppm2=2.270

assign ( resid 34 and name HB1
  )
       ( resid 34 and name HB2
  ) 3.9 2.1 0.8 volume=0.295 peak=1362 ppm1=3.306 ppm2=2.993

assign ( resid 40 and name HB#
  )
       ( resid 32 and name HN
  ) 3.3 1.5 0.7 volume=0.772 peak=2054 ppm1=1.145 ppm2=7.672

assign ( resid 36 and name HG2
  )
       ( resid 36 and name HG1
  ) 2.7 0.9 0.5 volume=2.840 peak=1468 ppm1=1.684 ppm2=1.648

assign ( resid 56 and name HG1
  )
       ( resid 56 and name HB1
  ) 2.9 1.1 0.6 volume=1.818 peak=976 ppm1=1.799 ppm2=2.100

assign ( resid 47 and name HN
  )
       ( resid 46 and name HN
  ) 3.1 1.3 0.6 volume=1.160 peak=561 ppm1=6.978 ppm2=7.704

assign ( resid 40 and name HN
  )
       ( resid 40 and name HB#
  ) 3.0 1.2 0.6 volume=1.474 peak=545 ppm1=7.739 ppm2=1.139

assign ( resid 33 and name HB1
  or resid 33 and name HB2
  )
       ( resid 33 and name HN
  ) 3.8 2.0 0.8 volume=0.344 peak=2139 ppm1=3.494 ppm2=8.495

assign ( resid 43 and name HN
  )
       ( resid 41 and name HB2
  ) 3.0 1.2 0.6 volume=1.581 peak=339 ppm1=7.454 ppm2=2.615

assign ( resid 53 and name HG2#
  )
       ( resid 50 and name HA
  ) 3.6 1.8 0.7 volume=0.526 peak=1942 ppm1=1.116 ppm2=4.159

assign ( resid 49 and name HN
  )
       ( resid 46 and name HA
  ) 2.8 1.0 0.6 volume=2.061 peak=733 ppm1=7.697 ppm2=3.872

assign ( resid 49 and name HN
  )
       ( resid 50 and name HN
  ) 3.3 1.5 0.7 volume=0.864 peak=226 ppm1=7.701 ppm2=7.442

assign ( resid 51 and name HN
  )
       ( resid 50 and name HB2
  ) 3.5 1.7 0.7 volume=0.573 peak=608 ppm1=8.920 ppm2=2.990

assign ( resid 39 and name HB1
  )
       ( resid 39 and name HA
  ) 4.3 2.5 0.9 volume=0.174 peak=1531 ppm1=1.030 ppm2=3.787

assign ( resid 52 and name HN
  )
       ( resid 49 and name HA
  ) 3.4 1.6 0.7 volume=0.690 peak=870 ppm1=7.117 ppm2=3.863

assign ( resid 36 and name HG1
  )
       ( resid 54 and name HB2
  ) 4.7 2.9 0.9 volume=0.099 peak=1545 ppm1=1.648 ppm2=3.088

assign ( resid 57 and name HB1
  )
       ( resid 57 and name HD2#
  ) 2.7 0.9 0.5 volume=2.734 peak=2290 ppm1=1.453 ppm2=0.745

assign ( resid 56 and name HB2
  )
       ( resid 57 and name HN
  ) 3.6 1.8 0.7 volume=0.496 peak=2214 ppm1=1.669 ppm2=7.973

assign ( resid 51 and name HA
  )
       ( resid 52 and name HN
  ) 4.0 2.2 0.8 volume=0.253 peak=1972 ppm1=3.825 ppm2=7.098

assign ( resid 38 and name HN
  )
       ( resid 39 and name HN
  ) 3.9 2.1 0.8 volume=0.314 peak=198 ppm1=7.801 ppm2=8.174

assign ( resid 34 and name HN
  )
       ( resid 34 and name HA
  ) 4.0 2.2 0.8 volume=0.283 peak=871 ppm1=8.947 ppm2=4.285

assign ( resid 56 and name HD2
  )
       ( resid 56 and name HG1
  ) 3.3 1.5 0.7 volume=0.871 peak=2107 ppm1=3.639 ppm2=1.801

assign ( resid 34 and name HB2
  )
       ( resid 34 and name HB1
  ) 4.1 2.3 0.8 volume=0.233 peak=1001 ppm1=2.983 ppm2=3.307

assign ( resid 50 and name HN
  )
       ( resid 50 and name HA
  ) 3.4 1.6 0.7 volume=0.660 peak=189 ppm1=7.434 ppm2=4.161

assign ( resid 41 and name HD1 or resid 41 and name HD2
  )
       ( resid 41 and name HB1
  ) 3.7 1.9 0.7 volume=0.390 peak=57 ppm1=7.187 ppm2=2.666

assign ( resid 44 and name HA
  )
       ( resid 47 and name HB2
  ) 4.6 2.8 0.9 volume=0.111 peak=2254 ppm1=3.373 ppm2=2.172

assign ( resid 53 and name HG2#
  )
       ( resid 52 and name HB2
  or resid 52 and name HB1
  ) 3.7 1.9 0.7 volume=0.399 peak=1453 ppm1=1.114 ppm2=1.765

assign ( resid 40 and name HA
  )
       ( resid 41 and name HN
  ) 4.6 2.8 0.9 volume=0.112 peak=1384 ppm1=4.914 ppm2=8.779

assign ( resid 36 and name HG1
  )
       ( resid 36 and name HA
  ) 4.9 3.1 1.0 volume=0.078 peak=1432 ppm1=1.656 ppm2=4.259

assign ( resid 41 and name HD1 or resid 41 and name HD2
  )
       ( resid 46 and name HB#
  ) 3.8 2.0 0.8 volume=0.361 peak=77 ppm1=7.180 ppm2=1.412

assign ( resid 50 and name HB1
  )
       ( resid 49 and name HB#
  ) 4.4 2.6 0.9 volume=0.152 peak=1018 ppm1=2.897 ppm2=1.195

assign ( resid 57 and name HB1
  )
       ( resid 57 and name HD1#
  ) 2.7 0.9 0.5 volume=2.591 peak=2098 ppm1=1.453 ppm2=0.704

assign ( resid 46 and name HB#
  )
       ( resid 41 and name HB2
  ) 3.3 1.5 0.7 volume=0.777 peak=1196 ppm1=1.405 ppm2=2.624

assign ( resid 46 and name HB#
  )
       ( resid 41 and name HB1
  ) 3.3 1.5 0.7 volume=0.865 peak=1128 ppm1=1.403 ppm2=2.647

assign ( resid 49 and name HA
  )
       ( resid 52 and name HB2
  or resid 52 and name HB1
  ) 3.4 1.6 0.7 volume=0.667 peak=2160 ppm1=3.863 ppm2=1.757

assign ( resid 50 and name HA
  )
       ( resid 51 and name HN
  ) 5.0 3.2 1.0 volume=0.071 peak=1926 ppm1=4.161 ppm2=8.924

assign ( resid 56 and name HG1
  )
       ( resid 56 and name HD2
  ) 3.4 1.6 0.7 volume=0.741 peak=1297 ppm1=1.794 ppm2=3.635

assign ( resid 34 and name HN
  )
       ( resid 33 and name HA
  ) 3.5 1.7 0.7 volume=0.597 peak=832 ppm1=8.947 ppm2=5.240

assign ( resid 43 and name HN
  )
       ( resid 47 and name HN
  ) 3.8 2.0 0.8 volume=0.374 peak=593 ppm1=7.460 ppm2=7.006

assign ( resid 51 and name HG2
  )
       ( resid 52 and name HN
  ) 4.2 2.4 0.8 volume=0.205 peak=1790 ppm1=3.050 ppm2=7.117

assign ( resid 49 and name HN
  )
       ( resid 49 and name HB#
  ) 2.6 0.8 0.5 volume=3.402 peak=653 ppm1=7.700 ppm2=1.220

assign ( resid 47 and name HN
  )
       ( resid 44 and name HA
  ) 3.9 2.1 0.8 volume=0.299 peak=385 ppm1=6.977 ppm2=3.384

assign ( resid 48 and name HB1
  or resid 48 and name HB2
  )
       ( resid 49 and name HN
  ) 3.2 1.4 0.6 volume=1.078 peak=1721 ppm1=1.648 ppm2=7.702

assign ( resid 57 and name HB1
  )
       ( resid 57 and name HB2
  ) 2.5 0.7 0.5 volume=4.849 peak=2001 ppm1=1.454 ppm2=1.351

assign ( resid 51 and name HN
  )
       ( resid 50 and name HA
  ) 4.5 2.7 0.9 volume=0.127 peak=598 ppm1=8.912 ppm2=4.163

assign ( resid 39 and name HN
  )
       ( resid 39 and name HA
  ) 3.6 1.8 0.7 volume=0.511 peak=137 ppm1=8.184 ppm2=3.791

assign ( resid 34 and name HB1
  )
       ( resid 37 and name HN
  ) 4.2 2.4 0.8 volume=0.183 peak=1824 ppm1=3.310 ppm2=8.361

assign ( resid 52 and name HN
  )
       ( resid 52 and name HG1
  ) 3.3 1.5 0.7 volume=0.803 peak=423 ppm1=7.120 ppm2=1.414

assign ( resid 47 and name HB2
  )
       ( resid 32 and name HB2
  ) 4.1 2.3 0.8 volume=0.215 peak=1354 ppm1=2.189 ppm2=2.839

assign ( resid 41 and name HD1 or resid 41 and name HD2
  )
       ( resid 47 and name HB1
  ) 3.9 2.1 0.8 volume=0.315 peak=46 ppm1=7.183 ppm2=2.839

assign ( resid 44 and name HA
  )
       ( resid 47 and name HN
  ) 4.3 2.5 0.9 volume=0.163 peak=917 ppm1=3.376 ppm2=7.002

assign ( resid 39 and name HB1
  )
       ( resid 39 and name HN
  ) 4.4 2.6 0.9 volume=0.150 peak=1219 ppm1=1.031 ppm2=8.166

assign ( resid 53 and name HN
  )
       ( resid 54 and name HN
  ) 3.5 1.7 0.7 volume=0.603 peak=802 ppm1=7.596 ppm2=6.927

assign ( resid 57 and name HD2#
  )
       ( resid 57 and name HB2
  ) 2.6 0.8 0.5 volume=3.573 peak=1731 ppm1=0.747 ppm2=1.354

assign ( resid 36 and name HA
  )
       ( resid 36 and name HB2
  ) 4.9 3.1 1.0 volume=0.081 peak=2298 ppm1=4.261 ppm2=1.238

assign ( resid 36 and name HB1
  )
       ( resid 36 and name HG1
  ) 3.5 1.7 0.7 volume=0.622 peak=930 ppm1=1.073 ppm2=1.647

assign ( resid 36 and name HB1
  )
       ( resid 36 and name HG2
  ) 3.4 1.6 0.7 volume=0.641 peak=1479 ppm1=1.075 ppm2=1.685

assign ( resid 39 and name HB1
  )
       ( resid 40 and name HN
  ) 4.2 2.4 0.8 volume=0.203 peak=1303 ppm1=1.034 ppm2=7.747

assign ( resid 41 and name HE1 or resid 41 and name HE2
  )
       ( resid 41 and name HD1 or resid 41 and name HD2
  ) 3.3 1.5 0.7 volume=0.877 peak=99 ppm1=6.808 ppm2=7.182

assign ( resid 39 and name HB2
  )
       ( resid 39 and name HB1
  ) 3.1 1.3 0.6 volume=1.135 peak=1282 ppm1=1.517 ppm2=1.037

assign ( resid 51 and name HG1
  )
       ( resid 51 and name HB2
  ) 3.7 1.9 0.7 volume=0.437 peak=1249 ppm1=2.852 ppm2=1.958

assign ( resid 54 and name HN
  )
       ( resid 50 and name HA
  ) 3.9 2.1 0.8 volume=0.298 peak=751 ppm1=6.909 ppm2=4.134

assign ( resid 48 and name HB1
  or resid 48 and name HB2
  )
       ( resid 48 and name HN
  ) 3.2 1.4 0.6 volume=0.974 peak=1513 ppm1=1.648 ppm2=7.729

assign ( resid 34 and name HB1
  )
       ( resid 39 and name HN
  ) 4.3 2.5 0.9 volume=0.163 peak=1665 ppm1=3.305 ppm2=8.171

assign ( resid 47 and name HB1
  )
       ( resid 47 and name HB2
  ) 4.0 2.2 0.8 volume=0.252 peak=1381 ppm1=2.840 ppm2=2.189

assign ( resid 40 and name HB#
  )
       ( resid 34 and name HN
  ) 4.3 2.5 0.9 volume=0.160 peak=1838 ppm1=1.152 ppm2=8.937

assign ( resid 34 and name HB1
  )
       ( resid 34 and name HN
  ) 4.6 2.8 0.9 volume=0.114 peak=1428 ppm1=3.299 ppm2=8.945

assign ( resid 37 and name HB2
  )
       ( resid 37 and name HB1
  ) 3.0 1.2 0.6 volume=1.554 peak=1166 ppm1=3.293 ppm2=2.651

assign ( resid 40 and name HN
  )
       ( resid 39 and name HN
  ) 4.3 2.5 0.9 volume=0.163 peak=120 ppm1=7.752 ppm2=8.176

assign ( resid 52 and name HB2
  )
       ( resid 52 and name HN
  ) 3.3 1.5 0.7 volume=0.790 peak=1483 ppm1=1.760 ppm2=7.119

assign ( resid 50 and name HD2
  )
       ( resid 34 and name HB1
  ) 3.7 1.9 0.7 volume=0.454 peak=22 ppm1=6.609 ppm2=3.309

assign ( resid 37 and name HN
  )
       ( resid 38 and name HA
  ) 3.6 1.8 0.7 volume=0.483 peak=176 ppm1=8.360 ppm2=4.206

assign ( resid 49 and name HB#
  )
       ( resid 50 and name HN
  ) 3.4 1.6 0.7 volume=0.643 peak=1397 ppm1=1.223 ppm2=7.439

assign ( resid 41 and name HN
  )
       ( resid 40 and name HB#
  ) 3.5 1.7 0.7 volume=0.622 peak=457 ppm1=8.776 ppm2=1.144

assign ( resid 37 and name HN
  )
       ( resid 36 and name HA
  ) 3.4 1.6 0.7 volume=0.750 peak=227 ppm1=8.360 ppm2=4.259

assign ( resid 48 and name HN
  )
       ( resid 45 and name HA
  ) 3.2 1.4 0.6 volume=1.056 peak=669 ppm1=7.728 ppm2=3.889

assign ( resid 51 and name HG2
  )
       ( resid 51 and name HA
  ) 4.5 2.7 0.9 volume=0.136 peak=1549 ppm1=3.057 ppm2=3.838

assign ( resid 56 and name HB2
  )
       ( resid 56 and name HD2
  ) 3.4 1.6 0.7 volume=0.718 peak=1161 ppm1=1.673 ppm2=3.626

assign ( resid 50 and name HA
  )
       ( resid 50 and name HB1
  ) 3.8 2.0 0.8 volume=0.364 peak=1062 ppm1=4.155 ppm2=2.902

assign ( resid 36 and name HB1
  )
       ( resid 37 and name HN
  ) 4.4 2.6 0.9 volume=0.138 peak=1764 ppm1=1.079 ppm2=8.362

assign ( resid 50 and name HB1
  )
       ( resid 50 and name HN
  ) 3.8 2.0 0.8 volume=0.380 peak=2221 ppm1=2.901 ppm2=7.445

assign ( resid 36 and name HB2
  )
       ( resid 37 and name HN
  ) 4.3 2.5 0.9 volume=0.179 peak=938 ppm1=1.269 ppm2=8.361

assign ( resid 49 and name HN
  )
       ( resid 48 and name HN
  ) 2.1 0.3 0.4 volume=12.327 peak=128 ppm1=7.702 ppm2=7.733

assign ( resid 36 and name HB2
  )
       ( resid 36 and name HA
  ) 4.8 3.0 1.0 volume=0.085 peak=1994 ppm1=1.263 ppm2=4.258

assign ( resid 56 and name HG2
  )
       ( resid 57 and name HN
  ) 4.4 2.6 0.9 volume=0.139 peak=1608 ppm1=1.848 ppm2=7.976

assign ( resid 49 and name HA
  )
       ( resid 49 and name HB#
  ) 2.4 0.6 0.5 volume=5.077 peak=1070 ppm1=3.869 ppm2=1.222

assign ( resid 56 and name HA
  )
       ( resid 56 and name HB2
  ) 3.7 1.9 0.7 volume=0.450 peak=942 ppm1=4.282 ppm2=1.686

assign ( resid 41 and name HB2
  )
       ( resid 41 and name HD1 or resid 41 and name HD2
  ) 4.2 2.4 0.8 volume=0.185 peak=1266 ppm1=2.608 ppm2=7.166




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